Z4YN00_MOUSE Loading...

F-box protein 6

AlphaFold DB , UniProt , Accession Z4YN00, Species MOUSE (Mus musculus, Mouse), Gene Fbxo6, Length 265 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	56.6	Low	84.7	Confident	232 Å²	232	108.5 Å²	108.5	100%	1.143	56%	0.56	S	S	*	*				0	122.7	0	-76.8	174.6	-173.9	0	0	106.2	H3	M1-H3 PolarHBondContact O-N 3.45Å
2	V	69	Low	85.3	Confident	118 Å²	118	99.6 Å²	99.6	72%	0.715	51%	0.514	S	S	*	.			trans	-75	122.4	177.7	-179.9	0	0	0	0	107.7	E6	V2-E6 WeakPolarHBondContact CA-OE2 3.46Å; V2-E6 HydrophobicContact CG1-CB 4.37Å
3	H	83.5	Confident	85.9	Confident	123 Å²	123	92.5 Å²	92.5	57%	0.569	48%	0.477	S	S	*	.			trans	-80.5	142.8	175.7	-116.8	-81.9	0	0	0	109.3	M1 N5 E6	M1-H3 PolarHBondContact O-N 3.45Å; H3-N5 PolarHBondContact O-N 3.16Å; H3-E6 HydrophobicContact CB-CG 4.01Å; H3-E6 PolarHBondContact N-OE2 2.98Å; H3-E6 WeakPolarHBondContact O-CB 3.42Å; H3-E6 PolarHBondContact O-N 3.18Å
4	I	88.4	Confident	86.3	Confident	77 Å²	77	91.8 Å²	91.8	40%	0.395	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-53.9	-30.6	177.3	-168.6	168.7	0	0	0	112.6	E6 L7 L12 L15 W35	I4-E6 PolarHBondContact O-N 3.16Å; I4-L7 HydrophobicContact CG1-CD1 4.03Å; I4-L7 WeakPolarHBondContact O-CB 3.38Å; I4-L7 WeakPolarHBondContact O-CG 3.38Å; I4-L7 PolarHBondContact O-N 3.45Å; I4-L12 HydrophobicContact CG1-CD2 4.07Å; I4-L15 HydrophobicContact CD1-CD1 4.33Å; I4-W35 HydrophobicContact CD1-CZ2 4.26Å; I4-W35 HydrophobicContact CG2-CZ2 4.18Å
5	N	88.3	Confident	86.8	Confident	64 Å²	64	90.9 Å²	90.9	34%	0.342	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-73	-9	178.9	-62	-22.1	0	0	0	113.9	H3 L7 L34 W35	H3-N5 PolarHBondContact O-N 3.16Å; N5-L7 VanDerWaalsContact C-N 3.35Å; N5-L34 HydrophobicContact CB-CD2 4.1Å; N5-W35 PolarHBondContact OD1-NE1 3.44Å
6	E	89.9	Confident	87.2	Confident	132 Å²	132	85.4 Å²	85.4	62%	0.617	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-89.6	-6.2	175.4	-59	173.6	163.3	0	0	111.7	V2 H3 I4	V2-E6 WeakPolarHBondContact CA-OE2 3.46Å; V2-E6 HydrophobicContact CG1-CB 4.37Å; H3-E6 HydrophobicContact CB-CG 4.01Å; H3-E6 PolarHBondContact N-OE2 2.98Å; H3-E6 WeakPolarHBondContact O-CB 3.42Å; H3-E6 PolarHBondContact O-N 3.18Å; I4-E6 PolarHBondContact O-N 3.16Å
7	L	90	Very high	87.5	Confident	63 Å²	63	80.7 Å²	80.7	33%	0.33	42%	0.415	S	S	.	.	S	Bend	trans	-68.9	148	173.6	-64.7	175.7	0	0	0	110.8	I4 N5 I11 L12 L15	I4-L7 HydrophobicContact CG1-CD1 4.03Å; I4-L7 WeakPolarHBondContact O-CB 3.38Å; I4-L7 WeakPolarHBondContact O-CG 3.38Å; I4-L7 PolarHBondContact O-N 3.45Å; N5-L7 VanDerWaalsContact C-N 3.35Å; L7-I11 HydrophobicContact CB-CB 4.46Å; L7-I11 HydrophobicContact CB-CG2 4.49Å; L7-I11 HydrophobicContact CD1-CG2 4.15Å; L7-L12 HydrophobicContact CB-CD2 4.41Å; L7-L12 HydrophobicContact CB-CG 4.3Å; L7-L15 HydrophobicContact CD1-CD1 4.33Å
8	P	92.7	Very high	87.7	Confident	83 Å²	83	82.8 Å²	82.8	54%	0.539	42%	0.422	S	S	.	.			trans	-55.7	142.9	173.4	-23.1	32.5	0	0	0	111.7	N10 I11 L12	P8-N10 PolarHBondContact O-N 3.08Å; P8-N10 VanDerWaalsContact O-N 3.1Å; P8-I11 HydrophobicContact CB-CG1 4.25Å; P8-I11 HydrophobicContact CG-CG1 4.28Å; P8-I11 WeakPolarHBondContact O-CA 3.21Å; P8-I11 WeakPolarHBondContact O-CB 3.32Å; P8-I11 PolarHBondContact O-N 2.93Å; P8-L12 PolarHBondContact O-N 3.08Å
9	E	91.6	Very high	88	Confident	121 Å²	121	80.5 Å²	80.5	57%	0.565	41%	0.41	S	S	*	.	H	α-helix	trans	-52.4	-38.4	-178.6	-68.3	-176.1	-177.5	0	0	113.1	I11 L12 L13 L38	E9-I11 VanDerWaalsContact C-N 3.28Å; E9-I11 PolarHBondContact O-N 2.99Å; E9-L12 PolarHBondContact O-N 3.5Å; E9-L13 WeakPolarHBondContact O-CG 3.36Å; E9-L13 PolarHBondContact O-N 2.8Å; E9-L38 HydrophobicContact CB-CD2 3.85Å; E9-L38 HydrophobicContact CG-CD2 3.94Å
10	N	90.3	Very high	88.1	Confident	98 Å²	98	80.2 Å²	80.2	52%	0.524	41%	0.414	S	S	.	.	H	α-helix	trans	-60.5	-36.1	176.4	-83.8	-44.6	0	0	0	113	P8 E14 R47	P8-N10 PolarHBondContact O-N 3.08Å; P8-N10 VanDerWaalsContact O-N 3.1Å; N10-E14 WeakPolarHBondContact O-CG 3.37Å; N10-E14 PolarHBondContact O-N 3.24Å; N10-R47 PolarHBondContact OD1-NH2 2.86Å
11	I	91.3	Very high	88.2	Confident	83 Å²	83	76.6 Å²	76.6	43%	0.426	40%	0.396	S	S	.	.	H	α-helix	trans	-71.4	-41	177	-57.3	-58.9	0	0	0	110.1	L7 P8 E9 L13 E14 L15	L7-I11 HydrophobicContact CB-CB 4.46Å; L7-I11 HydrophobicContact CB-CG2 4.49Å; L7-I11 HydrophobicContact CD1-CG2 4.15Å; P8-I11 HydrophobicContact CB-CG1 4.25Å; P8-I11 HydrophobicContact CG-CG1 4.28Å; P8-I11 WeakPolarHBondContact O-CA 3.21Å; P8-I11 WeakPolarHBondContact O-CB 3.32Å; P8-I11 PolarHBondContact O-N 2.93Å; E9-I11 VanDerWaalsContact C-N 3.28Å; E9-I11 PolarHBondContact O-N 2.99Å; I11-L13 VanDerWaalsContact C-N 3.33Å; I11-L13 PolarHBondContact O-N 3.4Å; I11-E14 PolarHBondContact O-N 3.34Å; I11-L15 WeakPolarHBondContact O-CG 3.32Å; I11-L15 PolarHBondContact O-N 2.88Å
12	L	92.3	Very high	89.6	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-61.3	-41.7	174.7	-69	173.3	0	0	0	111.8	I4 L7 P8 E9 L15 F16 L34 L38	I4-L12 HydrophobicContact CG1-CD2 4.07Å; L7-L12 HydrophobicContact CB-CD2 4.41Å; L7-L12 HydrophobicContact CB-CG 4.3Å; P8-L12 PolarHBondContact O-N 3.08Å; E9-L12 PolarHBondContact O-N 3.5Å; L12-L15 HydrophobicContact CD2-CD1 4.46Å; L12-L15 WeakPolarHBondContact O-CB 3.36Å; L12-L15 PolarHBondContact O-N 3.03Å; L12-F16 HydrophobicContact CB-CE2 4.28Å; L12-F16 VanDerWaalsContact O-CD2 3.28Å; L12-F16 WeakPolarHBondContact O-CD2 3.11Å; L12-F16 VanDerWaalsContact O-CG 3.24Å; L12-F16 WeakPolarHBondContact O-CG 3.31Å; L12-F16 PolarHBondContact O-N 2.93Å; L12-L34 HydrophobicContact CD1-CD2 4.02Å; L12-L38 HydrophobicContact CB-CD1 3.72Å; L12-L38 HydrophobicContact CD1-CD1 3.64Å; L12-L38 HydrophobicContact CG-CD1 4.34Å
13	L	92.7	Very high	90.6	Very high	7 Å²	7	68.5 Å²	68.5	4%	0.037	36%	0.355	C	S	.	.	H	α-helix	trans	-60.7	-45.4	173.9	-71.3	172.8	0	0	0	111.6	E9 I11 L15 F16 I17 L38 L44	E9-L13 WeakPolarHBondContact O-CG 3.36Å; E9-L13 PolarHBondContact O-N 2.8Å; I11-L13 VanDerWaalsContact C-N 3.33Å; I11-L13 PolarHBondContact O-N 3.4Å; L13-L15 VanDerWaalsContact C-N 3.31Å; L13-L15 PolarHBondContact O-N 2.83Å; L13-F16 PolarHBondContact O-N 3.11Å; L13-I17 WeakPolarHBondContact O-CG1 3.26Å; L13-I17 PolarHBondContact O-N 3.01Å; L13-L38 HydrophobicContact CD2-CB 4.25Å; L13-L38 HydrophobicContact CD2-CD2 4.29Å; L13-L38 HydrophobicContact CG-CD2 4.3Å; L13-L44 HydrophobicContact CD2-CB 3.95Å; L13-L44 HydrophobicContact CD2-CD1 4.24Å
14	E	92	Very high	91	Very high	83 Å²	83	62.7 Å²	62.7	39%	0.388	33%	0.328	S	S	.	.	H	α-helix	trans	-60.1	-40.9	175.3	-70.5	-53	132.3	0	0	111.8	N10 I11 F16 I17 H18 R47	N10-E14 WeakPolarHBondContact O-CG 3.37Å; N10-E14 PolarHBondContact O-N 3.24Å; I11-E14 PolarHBondContact O-N 3.34Å; E14-F16 PolarHBondContact O-N 2.9Å; E14-I17 WeakPolarHBondContact O-CB 3.49Å; E14-I17 PolarHBondContact O-N 3.4Å; E14-H18 PolarHBondContact O-CD2 3.3Å; E14-R47 IonicContact OE1-CZ 2.77Å; E14-R47 IonicContact OE1-NH1 2.85Å; E14-R47 PolarHBondContact OE1-NH1 2.74Å
15	L	92.9	Very high	91	Very high	79 Å²	79	61.1 Å²	61.1	41%	0.414	32%	0.32	S	S	.	.	H	α-helix	trans	-61.7	-45.4	173.9	-67	174.4	0	0	0	111.9	I4 L7 I11 L12 L13 I17 H18	I4-L15 HydrophobicContact CD1-CD1 4.33Å; L7-L15 HydrophobicContact CD1-CD1 4.33Å; I11-L15 WeakPolarHBondContact O-CG 3.32Å; I11-L15 PolarHBondContact O-N 2.88Å; L12-L15 HydrophobicContact CD2-CD1 4.46Å; L12-L15 WeakPolarHBondContact O-CB 3.36Å; L12-L15 PolarHBondContact O-N 3.03Å; L13-L15 VanDerWaalsContact C-N 3.31Å; L13-L15 PolarHBondContact O-N 2.83Å; L15-I17 VanDerWaalsContact C-N 3.27Å; L15-I17 PolarHBondContact O-N 3.39Å; L15-H18 PolarHBondContact O-N 3.23Å; L15-H18 VanDerWaalsContact O-N 3.13Å
16	F	93.8	Very high	91	Very high	3 Å²	3	67.1 Å²	67.1	1%	0.013	34%	0.338	C	S	.	.	H	α-helix	trans	-65.1	-27.7	179.4	-63.9	-28.7	0	0	0	113.2	L12 L13 E14 H18 I19 L24 W35 L38 I39 L44 K48	L12-F16 HydrophobicContact CB-CE2 4.28Å; L12-F16 VanDerWaalsContact O-CD2 3.28Å; L12-F16 WeakPolarHBondContact O-CD2 3.11Å; L12-F16 VanDerWaalsContact O-CG 3.24Å; L12-F16 WeakPolarHBondContact O-CG 3.31Å; L12-F16 PolarHBondContact O-N 2.93Å; L13-F16 PolarHBondContact O-N 3.11Å; E14-F16 PolarHBondContact O-N 2.9Å; F16-H18 PolarHBondContact O-N 2.69Å; F16-I19 HydrophobicContact CD1-CD1 3.96Å; F16-I19 PolarHBondContact O-N 2.94Å; F16-I19 VanDerWaalsContact O-N 3.1Å; F16-L24 HydrophobicContact CB-CD2 3.84Å; F16-L24 HydrophobicContact CD1-CD2 3.95Å; F16-L24 HydrophobicContact CG-CD2 4.03Å; F16-L24 WeakPolarHBondContact O-CD1 3.39Å; F16-W35 AromaticContact CE1-CD2 3.89Å; F16-W35 HydrophobicContact CE1-CD2 3.89Å; F16-W35 AromaticContact CE1-CE3 3.63Å; F16-W35 HydrophobicContact CE1-CE3 3.63Å; F16-W35 HydrophobicContact CE1-CH2 4.11Å; F16-W35 HydrophobicContact CE1-CZ2 4.35Å; F16-W35 AromaticContact CE1-CZ3 3.74Å; F16-W35 HydrophobicContact CE1-CZ3 3.74Å; F16-W35 HydrophobicContact CZ-CB 4.25Å; F16-W35 AromaticContact CZ-CD2 3.56Å; F16-W35 HydrophobicContact CZ-CD2 3.56Å; F16-W35 AromaticContact CZ-CE2 3.96Å; F16-W35 AromaticContact CZ-CE3 3.76Å; F16-W35 HydrophobicContact CZ-CE3 3.76Å; F16-W35 AromaticContact CZ-CG 3.79Å; F16-W35 HydrophobicContact CZ-CG 3.79Å; F16-W35 HydrophobicContact CZ-CZ2 4.49Å; F16-W35 HydrophobicContact CZ-CZ3 4.3Å; F16-L38 HydrophobicContact CD2-CB 4.34Å; F16-L38 HydrophobicContact CE2-CB 3.87Å; F16-L38 HydrophobicContact CE2-CD1 4.09Å; F16-I39 HydrophobicContact CD2-CG1 4.14Å; F16-I39 HydrophobicContact CE2-CG1 4.25Å; F16-L44 HydrophobicContact CB-CD1 3.7Å; F16-L44 HydrophobicContact CB-CD2 4.14Å; F16-K48 PolarHBondContact O-NZ 3.28Å
17	I	92.8	Very high	91.1	Very high	5 Å²	5	65.7 Å²	65.7	3%	0.026	34%	0.335	C	S	.	.	H	α-helix	trans	-59	-30.2	174.4	-71.3	166	0	0	0	111.7	L13 E14 L15 L44 R47 K48	L13-I17 WeakPolarHBondContact O-CG1 3.26Å; L13-I17 PolarHBondContact O-N 3.01Å; E14-I17 WeakPolarHBondContact O-CB 3.49Å; E14-I17 PolarHBondContact O-N 3.4Å; L15-I17 VanDerWaalsContact C-N 3.27Å; L15-I17 PolarHBondContact O-N 3.39Å; I17-L44 HydrophobicContact CG1-CD1 3.83Å; I17-R47 HydrophobicContact CD1-CB 3.51Å; I17-R47 HydrophobicContact CD1-CG 4.26Å; I17-R47 HydrophobicContact CG1-CB 4.19Å; I17-K48 HydrophobicContact CB-CG 4.21Å; I17-K48 HydrophobicContact CG1-CG 3.96Å; I17-K48 HydrophobicContact CG2-CG 4.2Å; I17-K48 PolarHBondContact O-NZ 3.15Å
18	H	91.4	Very high	91.2	Very high	118 Å²	118	63.1 Å²	63.1	55%	0.546	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-13.2	179.7	-66.1	-77.6	0	0	0	114.4	E14 L15 F16 R51	E14-H18 PolarHBondContact O-CD2 3.3Å; L15-H18 PolarHBondContact O-N 3.23Å; L15-H18 VanDerWaalsContact O-N 3.13Å; F16-H18 PolarHBondContact O-N 2.69Å; H18-R51 PolarHBondContact CE1-NH2 3.47Å; H18-R51 VanDerWaalsContact CE1-NH2 3.35Å; H18-R51 PolarHBondContact ND1-NH1 3.13Å; H18-R51 PolarHBondContact ND1-NH2 3.44Å
19	I	91.9	Very high	91.3	Very high	39 Å²	39	63.3 Å²	63.3	20%	0.2	31%	0.312	C	S	.	.	S	Bend	trans	-87.4	136.6	-178.7	-55.4	-178.9	0	0	0	110	F16 A21 Q23 L24 K48	F16-I19 HydrophobicContact CD1-CD1 3.96Å; F16-I19 PolarHBondContact O-N 2.94Å; F16-I19 VanDerWaalsContact O-N 3.1Å; I19-A21 PolarHBondContact O-N 2.85Å; I19-Q23 HydrophobicContact CG2-CB 3.9Å; I19-Q23 HydrophobicContact CG2-CG 3.9Å; I19-L24 HydrophobicContact CB-CD2 3.78Å; I19-L24 HydrophobicContact CB-CG 3.93Å; I19-L24 HydrophobicContact CD1-CD2 4.11Å; I19-L24 HydrophobicContact CG1-CD2 4.45Å; I19-L24 HydrophobicContact CG2-CD2 3.94Å; I19-L24 HydrophobicContact CG2-CG 3.91Å; I19-K48 PolarHBondContact O-NZ 3.35Å
20	P	90.6	Very high	91.3	Very high	74 Å²	74	63.9 Å²	63.9	48%	0.481	32%	0.318	S	S	.	.			trans	-55.6	137.6	173.9	-25.8	34.8	0	0	0	112.3	P22 Q23 L24	P20-P22 VanDerWaalsContact C-CD 3.48Å; P20-Q23 WeakPolarHBondContact O-CB 3.33Å; P20-Q23 PolarHBondContact O-N 3.46Å; P20-L24 PolarHBondContact O-N 3.45Å
21	A	89.9	Confident	91.5	Very high	6 Å²	6	63.4 Å²	63.4	5%	0.05	32%	0.319	C	S	.	.	H	α-helix	trans	-56.1	-39.9	-177.7	0	0	0	0	0	114.9	I19 Q23 L24 L25 W45 Y70	I19-A21 PolarHBondContact O-N 2.85Å; A21-Q23 PolarHBondContact O-N 2.96Å; A21-L24 PolarHBondContact O-N 3.1Å; A21-L25 WeakPolarHBondContact O-CG 3.28Å; A21-L25 PolarHBondContact O-N 3.23Å; A21-W45 HydrophobicContact CB-CH2 3.96Å; A21-W45 HydrophobicContact CB-CZ3 3.68Å; A21-Y70 HydrophobicContact CB-CD1 4.12Å; A21-Y70 HydrophobicContact CB-CE1 3.41Å; A21-Y70 VanDerWaalsContact CB-CE1 3.41Å
22	P	86.9	Confident	91.7	Very high	86 Å²	86	61.2 Å²	61.2	56%	0.558	31%	0.311	S	S	*	.	H	α-helix	trans	-58.2	-37.7	174.8	-26	35.7	0	0	0	112.9	P20 R26	P20-P22 VanDerWaalsContact C-CD 3.48Å; P22-R26 VanDerWaalsContact O-CB 3.32Å; P22-R26 WeakPolarHBondContact O-CB 3.46Å; P22-R26 WeakPolarHBondContact O-CG 3.48Å; P22-R26 PolarHBondContact O-N 3.32Å
23	Q	89.4	Confident	91.7	Very high	94 Å²	94	70.6 Å²	70.6	44%	0.439	35%	0.346	S	S	.	.	H	α-helix	trans	-73.6	-37.8	178.9	-175	175.2	-3.6	0	0	111.7	I19 P20 A21 L25 N27 C28	I19-Q23 HydrophobicContact CG2-CB 3.9Å; I19-Q23 HydrophobicContact CG2-CG 3.9Å; P20-Q23 WeakPolarHBondContact O-CB 3.33Å; P20-Q23 PolarHBondContact O-N 3.46Å; A21-Q23 PolarHBondContact O-N 2.96Å; Q23-L25 VanDerWaalsContact C-N 3.35Å; Q23-L25 PolarHBondContact O-N 3.17Å; Q23-N27 HydrophobicContact CG-CB 4.41Å; Q23-N27 WeakPolarHBondContact O-CA 3.43Å; Q23-N27 WeakPolarHBondContact O-CB 3.37Å; Q23-N27 PolarHBondContact O-N 3.26Å; Q23-C28 PolarHBondContact O-N 3.2Å; Q23-C28 VanDerWaalsContact O-N 3.08Å
24	L	91.9	Very high	91.7	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-57.9	-49.4	172.6	-73.5	174.1	0	0	0	111.2	F16 I19 P20 A21 C28 R29 I39 L44 W45 K48	F16-L24 HydrophobicContact CB-CD2 3.84Å; F16-L24 HydrophobicContact CD1-CD2 3.95Å; F16-L24 HydrophobicContact CG-CD2 4.03Å; F16-L24 WeakPolarHBondContact O-CD1 3.39Å; I19-L24 HydrophobicContact CB-CD2 3.78Å; I19-L24 HydrophobicContact CB-CG 3.93Å; I19-L24 HydrophobicContact CD1-CD2 4.11Å; I19-L24 HydrophobicContact CG1-CD2 4.45Å; I19-L24 HydrophobicContact CG2-CD2 3.94Å; I19-L24 HydrophobicContact CG2-CG 3.91Å; P20-L24 PolarHBondContact O-N 3.45Å; A21-L24 PolarHBondContact O-N 3.1Å; L24-C28 HydrophobicContact CD2-CB 4.14Å; L24-C28 PolarHBondContact O-N 3.37Å; L24-R29 WeakPolarHBondContact O-CB 3.49Å; L24-R29 PolarHBondContact O-N 2.74Å; L24-I39 HydrophobicContact CD2-CD1 4.19Å; L24-I39 HydrophobicContact CD2-CG1 4.29Å; L24-L44 HydrophobicContact CD1-CD2 4.38Å; L24-W45 HydrophobicContact CD1-CH2 4.47Å; L24-K48 HydrophobicContact CD1-CD 4.17Å
25	L	88.8	Confident	91.8	Very high	44 Å²	44	70.5 Å²	70.5	23%	0.23	35%	0.345	C	S	.	.	H	α-helix	trans	-75.4	-38	-172.5	-65	178.6	0	0	0	113.8	A21 Q23 I39 W45 K67 I71	A21-L25 WeakPolarHBondContact O-CG 3.28Å; A21-L25 PolarHBondContact O-N 3.23Å; Q23-L25 VanDerWaalsContact C-N 3.35Å; Q23-L25 PolarHBondContact O-N 3.17Å; L25-I39 HydrophobicContact CD2-CG2 4.17Å; L25-W45 HydrophobicContact CD1-CH2 4.06Å; L25-W45 HydrophobicContact CD2-CH2 3.85Å; L25-W45 HydrophobicContact CD2-CZ2 3.6Å; L25-W45 HydrophobicContact CG-CH2 3.89Å; L25-W45 HydrophobicContact CG-CZ2 4.18Å; L25-K67 HydrophobicContact CD2-CD 4.19Å; L25-I71 HydrophobicContact CD1-CD1 3.96Å
26	R	87.9	Confident	91.9	Very high	191 Å²	191	71.4 Å²	71.4	72%	0.721	34%	0.343	S	S	*	.	H	α-helix	trans	-88.7	-32.9	-176.7	-65.7	-178.7	176.5	-177.4	0.1	113.4	P22 L30	P22-R26 VanDerWaalsContact O-CB 3.32Å; P22-R26 WeakPolarHBondContact O-CB 3.46Å; P22-R26 WeakPolarHBondContact O-CG 3.48Å; P22-R26 PolarHBondContact O-N 3.32Å; R26-L30 WeakPolarHBondContact O-CD1 3.4Å
27	N	92.5	Very high	91.8	Very high	101 Å²	101	76 Å²	76	54%	0.54	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-59	-170.2	-56.1	1.5	0	0	0	111.1	Q23 R29 L30	Q23-N27 HydrophobicContact CG-CB 4.41Å; Q23-N27 WeakPolarHBondContact O-CA 3.43Å; Q23-N27 WeakPolarHBondContact O-CB 3.37Å; Q23-N27 PolarHBondContact O-N 3.26Å; N27-R29 VanDerWaalsContact C-N 3.32Å; N27-R29 PolarHBondContact O-N 3.27Å; N27-L30 PolarHBondContact O-N 3.34Å; N27-L30 VanDerWaalsContact O-N 3.08Å
28	C	92.4	Very high	91.9	Very high	10 Å²	10	76 Å²	76	7%	0.068	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-64.2	-36.9	-172.7	-58	0	0	0	0	112.5	Q23 L24 L30 V31 W35 I39	Q23-C28 PolarHBondContact O-N 3.2Å; Q23-C28 VanDerWaalsContact O-N 3.08Å; L24-C28 HydrophobicContact CD2-CB 4.14Å; L24-C28 PolarHBondContact O-N 3.37Å; C28-L30 PolarHBondContact O-N 3.28Å; C28-V31 WeakPolarHBondContact O-CB 3.38Å; C28-V31 WeakPolarHBondContact O-CG2 3.49Å; C28-V31 PolarHBondContact O-N 3Å; C28-V31 VanDerWaalsContact O-N 3.16Å; C28-W35 HydrophobicContact CB-CE3 3.81Å; C28-W35 HydrophobicContact CB-CZ3 4.03Å; C28-I39 HydrophobicContact CB-CD1 3.53Å
29	R	93.1	Very high	92	Very high	86 Å²	86	70.4 Å²	70.4	33%	0.325	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-64.3	-17.3	177.3	-161.5	175.3	177	-119.8	-0.5	113.7	L24 N27 R36 I39 D40	L24-R29 WeakPolarHBondContact O-CB 3.49Å; L24-R29 PolarHBondContact O-N 2.74Å; N27-R29 VanDerWaalsContact C-N 3.32Å; N27-R29 PolarHBondContact O-N 3.27Å; R29-R36 HydrophobicContact CG-CB 4.12Å; R29-R36 HydrophobicContact CG-CG 3.79Å; R29-I39 HydrophobicContact CB-CD1 4.15Å; R29-I39 HydrophobicContact CB-CG2 4.42Å; R29-I39 HydrophobicContact CG-CG2 4.36Å; R29-D40 IonicContact CZ-OD1 3.93Å; R29-D40 IonicContact CZ-OD2 2.68Å; R29-D40 VanDerWaalsContact CZ-OD2 3.24Å; R29-D40 VanDerWaalsContact NE-CG 3.3Å; R29-D40 IonicContact NE-OD1 2.79Å; R29-D40 PolarHBondContact NE-OD1 3.33Å; R29-D40 IonicContact NE-OD2 3.71Å; R29-D40 PolarHBondContact NE-OD2 2.86Å; R29-D40 IonicContact NH2-OD1 3.04Å; R29-D40 PolarHBondContact NH2-OD1 2.85Å; R29-D40 IonicContact NH2-OD2 3.61Å; R29-D40 PolarHBondContact NH2-OD2 3.01Å
30	L	93.4	Very high	91.9	Very high	133 Å²	133	71.5 Å²	71.5	70%	0.696	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-95.6	-9.3	178.2	-59.2	-177.8	0	0	0	113.5	R26 N27 C28	R26-L30 WeakPolarHBondContact O-CD1 3.4Å; N27-L30 PolarHBondContact O-N 3.34Å; N27-L30 VanDerWaalsContact O-N 3.08Å; C28-L30 PolarHBondContact O-N 3.28Å
31	V	94.4	Very high	92	Very high	89 Å²	89	70.9 Å²	70.9	54%	0.539	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-52.6	-174.8	173.8	0	0	0	0	111.8	C28 W35	C28-V31 WeakPolarHBondContact O-CB 3.38Å; C28-V31 WeakPolarHBondContact O-CG2 3.49Å; C28-V31 PolarHBondContact O-N 3Å; C28-V31 VanDerWaalsContact O-N 3.16Å; V31-W35 HydrophobicContact CB-CD2 4.15Å; V31-W35 HydrophobicContact CB-CE3 3.97Å; V31-W35 HydrophobicContact CB-CG 4.46Å; V31-W35 HydrophobicContact CG1-CD2 4.15Å; V31-W35 HydrophobicContact CG1-CE3 4.25Å; V31-W35 HydrophobicContact CG2-CE3 3.94Å; V31-W35 HydrophobicContact CG2-CZ3 4.16Å
32	C	93.8	Very high	92.1	Very high	37 Å²	37	74.6 Å²	74.6	25%	0.25	37%	0.365	C	S	.	.			trans	-159.9	173.9	176.8	72.1	0	0	0	0	111.2	W35 R36	C32-W35 PolarHBondContact O-N 3.01Å; C32-R36 PolarHBondContact O-N 3.02Å; C32-R36 VanDerWaalsContact O-N 3.16Å
33	R	93.5	Very high	92.2	Very high	198 Å²	198	72.3 Å²	72.3	75%	0.747	35%	0.351	S	S	*	.	H	α-helix	trans	-61.8	-46.6	179.2	-66.8	-175.9	-178.4	175	-0.7	112.2	W35 R36 D37	R33-W35 VanDerWaalsContact C-N 3.31Å; R33-W35 PolarHBondContact O-N 2.91Å; R33-R36 WeakPolarHBondContact O-CB 3.33Å; R33-R36 PolarHBondContact O-N 3.19Å; R33-R36 VanDerWaalsContact O-N 3.11Å; R33-D37 PolarHBondContact O-N 3.21Å
34	L	93.3	Very high	92.4	Very high	53 Å²	53	67.9 Å²	67.9	28%	0.277	33%	0.33	S	S	.	.	H	α-helix	trans	-53.9	-46.5	177.8	177.5	65.9	0	0	0	112.4	N5 L12 D37 L38	N5-L34 HydrophobicContact CB-CD2 4.1Å; L12-L34 HydrophobicContact CD1-CD2 4.02Å; L34-D37 PolarHBondContact O-N 3.03Å; L34-L38 HydrophobicContact CD1-CD1 4.09Å; L34-L38 HydrophobicContact CD1-CG 4.34Å; L34-L38 HydrophobicContact CG-CD1 4.13Å; L34-L38 WeakPolarHBondContact O-CB 3.47Å; L34-L38 WeakPolarHBondContact O-CG 3.36Å; L34-L38 PolarHBondContact O-N 3.28Å
35	W	94.3	Very high	92.4	Very high	34 Å²	34	68 Å²	68	13%	0.129	33%	0.331	C	S	.	.	H	α-helix	trans	-67.5	-39.5	-179.4	-74.9	37.2	0	0	0	111.6	I4 N5 F16 C28 V31 C32 R33 I39	I4-W35 HydrophobicContact CD1-CZ2 4.26Å; I4-W35 HydrophobicContact CG2-CZ2 4.18Å; N5-W35 PolarHBondContact OD1-NE1 3.44Å; F16-W35 AromaticContact CE1-CD2 3.89Å; F16-W35 HydrophobicContact CE1-CD2 3.89Å; F16-W35 AromaticContact CE1-CE3 3.63Å; F16-W35 HydrophobicContact CE1-CE3 3.63Å; F16-W35 HydrophobicContact CE1-CH2 4.11Å; F16-W35 HydrophobicContact CE1-CZ2 4.35Å; F16-W35 AromaticContact CE1-CZ3 3.74Å; F16-W35 HydrophobicContact CE1-CZ3 3.74Å; F16-W35 HydrophobicContact CZ-CB 4.25Å; F16-W35 AromaticContact CZ-CD2 3.56Å; F16-W35 HydrophobicContact CZ-CD2 3.56Å; F16-W35 AromaticContact CZ-CE2 3.96Å; F16-W35 AromaticContact CZ-CE3 3.76Å; F16-W35 HydrophobicContact CZ-CE3 3.76Å; F16-W35 AromaticContact CZ-CG 3.79Å; F16-W35 HydrophobicContact CZ-CG 3.79Å; F16-W35 HydrophobicContact CZ-CZ2 4.49Å; F16-W35 HydrophobicContact CZ-CZ3 4.3Å; C28-W35 HydrophobicContact CB-CE3 3.81Å; C28-W35 HydrophobicContact CB-CZ3 4.03Å; V31-W35 HydrophobicContact CB-CD2 4.15Å; V31-W35 HydrophobicContact CB-CE3 3.97Å; V31-W35 HydrophobicContact CB-CG 4.46Å; V31-W35 HydrophobicContact CG1-CD2 4.15Å; V31-W35 HydrophobicContact CG1-CE3 4.25Å; V31-W35 HydrophobicContact CG2-CE3 3.94Å; V31-W35 HydrophobicContact CG2-CZ3 4.16Å; C32-W35 PolarHBondContact O-N 3.01Å; R33-W35 VanDerWaalsContact C-N 3.31Å; R33-W35 PolarHBondContact O-N 2.91Å; W35-I39 VanDerWaalsContact O-CB 3.26Å; W35-I39 WeakPolarHBondContact O-CB 3.28Å; W35-I39 VanDerWaalsContact O-CD1 3.31Å; W35-I39 WeakPolarHBondContact O-CD1 3.32Å; W35-I39 WeakPolarHBondContact O-CG1 3.24Å; W35-I39 PolarHBondContact O-N 3.31Å
36	R	93.3	Very high	92.5	Very high	99 Å²	99	70.2 Å²	70.2	37%	0.374	34%	0.339	S	S	.	.	H	α-helix	trans	-58.8	-50.6	174.5	-178.9	-170.3	-54.1	154.2	1.5	111.3	R29 C32 R33 L38 I39 D40	R29-R36 HydrophobicContact CG-CB 4.12Å; R29-R36 HydrophobicContact CG-CG 3.79Å; C32-R36 PolarHBondContact O-N 3.02Å; C32-R36 VanDerWaalsContact O-N 3.16Å; R33-R36 WeakPolarHBondContact O-CB 3.33Å; R33-R36 PolarHBondContact O-N 3.19Å; R33-R36 VanDerWaalsContact O-N 3.11Å; R36-L38 VanDerWaalsContact C-N 3.34Å; R36-L38 PolarHBondContact O-N 3.44Å; R36-I39 PolarHBondContact O-N 3.01Å; R36-D40 PolarHBondContact O-N 2.86Å
37	D	93.5	Very high	92.6	Very high	98 Å²	98	64.9 Å²	64.9	52%	0.524	32%	0.318	S	S	.	.	H	α-helix	trans	-62.2	-44.8	-176.3	-59.5	-22.6	0	0	0	110	R33 L34 I39 D40 V41	R33-D37 PolarHBondContact O-N 3.21Å; L34-D37 PolarHBondContact O-N 3.03Å; D37-I39 PolarHBondContact O-N 3.19Å; D37-D40 PolarHBondContact O-N 3.21Å; D37-V41 VanDerWaalsContact O-CG2 3.28Å; D37-V41 WeakPolarHBondContact O-CG2 3.41Å; D37-V41 PolarHBondContact O-N 3.1Å
38	L	93.1	Very high	92.6	Very high	6 Å²	6	60.1 Å²	60.1	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-65.5	-35.6	175.4	-69.5	175.8	0	0	0	113.8	E9 L12 L13 F16 L34 R36 D40 V41	E9-L38 HydrophobicContact CB-CD2 3.85Å; E9-L38 HydrophobicContact CG-CD2 3.94Å; L12-L38 HydrophobicContact CB-CD1 3.72Å; L12-L38 HydrophobicContact CD1-CD1 3.64Å; L12-L38 HydrophobicContact CG-CD1 4.34Å; L13-L38 HydrophobicContact CD2-CB 4.25Å; L13-L38 HydrophobicContact CD2-CD2 4.29Å; L13-L38 HydrophobicContact CG-CD2 4.3Å; F16-L38 HydrophobicContact CD2-CB 4.34Å; F16-L38 HydrophobicContact CE2-CB 3.87Å; F16-L38 HydrophobicContact CE2-CD1 4.09Å; L34-L38 HydrophobicContact CD1-CD1 4.09Å; L34-L38 HydrophobicContact CD1-CG 4.34Å; L34-L38 HydrophobicContact CG-CD1 4.13Å; L34-L38 WeakPolarHBondContact O-CB 3.47Å; L34-L38 WeakPolarHBondContact O-CG 3.36Å; L34-L38 PolarHBondContact O-N 3.28Å; R36-L38 VanDerWaalsContact C-N 3.34Å; R36-L38 PolarHBondContact O-N 3.44Å; L38-D40 VanDerWaalsContact C-N 3.33Å; L38-V41 PolarHBondContact O-N 3.01Å
39	I	93.3	Very high	92.4	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-71.3	-31	178.1	-72.6	165.3	0	0	0	111.5	F16 L24 L25 C28 R29 W35 R36 D37 V41 L44 W45	F16-I39 HydrophobicContact CD2-CG1 4.14Å; F16-I39 HydrophobicContact CE2-CG1 4.25Å; L24-I39 HydrophobicContact CD2-CD1 4.19Å; L24-I39 HydrophobicContact CD2-CG1 4.29Å; L25-I39 HydrophobicContact CD2-CG2 4.17Å; C28-I39 HydrophobicContact CB-CD1 3.53Å; R29-I39 HydrophobicContact CB-CD1 4.15Å; R29-I39 HydrophobicContact CB-CG2 4.42Å; R29-I39 HydrophobicContact CG-CG2 4.36Å; W35-I39 VanDerWaalsContact O-CB 3.26Å; W35-I39 WeakPolarHBondContact O-CB 3.28Å; W35-I39 VanDerWaalsContact O-CD1 3.31Å; W35-I39 WeakPolarHBondContact O-CD1 3.32Å; W35-I39 WeakPolarHBondContact O-CG1 3.24Å; W35-I39 PolarHBondContact O-N 3.31Å; R36-I39 PolarHBondContact O-N 3.01Å; D37-I39 PolarHBondContact O-N 3.19Å; I39-V41 VanDerWaalsContact C-N 3.33Å; I39-L44 HydrophobicContact CB-CD2 4.41Å; I39-L44 HydrophobicContact CG1-CD2 4.29Å; I39-W45 HydrophobicContact CG2-CZ2 4.24Å; I39-W45 PolarHBondContact O-NE1 3.35Å
40	D	91.3	Very high	92.2	Very high	63 Å²	63	58.6 Å²	58.6	34%	0.337	29%	0.29	S	S	.	.	H	α-helix	trans	-85.9	-6.6	179.2	-67.7	-29.2	0	0	0	113	R29 R36 D37 L38 K67	R29-D40 IonicContact CZ-OD1 3.93Å; R29-D40 IonicContact CZ-OD2 2.68Å; R29-D40 VanDerWaalsContact CZ-OD2 3.24Å; R29-D40 VanDerWaalsContact NE-CG 3.3Å; R29-D40 IonicContact NE-OD1 2.79Å; R29-D40 PolarHBondContact NE-OD1 3.33Å; R29-D40 IonicContact NE-OD2 3.71Å; R29-D40 PolarHBondContact NE-OD2 2.86Å; R29-D40 IonicContact NH2-OD1 3.04Å; R29-D40 PolarHBondContact NH2-OD1 2.85Å; R29-D40 IonicContact NH2-OD2 3.61Å; R29-D40 PolarHBondContact NH2-OD2 3.01Å; R36-D40 PolarHBondContact O-N 2.86Å; D37-D40 PolarHBondContact O-N 3.21Å; L38-D40 VanDerWaalsContact C-N 3.33Å; D40-K67 IonicContact OD1-NZ 3.1Å
41	V	92.6	Very high	92	Very high	61 Å²	61	59.2 Å²	59.2	37%	0.37	28%	0.283	S	S	.	.	S	Bend	trans	-69.7	133.7	174.7	166.4	0	0	0	0	111.6	D37 L38 I39 S43 L44	D37-V41 VanDerWaalsContact O-CG2 3.28Å; D37-V41 WeakPolarHBondContact O-CG2 3.41Å; D37-V41 PolarHBondContact O-N 3.1Å; L38-V41 PolarHBondContact O-N 3.01Å; I39-V41 VanDerWaalsContact C-N 3.33Å; V41-S43 VanDerWaalsContact C-N 3.26Å; V41-S43 WeakPolarHBondContact CG1-OG 3.49Å; V41-S43 PolarHBondContact O-N 3.13Å; V41-L44 WeakPolarHBondContact O-CB 3.5Å; V41-L44 PolarHBondContact O-N 3.44Å
42	V	90.9	Very high	91.6	Very high	83 Å²	83	58.8 Å²	58.8	50%	0.503	28%	0.275	S	S	.	.	H	α-helix	trans	-53.8	-38.9	178.2	170.4	0	0	0	0	113.3	L44 W45 K46 W66	V42-L44 PolarHBondContact O-N 2.76Å; V42-W45 PolarHBondContact O-N 3.46Å; V42-K46 WeakPolarHBondContact O-CB 3.44Å; V42-K46 PolarHBondContact O-N 2.85Å; V42-W66 HydrophobicContact CG1-CB 4.24Å; V42-W66 HydrophobicContact CG1-CG 3.78Å
43	S	90.6	Very high	91.2	Very high	39 Å²	39	59.5 Å²	59.5	27%	0.273	29%	0.289	S	S	.	.	H	α-helix	trans	-61.4	-31.7	-175.7	72.4	0	0	0	0	112.7	V41 R47	V41-S43 VanDerWaalsContact C-N 3.26Å; V41-S43 WeakPolarHBondContact CG1-OG 3.49Å; V41-S43 PolarHBondContact O-N 3.13Å; S43-R47 WeakPolarHBondContact O-CB 3.48Å; S43-R47 VanDerWaalsContact O-CG 3.24Å; S43-R47 WeakPolarHBondContact O-CG 3.29Å; S43-R47 PolarHBondContact O-N 3.25Å
44	L	93.3	Very high	90.6	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-56.6	176.5	179.4	60.2	0	0	0	110.9	L13 F16 I17 L24 I39 V41 V42 K46 R47 K48	L13-L44 HydrophobicContact CD2-CB 3.95Å; L13-L44 HydrophobicContact CD2-CD1 4.24Å; F16-L44 HydrophobicContact CB-CD1 3.7Å; F16-L44 HydrophobicContact CB-CD2 4.14Å; I17-L44 HydrophobicContact CG1-CD1 3.83Å; L24-L44 HydrophobicContact CD1-CD2 4.38Å; I39-L44 HydrophobicContact CB-CD2 4.41Å; I39-L44 HydrophobicContact CG1-CD2 4.29Å; V41-L44 WeakPolarHBondContact O-CB 3.5Å; V41-L44 PolarHBondContact O-N 3.44Å; V42-L44 PolarHBondContact O-N 2.76Å; L44-K46 VanDerWaalsContact C-N 3.33Å; L44-K46 PolarHBondContact O-N 3.23Å; L44-R47 PolarHBondContact O-N 3.22Å; L44-K48 HydrophobicContact CD1-CD 4.32Å; L44-K48 HydrophobicContact CD1-CG 4.44Å; L44-K48 HydrophobicContact CG-CD 4.3Å; L44-K48 WeakPolarHBondContact O-CG 3.35Å; L44-K48 PolarHBondContact O-N 3.18Å
45	W	92.4	Very high	89.9	Confident	2 Å²	2	51 Å²	51	1%	0.008	26%	0.255	C	S	.	.	H	α-helix	trans	-67.3	-34.3	-175.9	-60	98.7	0	0	0	112.4	A21 L24 L25 I39 V42 K48 S49 W66 K67 Y70	A21-W45 HydrophobicContact CB-CH2 3.96Å; A21-W45 HydrophobicContact CB-CZ3 3.68Å; L24-W45 HydrophobicContact CD1-CH2 4.47Å; L25-W45 HydrophobicContact CD1-CH2 4.06Å; L25-W45 HydrophobicContact CD2-CH2 3.85Å; L25-W45 HydrophobicContact CD2-CZ2 3.6Å; L25-W45 HydrophobicContact CG-CH2 3.89Å; L25-W45 HydrophobicContact CG-CZ2 4.18Å; I39-W45 HydrophobicContact CG2-CZ2 4.24Å; I39-W45 PolarHBondContact O-NE1 3.35Å; V42-W45 PolarHBondContact O-N 3.46Å; W45-K48 HydrophobicContact CE3-CD 4.4Å; W45-S49 VanDerWaalsContact O-CB 3.31Å; W45-S49 WeakPolarHBondContact O-CB 3.36Å; W45-S49 PolarHBondContact O-N 2.91Å; W45-S49 PolarHBondContact O-OG 2.8Å; W45-W66 HydrophobicContact CB-CB 3.8Å; W45-K67 HydrophobicContact CD2-CB 3.82Å; W45-K67 HydrophobicContact CD2-CG 3.99Å; W45-K67 HydrophobicContact CE3-CB 4.49Å; W45-K67 HydrophobicContact CE3-CG 4.41Å; W45-K67 HydrophobicContact CG-CB 3.81Å; W45-K67 HydrophobicContact CG-CG 4.48Å; W45-K67 HydrophobicContact CH2-CG 4.35Å; W45-K67 HydrophobicContact CZ2-CD 4.07Å; W45-K67 HydrophobicContact CZ2-CG 3.93Å; W45-Y70 AromaticContact CE3-CD1 3.63Å; W45-Y70 HydrophobicContact CE3-CD1 3.63Å; W45-Y70 HydrophobicContact CE3-CE1 4.36Å; W45-Y70 AromaticContact CE3-CG 3.76Å; W45-Y70 HydrophobicContact CE3-CG 3.76Å; W45-Y70 AromaticContact CZ3-CD1 3.56Å; W45-Y70 HydrophobicContact CZ3-CD1 3.56Å; W45-Y70 AromaticContact CZ3-CE1 3.99Å; W45-Y70 HydrophobicContact CZ3-CE1 3.99Å; W45-Y70 HydrophobicContact CZ3-CG 4.18Å
46	K	89.9	Confident	88.6	Confident	92 Å²	92	52.6 Å²	52.6	40%	0.4	27%	0.269	S	S	.	.	H	α-helix	trans	-62.6	-47.1	171.5	-175.6	171.5	-174.2	176.5	0	112.1	V42 L44 S49 L50 W66	V42-K46 WeakPolarHBondContact O-CB 3.44Å; V42-K46 PolarHBondContact O-N 2.85Å; L44-K46 VanDerWaalsContact C-N 3.33Å; L44-K46 PolarHBondContact O-N 3.23Å; K46-S49 PolarHBondContact O-N 2.93Å; K46-L50 HydrophobicContact CG-CD1 4.33Å; K46-L50 WeakPolarHBondContact O-CG 3.21Å; K46-L50 PolarHBondContact O-N 3.33Å; K46-W66 HydrophobicContact CB-CD2 3.82Å; K46-W66 HydrophobicContact CB-CE3 3.77Å; K46-W66 HydrophobicContact CB-CG 4.39Å; K46-W66 HydrophobicContact CB-CH2 4.42Å; K46-W66 HydrophobicContact CB-CZ2 4.47Å; K46-W66 HydrophobicContact CB-CZ3 4.09Å; K46-W66 HydrophobicContact CD-CH2 4.05Å; K46-W66 HydrophobicContact CD-CZ2 3.77Å; K46-W66 HydrophobicContact CG-CD2 4.18Å; K46-W66 HydrophobicContact CG-CE3 4.01Å; K46-W66 HydrophobicContact CG-CH2 3.75Å; K46-W66 HydrophobicContact CG-CZ2 3.93Å; K46-W66 HydrophobicContact CG-CZ3 3.79Å
47	R	89.9	Confident	87	Confident	78 Å²	78	56.5 Å²	56.5	29%	0.294	29%	0.288	S	S	.	.	H	α-helix	trans	-65	-41.2	177.4	-71.4	178.7	-167.3	-177.3	12.7	111.8	N10 E14 I17 S43 L44 L50 R51	N10-R47 PolarHBondContact OD1-NH2 2.86Å; E14-R47 IonicContact OE1-CZ 2.77Å; E14-R47 IonicContact OE1-NH1 2.85Å; E14-R47 PolarHBondContact OE1-NH1 2.74Å; I17-R47 HydrophobicContact CD1-CB 3.51Å; I17-R47 HydrophobicContact CD1-CG 4.26Å; I17-R47 HydrophobicContact CG1-CB 4.19Å; S43-R47 WeakPolarHBondContact O-CB 3.48Å; S43-R47 VanDerWaalsContact O-CG 3.24Å; S43-R47 WeakPolarHBondContact O-CG 3.29Å; S43-R47 PolarHBondContact O-N 3.25Å; L44-R47 PolarHBondContact O-N 3.22Å; R47-L50 PolarHBondContact O-N 2.85Å; R47-R51 WeakPolarHBondContact O-CB 3.31Å; R47-R51 PolarHBondContact O-N 2.73Å
48	K	92.3	Very high	85.3	Confident	2 Å²	2	59 Å²	59	1%	0.009	30%	0.302	C	S	.	.	H	α-helix	trans	-60.4	-46.1	173.7	-69.5	-178	77.4	75.7	0	111.8	F16 I17 I19 L24 L44 W45 L50 R51 E52 Y70	F16-K48 PolarHBondContact O-NZ 3.28Å; I17-K48 HydrophobicContact CB-CG 4.21Å; I17-K48 HydrophobicContact CG1-CG 3.96Å; I17-K48 HydrophobicContact CG2-CG 4.2Å; I17-K48 PolarHBondContact O-NZ 3.15Å; I19-K48 PolarHBondContact O-NZ 3.35Å; L24-K48 HydrophobicContact CD1-CD 4.17Å; L44-K48 HydrophobicContact CD1-CD 4.32Å; L44-K48 HydrophobicContact CD1-CG 4.44Å; L44-K48 HydrophobicContact CG-CD 4.3Å; L44-K48 WeakPolarHBondContact O-CG 3.35Å; L44-K48 PolarHBondContact O-N 3.18Å; W45-K48 HydrophobicContact CE3-CD 4.4Å; K48-L50 VanDerWaalsContact C-N 3.34Å; K48-L50 PolarHBondContact O-N 3.24Å; K48-R51 PolarHBondContact O-N 3.07Å; K48-E52 PolarHBondContact O-N 3.35Å; K48-Y70 HydrophobicContact CB-CD2 3.91Å; K48-Y70 HydrophobicContact CB-CE2 3.62Å
49	S	89.2	Confident	83.7	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.8	-39.1	178.2	-58.8	0	0	0	0	112.8	W45 K46 G53 F54 F55	W45-S49 VanDerWaalsContact O-CB 3.31Å; W45-S49 WeakPolarHBondContact O-CB 3.36Å; W45-S49 PolarHBondContact O-N 2.91Å; W45-S49 PolarHBondContact O-OG 2.8Å; K46-S49 PolarHBondContact O-N 2.93Å; S49-G53 PolarHBondContact O-N 3.19Å; S49-F54 PolarHBondContact O-N 2.77Å; S49-F55 PolarHBondContact O-N 3.01Å
50	L	88.4	Confident	81.7	Confident	63 Å²	63	69.8 Å²	69.8	33%	0.33	36%	0.361	S	S	.	.	H	α-helix	trans	-66.1	-43.5	174	-76.8	165.2	0	0	0	111.8	K46 R47 K48 E52 G53 F55 K57	K46-L50 HydrophobicContact CG-CD1 4.33Å; K46-L50 WeakPolarHBondContact O-CG 3.21Å; K46-L50 PolarHBondContact O-N 3.33Å; R47-L50 PolarHBondContact O-N 2.85Å; K48-L50 VanDerWaalsContact C-N 3.34Å; K48-L50 PolarHBondContact O-N 3.24Å; L50-E52 PolarHBondContact O-N 2.72Å; L50-G53 PolarHBondContact O-N 3.13Å; L50-F55 HydrophobicContact CD2-CD1 3.88Å; L50-F55 HydrophobicContact CG-CD1 4.43Å; L50-K57 HydrophobicContact CD2-CG 4.24Å
51	R	88	Confident	80.4	Confident	147 Å²	147	68.9 Å²	68.9	56%	0.555	36%	0.355	S	S	*	.	H	α-helix	trans	-65.8	-38	-178.3	-176.1	177.1	-179.5	-117.4	-8.2	112.5	H18 R47 K48 G53	H18-R51 PolarHBondContact CE1-NH2 3.47Å; H18-R51 VanDerWaalsContact CE1-NH2 3.35Å; H18-R51 PolarHBondContact ND1-NH1 3.13Å; H18-R51 PolarHBondContact ND1-NH2 3.44Å; R47-R51 WeakPolarHBondContact O-CB 3.31Å; R47-R51 PolarHBondContact O-N 2.73Å; K48-R51 PolarHBondContact O-N 3.07Å; R51-G53 VanDerWaalsContact C-N 3.3Å
52	E	87	Confident	79.4	Confident	79 Å²	79	70.2 Å²	70.2	37%	0.369	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	0.2	179.9	-67.6	175.5	-147	0	0	112.9	K48 L50 F54 Y70	K48-E52 PolarHBondContact O-N 3.35Å; L50-E52 PolarHBondContact O-N 2.72Å; E52-F54 VanDerWaalsContact C-N 3.3Å; E52-F54 HydrophobicContact CB-CD2 4.01Å; E52-F54 HydrophobicContact CB-CE1 4.5Å; E52-F54 HydrophobicContact CB-CE2 3.78Å; E52-F54 HydrophobicContact CB-CG 4.45Å; E52-F54 HydrophobicContact CB-CZ 4.03Å; E52-F54 PolarHBondContact O-N 3.1Å; E52-F54 WeakPolarHBondContact OE2-CE2 3.17Å; E52-F54 WeakPolarHBondContact OE2-CZ 3.38Å; E52-Y70 PolarHBondContact OE1-OH 3.18Å; E52-Y70 WeakPolarHBondContact OE2-CE2 3.27Å; E52-Y70 PolarHBondContact OE2-OH 3.19Å
53	G	84.5	Confident	78.8	Confident	52 Å²	52	67.8 Å²	67.8	54%	0.536	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	9.6	176.1	0	0	0	0	0	114.9	S49 L50 R51 F55	S49-G53 PolarHBondContact O-N 3.19Å; L50-G53 PolarHBondContact O-N 3.13Å; R51-G53 VanDerWaalsContact C-N 3.3Å; G53-F55 VanDerWaalsContact C-N 3.28Å; G53-F55 PolarHBondContact O-N 3.32Å
54	F	82.3	Confident	78.3	Confident	53 Å²	53	72.2 Å²	72.2	23%	0.232	37%	0.367	C	S	.	.	S	Bend	trans	-69.3	-28	176.3	-58.8	-34.4	0	0	0	112.9	S49 E52 R59 F69 Y70 C73	S49-F54 PolarHBondContact O-N 2.77Å; E52-F54 VanDerWaalsContact C-N 3.3Å; E52-F54 HydrophobicContact CB-CD2 4.01Å; E52-F54 HydrophobicContact CB-CE1 4.5Å; E52-F54 HydrophobicContact CB-CE2 3.78Å; E52-F54 HydrophobicContact CB-CG 4.45Å; E52-F54 HydrophobicContact CB-CZ 4.03Å; E52-F54 PolarHBondContact O-N 3.1Å; E52-F54 WeakPolarHBondContact OE2-CE2 3.17Å; E52-F54 WeakPolarHBondContact OE2-CZ 3.38Å; F54-R59 PolarHBondContact O-NH1 3.33Å; F54-F69 HydrophobicContact CB-CE1 4.24Å; F54-Y70 AromaticContact CD2-CD2 3.99Å; F54-Y70 HydrophobicContact CD2-CD2 3.99Å; F54-Y70 HydrophobicContact CD2-CE2 4.09Å; F54-Y70 HydrophobicContact CE2-CD2 4.14Å; F54-Y70 AromaticContact CE2-CE2 3.85Å; F54-Y70 HydrophobicContact CE2-CE2 3.85Å; F54-C73 HydrophobicContact CB-CB 3.9Å; F54-C73 HydrophobicContact CD1-CB 3.97Å; F54-C73 HydrophobicContact CD2-CB 3.82Å; F54-C73 HydrophobicContact CE1-CB 4.47Å; F54-C73 HydrophobicContact CE2-CB 4.33Å; F54-C73 HydrophobicContact CG-CB 3.64Å
55	F	77	Confident	78	Confident	20 Å²	20	75.8 Å²	75.8	9%	0.088	39%	0.385	C	S	.	.			trans	-126.4	135.2	177.9	-168.7	-92.5	0	0	0	110.1	S49 L50 G53 R59 V63 W66 F69	S49-F55 PolarHBondContact O-N 3.01Å; L50-F55 HydrophobicContact CD2-CD1 3.88Å; L50-F55 HydrophobicContact CG-CD1 4.43Å; G53-F55 VanDerWaalsContact C-N 3.28Å; G53-F55 PolarHBondContact O-N 3.32Å; F55-R59 HydrophobicContact CD2-CB 4.39Å; F55-R59 HydrophobicContact CE2-CB 3.8Å; F55-R59 HydrophobicContact CZ-CB 3.93Å; F55-R59 WeakPolarHBondContact CZ-O 3.02Å; F55-V63 HydrophobicContact CE2-CG2 4.22Å; F55-W66 HydrophobicContact CB-CZ3 4.22Å; F55-W66 AromaticContact CD1-CH2 3.9Å; F55-W66 HydrophobicContact CD1-CH2 3.9Å; F55-W66 HydrophobicContact CD1-CZ3 4.31Å; F55-W66 AromaticContact CD2-CH2 3.67Å; F55-W66 HydrophobicContact CD2-CH2 3.67Å; F55-W66 AromaticContact CD2-CZ3 3.91Å; F55-W66 HydrophobicContact CD2-CZ3 3.91Å; F55-W66 AromaticContact CE1-CH2 3.92Å; F55-W66 HydrophobicContact CE1-CH2 3.92Å; F55-W66 AromaticContact CE2-CH2 3.68Å; F55-W66 HydrophobicContact CE2-CH2 3.68Å; F55-W66 HydrophobicContact CE2-CZ3 4.38Å; F55-W66 AromaticContact CG-CH2 3.79Å; F55-W66 HydrophobicContact CG-CH2 3.79Å; F55-W66 AromaticContact CG-CZ3 3.88Å; F55-W66 HydrophobicContact CG-CZ3 3.88Å; F55-W66 AromaticContact CZ-CH2 3.82Å; F55-W66 HydrophobicContact CZ-CH2 3.82Å; F55-F69 HydrophobicContact CB-CE1 4.24Å; F55-F69 HydrophobicContact CB-CZ 4.45Å; F55-F69 HydrophobicContact CD2-CE1 4.48Å; F55-F69 HydrophobicContact CD2-CZ 4.21Å
56	T	68.4	Low	77.8	Confident	67 Å²	67	77 Å²	77	41%	0.411	39%	0.39	S	S	.	.			trans	-111.2	147.7	170.7	54.8	0	0	0	0	109.4	D58 R59	T56-D58 PolarHBondContact O-N 3.3Å; T56-R59 WeakPolarHBondContact O-CB 3.13Å; T56-R59 PolarHBondContact O-N 3.2Å
57	K	59.8	Low	77.7	Confident	181 Å²	181	74.8 Å²	74.8	79%	0.787	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.7	-177.9	-72.8	-177.3	178.7	177.6	0	113.4	L50 R59	L50-K57 HydrophobicContact CD2-CG 4.24Å; K57-R59 VanDerWaalsContact C-N 3.3Å
58	D	57.8	Low	77.6	Confident	151 Å²	151	72.1 Å²	72.1	81%	0.807	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-5.9	179.9	-47	-43.8	0	0	0	113	T56 C60	T56-D58 PolarHBondContact O-N 3.3Å; D58-C60 PolarHBondContact O-N 2.93Å
59	R	59.5	Low	77.5	Confident	99 Å²	99	72.7 Å²	72.7	37%	0.374	38%	0.375	S	S	.	.			trans	-79.1	116.4	174.1	-74.9	-174.8	179.8	-174.1	3.4	110.3	F54 F55 T56 K57 E61	F54-R59 PolarHBondContact O-NH1 3.33Å; F55-R59 HydrophobicContact CD2-CB 4.39Å; F55-R59 HydrophobicContact CE2-CB 3.8Å; F55-R59 HydrophobicContact CZ-CB 3.93Å; F55-R59 WeakPolarHBondContact CZ-O 3.02Å; T56-R59 WeakPolarHBondContact O-CB 3.13Å; T56-R59 PolarHBondContact O-N 3.2Å; K57-R59 VanDerWaalsContact C-N 3.3Å; R59-E61 VanDerWaalsContact C-N 3.34Å
60	C	50.8	Low	77.6	Confident	133 Å²	133	73.2 Å²	73.2	90%	0.899	38%	0.377	S	S	*	.			trans	-94.2	17	177.6	-139	0	0	0	0	113	D58	D58-C60 PolarHBondContact O-N 2.93Å
61	E	64.5	Low	77.6	Confident	44 Å²	44	72 Å²	72	21%	0.206	37%	0.371	C	S	.	.			trans	-81.9	125.8	179.1	-68.5	176.5	-164.8	0	0	109.6	R59 V63 R251 P258	R59-E61 VanDerWaalsContact C-N 3.34Å; E61-V63 PolarHBondContact O-N 2.94Å; E61-R251 IonicContact OE1-CZ 3.74Å; E61-R251 IonicContact OE1-NH2 3.06Å; E61-R251 PolarHBondContact OE1-NH2 3.48Å; E61-P258 VanDerWaalsContact OE1-CD 3.26Å; E61-P258 WeakPolarHBondContact OE1-CD 3.18Å
62	P	70.5	Confident	77.8	Confident	89 Å²	89	65 Å²	65	58%	0.578	34%	0.344	S	S	*	.			trans	-68.7	120.6	176.7	27	-31.2	0	0	0	109.9	N255	P62-N255 PolarHBondContact O-ND2 3.49Å
63	V	79.7	Confident	77.9	Confident	32 Å²	32	61.8 Å²	61.8	19%	0.194	33%	0.33	C	S	.	.			trans	-90.7	113.1	174.3	-179.5	0	0	0	0	108.6	F55 E61 W66 F69	F55-V63 HydrophobicContact CE2-CG2 4.22Å; E61-V63 PolarHBondContact O-N 2.94Å; V63-W66 HydrophobicContact CB-CD2 4.11Å; V63-W66 HydrophobicContact CB-CG 4.48Å; V63-W66 HydrophobicContact CB-CH2 4.46Å; V63-W66 HydrophobicContact CB-CZ2 3.96Å; V63-W66 HydrophobicContact CG1-CD2 3.88Å; V63-W66 HydrophobicContact CG1-CE3 4.28Å; V63-W66 HydrophobicContact CG1-CG 3.96Å; V63-W66 HydrophobicContact CG2-CH2 3.97Å; V63-W66 HydrophobicContact CG2-CZ2 3.91Å; V63-W66 HydrophobicContact CG2-CZ3 4.29Å; V63-F69 HydrophobicContact CG1-CB 3.61Å; V63-F69 HydrophobicContact CG1-CD2 4.25Å; V63-F69 HydrophobicContact CG1-CG 3.94Å; V63-F69 HydrophobicContact CG2-CD2 4.26Å; V63-F69 HydrophobicContact CG2-CG 4.48Å
64	E	78.4	Confident	78.2	Confident	133 Å²	133	62 Å²	62	62%	0.621	32%	0.324	S	S	*	.	S	Bend	trans	-64.4	-51.4	179.1	-65.5	-173.6	173.2	0	0	111.6
65	D	86.8	Confident	78.7	Confident	74 Å²	74	61.3 Å²	61.3	40%	0.396	32%	0.322	S	S	.	.			trans	-130.8	111.2	177.6	-174.4	-34	0	0	0	110.5	K67 V68 F69	D65-K67 VanDerWaalsContact C-N 3.31Å; D65-K67 PolarHBondContact O-N 3.43Å; D65-K67 WeakPolarHBondContact OD1-CA 3.41Å; D65-K67 VanDerWaalsContact OD1-CB 3.29Å; D65-K67 WeakPolarHBondContact OD1-CB 3.49Å; D65-K67 PolarHBondContact OD1-N 3.13Å; D65-V68 HydrophobicContact CB-CB 4.03Å; D65-V68 HydrophobicContact CB-CG2 4.05Å; D65-V68 PolarHBondContact O-N 3.47Å; D65-V68 PolarHBondContact OD1-N 2.66Å; D65-F69 VanDerWaalsContact O-CB 3.32Å; D65-F69 WeakPolarHBondContact O-CB 3.48Å; D65-F69 PolarHBondContact O-N 3.3Å
66	W	88.3	Confident	79.4	Confident	28 Å²	28	64.5 Å²	64.5	11%	0.106	34%	0.338	C	S	.	.	H	α-helix	trans	-68	-28.6	-178.2	-78.1	86.4	0	0	0	114	V42 W45 K46 F55 V63 F69 Y70	V42-W66 HydrophobicContact CG1-CB 4.24Å; V42-W66 HydrophobicContact CG1-CG 3.78Å; W45-W66 HydrophobicContact CB-CB 3.8Å; K46-W66 HydrophobicContact CB-CD2 3.82Å; K46-W66 HydrophobicContact CB-CE3 3.77Å; K46-W66 HydrophobicContact CB-CG 4.39Å; K46-W66 HydrophobicContact CB-CH2 4.42Å; K46-W66 HydrophobicContact CB-CZ2 4.47Å; K46-W66 HydrophobicContact CB-CZ3 4.09Å; K46-W66 HydrophobicContact CD-CH2 4.05Å; K46-W66 HydrophobicContact CD-CZ2 3.77Å; K46-W66 HydrophobicContact CG-CD2 4.18Å; K46-W66 HydrophobicContact CG-CE3 4.01Å; K46-W66 HydrophobicContact CG-CH2 3.75Å; K46-W66 HydrophobicContact CG-CZ2 3.93Å; K46-W66 HydrophobicContact CG-CZ3 3.79Å; F55-W66 HydrophobicContact CB-CZ3 4.22Å; F55-W66 AromaticContact CD1-CH2 3.9Å; F55-W66 HydrophobicContact CD1-CH2 3.9Å; F55-W66 HydrophobicContact CD1-CZ3 4.31Å; F55-W66 AromaticContact CD2-CH2 3.67Å; F55-W66 HydrophobicContact CD2-CH2 3.67Å; F55-W66 AromaticContact CD2-CZ3 3.91Å; F55-W66 HydrophobicContact CD2-CZ3 3.91Å; F55-W66 AromaticContact CE1-CH2 3.92Å; F55-W66 HydrophobicContact CE1-CH2 3.92Å; F55-W66 AromaticContact CE2-CH2 3.68Å; F55-W66 HydrophobicContact CE2-CH2 3.68Å; F55-W66 HydrophobicContact CE2-CZ3 4.38Å; F55-W66 AromaticContact CG-CH2 3.79Å; F55-W66 HydrophobicContact CG-CH2 3.79Å; F55-W66 AromaticContact CG-CZ3 3.88Å; F55-W66 HydrophobicContact CG-CZ3 3.88Å; F55-W66 AromaticContact CZ-CH2 3.82Å; F55-W66 HydrophobicContact CZ-CH2 3.82Å; V63-W66 HydrophobicContact CB-CD2 4.11Å; V63-W66 HydrophobicContact CB-CG 4.48Å; V63-W66 HydrophobicContact CB-CH2 4.46Å; V63-W66 HydrophobicContact CB-CZ2 3.96Å; V63-W66 HydrophobicContact CG1-CD2 3.88Å; V63-W66 HydrophobicContact CG1-CE3 4.28Å; V63-W66 HydrophobicContact CG1-CG 3.96Å; V63-W66 HydrophobicContact CG2-CH2 3.97Å; V63-W66 HydrophobicContact CG2-CZ2 3.91Å; V63-W66 HydrophobicContact CG2-CZ3 4.29Å; W66-F69 HydrophobicContact CE3-CD1 4.29Å; W66-F69 HydrophobicContact CZ3-CD1 4.45Å; W66-F69 HydrophobicContact CZ3-CE1 4.49Å; W66-Y70 VanDerWaalsContact O-CB 3.3Å; W66-Y70 WeakPolarHBondContact O-CB 3.48Å; W66-Y70 PolarHBondContact O-N 3.25Å
67	K	88.6	Confident	80.7	Confident	46 Å²	46	66.5 Å²	66.5	20%	0.2	34%	0.337	C	S	.	.	H	α-helix	trans	-72.4	-46.3	177.4	173.3	176.1	164.7	176.1	0	109.7	L25 D40 W45 D65 Y70 I71	L25-K67 HydrophobicContact CD2-CD 4.19Å; D40-K67 IonicContact OD1-NZ 3.1Å; W45-K67 HydrophobicContact CD2-CB 3.82Å; W45-K67 HydrophobicContact CD2-CG 3.99Å; W45-K67 HydrophobicContact CE3-CB 4.49Å; W45-K67 HydrophobicContact CE3-CG 4.41Å; W45-K67 HydrophobicContact CG-CB 3.81Å; W45-K67 HydrophobicContact CG-CG 4.48Å; W45-K67 HydrophobicContact CH2-CG 4.35Å; W45-K67 HydrophobicContact CZ2-CD 4.07Å; W45-K67 HydrophobicContact CZ2-CG 3.93Å; D65-K67 VanDerWaalsContact C-N 3.31Å; D65-K67 PolarHBondContact O-N 3.43Å; D65-K67 WeakPolarHBondContact OD1-CA 3.41Å; D65-K67 VanDerWaalsContact OD1-CB 3.29Å; D65-K67 WeakPolarHBondContact OD1-CB 3.49Å; D65-K67 PolarHBondContact OD1-N 3.13Å; K67-Y70 PolarHBondContact O-N 3.24Å; K67-I71 HydrophobicContact CG-CD1 4.03Å; K67-I71 WeakPolarHBondContact O-CD1 3.34Å; K67-I71 VanDerWaalsContact O-CG1 3.23Å; K67-I71 WeakPolarHBondContact O-CG1 3.42Å; K67-I71 PolarHBondContact O-N 2.72Å
68	V	88.6	Confident	82.5	Confident	22 Å²	22	60 Å²	60	13%	0.133	31%	0.312	C	S	.	.	H	α-helix	trans	-62.4	-46.3	174.7	174	0	0	0	0	110.8	D65 Y70 I71 L72 L148 F152	D65-V68 HydrophobicContact CB-CB 4.03Å; D65-V68 HydrophobicContact CB-CG2 4.05Å; D65-V68 PolarHBondContact O-N 3.47Å; D65-V68 PolarHBondContact OD1-N 2.66Å; V68-Y70 PolarHBondContact O-N 2.87Å; V68-I71 PolarHBondContact O-N 3.05Å; V68-L72 HydrophobicContact CG1-CD1 3.68Å; V68-L72 HydrophobicContact CG1-CG 4.2Å; V68-L72 WeakPolarHBondContact O-CG 3.33Å; V68-L72 PolarHBondContact O-N 2.86Å; V68-L148 HydrophobicContact CG1-CD1 3.6Å; V68-L148 HydrophobicContact CG2-CD1 4.49Å; V68-F152 HydrophobicContact CG1-CB 4.38Å; V68-F152 HydrophobicContact CG1-CD1 3.78Å; V68-F152 HydrophobicContact CG1-CD2 3.73Å; V68-F152 HydrophobicContact CG1-CE1 3.92Å; V68-F152 HydrophobicContact CG1-CE2 3.86Å; V68-F152 HydrophobicContact CG1-CG 3.69Å; V68-F152 HydrophobicContact CG1-CZ 3.95Å
69	F	89.8	Confident	84.4	Confident	14 Å²	14	53 Å²	53	6%	0.061	27%	0.274	C	S	.	.	H	α-helix	trans	-54	-51.2	175.2	173.5	-90.9	0	0	0	111.9	F54 F55 V63 D65 W66 I71 L72 C73 H250	F54-F69 HydrophobicContact CB-CE1 4.24Å; F55-F69 HydrophobicContact CB-CE1 4.24Å; F55-F69 HydrophobicContact CB-CZ 4.45Å; F55-F69 HydrophobicContact CD2-CE1 4.48Å; F55-F69 HydrophobicContact CD2-CZ 4.21Å; V63-F69 HydrophobicContact CG1-CB 3.61Å; V63-F69 HydrophobicContact CG1-CD2 4.25Å; V63-F69 HydrophobicContact CG1-CG 3.94Å; V63-F69 HydrophobicContact CG2-CD2 4.26Å; V63-F69 HydrophobicContact CG2-CG 4.48Å; D65-F69 VanDerWaalsContact O-CB 3.32Å; D65-F69 WeakPolarHBondContact O-CB 3.48Å; D65-F69 PolarHBondContact O-N 3.3Å; W66-F69 HydrophobicContact CE3-CD1 4.29Å; W66-F69 HydrophobicContact CZ3-CD1 4.45Å; W66-F69 HydrophobicContact CZ3-CE1 4.49Å; F69-I71 VanDerWaalsContact C-N 3.35Å; F69-I71 PolarHBondContact O-N 2.88Å; F69-L72 PolarHBondContact O-N 3.02Å; F69-C73 WeakPolarHBondContact O-CB 3.38Å; F69-C73 PolarHBondContact O-N 2.98Å; F69-C73 PolarHBondContact O-SG 3.06Å; F69-C73 VanDerWaalsContact O-SG 3.41Å; F69-H250 HydrophobicContact CD2-CB 4.11Å; F69-H250 AromaticContact CD2-CD2 3.79Å; F69-H250 HydrophobicContact CE2-CB 4.37Å; F69-H250 AromaticContact CE2-CD2 3.39Å; F69-H250 WeakPolarHBondContact CE2-CD2 3.15Å; F69-H250 AromaticContact CE2-CG 3.9Å; F69-H250 AromaticContact CE2-NE2 3.92Å
70	Y	90.8	Very high	86.3	Confident	10 Å²	10	48.7 Å²	48.7	4%	0.039	26%	0.258	C	S	.	.	H	α-helix	trans	-59.5	-46.1	178.9	175.8	-85.1	0	0	0	111.4	A21 W45 K48 E52 F54 W66 K67 V68 C73 S74	A21-Y70 HydrophobicContact CB-CD1 4.12Å; A21-Y70 HydrophobicContact CB-CE1 3.41Å; A21-Y70 VanDerWaalsContact CB-CE1 3.41Å; W45-Y70 AromaticContact CE3-CD1 3.63Å; W45-Y70 HydrophobicContact CE3-CD1 3.63Å; W45-Y70 HydrophobicContact CE3-CE1 4.36Å; W45-Y70 AromaticContact CE3-CG 3.76Å; W45-Y70 HydrophobicContact CE3-CG 3.76Å; W45-Y70 AromaticContact CZ3-CD1 3.56Å; W45-Y70 HydrophobicContact CZ3-CD1 3.56Å; W45-Y70 AromaticContact CZ3-CE1 3.99Å; W45-Y70 HydrophobicContact CZ3-CE1 3.99Å; W45-Y70 HydrophobicContact CZ3-CG 4.18Å; K48-Y70 HydrophobicContact CB-CD2 3.91Å; K48-Y70 HydrophobicContact CB-CE2 3.62Å; E52-Y70 PolarHBondContact OE1-OH 3.18Å; E52-Y70 WeakPolarHBondContact OE2-CE2 3.27Å; E52-Y70 PolarHBondContact OE2-OH 3.19Å; F54-Y70 AromaticContact CD2-CD2 3.99Å; F54-Y70 HydrophobicContact CD2-CD2 3.99Å; F54-Y70 HydrophobicContact CD2-CE2 4.09Å; F54-Y70 HydrophobicContact CE2-CD2 4.14Å; F54-Y70 AromaticContact CE2-CE2 3.85Å; F54-Y70 HydrophobicContact CE2-CE2 3.85Å; W66-Y70 VanDerWaalsContact O-CB 3.3Å; W66-Y70 WeakPolarHBondContact O-CB 3.48Å; W66-Y70 PolarHBondContact O-N 3.25Å; K67-Y70 PolarHBondContact O-N 3.24Å; V68-Y70 PolarHBondContact O-N 2.87Å; Y70-C73 PolarHBondContact O-N 3.43Å; Y70-S74 VanDerWaalsContact O-CB 3.27Å; Y70-S74 WeakPolarHBondContact O-CB 3.23Å; Y70-S74 PolarHBondContact O-N 3.4Å; Y70-S74 PolarHBondContact O-OG 3.31Å
71	I	89.7	Confident	88.5	Confident	38 Å²	38	49.6 Å²	49.6	20%	0.195	24%	0.243	C	C	.	.	H	α-helix	trans	-59.2	-50.6	179	-69.7	164.8	0	0	0	110.2	L25 K67 V68 F69 C73 S74 L75 L148	L25-I71 HydrophobicContact CD1-CD1 3.96Å; K67-I71 HydrophobicContact CG-CD1 4.03Å; K67-I71 WeakPolarHBondContact O-CD1 3.34Å; K67-I71 VanDerWaalsContact O-CG1 3.23Å; K67-I71 WeakPolarHBondContact O-CG1 3.42Å; K67-I71 PolarHBondContact O-N 2.72Å; V68-I71 PolarHBondContact O-N 3.05Å; F69-I71 VanDerWaalsContact C-N 3.35Å; F69-I71 PolarHBondContact O-N 2.88Å; I71-C73 PolarHBondContact O-N 3.21Å; I71-S74 PolarHBondContact O-N 2.97Å; I71-S74 PolarHBondContact O-OG 3.22Å; I71-L75 HydrophobicContact CG2-CD1 3.77Å; I71-L75 HydrophobicContact CG2-CG 4.43Å; I71-L75 WeakPolarHBondContact O-CB 3.23Å; I71-L75 WeakPolarHBondContact O-CG 3.42Å; I71-L75 PolarHBondContact O-N 3.43Å; I71-L148 HydrophobicContact CG2-CD2 4.44Å
72	L	91.3	Very high	90.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.4	-43.9	-179.4	-70.3	172.5	0	0	0	112.1	V68 F69 L75 Q76 Y144 L148 F152 P154 I248 H250	V68-L72 HydrophobicContact CG1-CD1 3.68Å; V68-L72 HydrophobicContact CG1-CG 4.2Å; V68-L72 WeakPolarHBondContact O-CG 3.33Å; V68-L72 PolarHBondContact O-N 2.86Å; F69-L72 PolarHBondContact O-N 3.02Å; L72-L75 PolarHBondContact O-N 3.25Å; L72-Q76 WeakPolarHBondContact O-CB 3.39Å; L72-Q76 PolarHBondContact O-N 2.84Å; L72-Y144 HydrophobicContact CD2-CD1 4.39Å; L72-Y144 HydrophobicContact CD2-CE1 4.21Å; L72-L148 HydrophobicContact CD2-CD1 4.32Å; L72-L148 HydrophobicContact CD2-CD2 3.9Å; L72-L148 HydrophobicContact CD2-CG 4.46Å; L72-L148 HydrophobicContact CG-CD1 4.46Å; L72-F152 HydrophobicContact CD1-CD1 3.75Å; L72-F152 HydrophobicContact CD1-CE1 3.42Å; L72-F152 VanDerWaalsContact CD1-CE1 3.42Å; L72-F152 HydrophobicContact CD1-CZ 4.3Å; L72-P154 HydrophobicContact CD1-CB 3.92Å; L72-P154 HydrophobicContact CD2-CB 3.93Å; L72-P154 HydrophobicContact CD2-CG 3.96Å; L72-I248 HydrophobicContact CD2-CG2 3.94Å; L72-H250 HydrophobicContact CB-CB 3.87Å; L72-H250 HydrophobicContact CD1-CB 4.42Å
73	C	90	Very high	91.3	Very high	11 Å²	11	45.3 Å²	45.3	7%	0.074	22%	0.218	C	C	.	.	H	α-helix	trans	-63.1	-43.3	174.7	-73.5	0	0	0	0	112.2	F54 F69 Y70 I71 L75 Q76	F54-C73 HydrophobicContact CB-CB 3.9Å; F54-C73 HydrophobicContact CD1-CB 3.97Å; F54-C73 HydrophobicContact CD2-CB 3.82Å; F54-C73 HydrophobicContact CE1-CB 4.47Å; F54-C73 HydrophobicContact CE2-CB 4.33Å; F54-C73 HydrophobicContact CG-CB 3.64Å; F69-C73 WeakPolarHBondContact O-CB 3.38Å; F69-C73 PolarHBondContact O-N 2.98Å; F69-C73 PolarHBondContact O-SG 3.06Å; F69-C73 VanDerWaalsContact O-SG 3.41Å; Y70-C73 PolarHBondContact O-N 3.43Å; I71-C73 PolarHBondContact O-N 3.21Å; C73-L75 VanDerWaalsContact C-N 3.26Å; C73-L75 PolarHBondContact O-N 3.01Å; C73-Q76 WeakPolarHBondContact O-CB 3.37Å; C73-Q76 PolarHBondContact O-N 2.6Å
74	S	90.5	Very high	92.2	Very high	57 Å²	57	44.7 Å²	44.7	40%	0.399	22%	0.215	S	C	.	.	H	α-helix	trans	-66.1	-28.9	179.9	74.7	0	0	0	0	113.2	Y70 I71	Y70-S74 VanDerWaalsContact O-CB 3.27Å; Y70-S74 WeakPolarHBondContact O-CB 3.23Å; Y70-S74 PolarHBondContact O-N 3.4Å; Y70-S74 PolarHBondContact O-OG 3.31Å; I71-S74 PolarHBondContact O-N 2.97Å; I71-S74 PolarHBondContact O-OG 3.22Å
75	L	91.8	Very high	93	Very high	38 Å²	38	38.4 Å²	38.4	20%	0.199	19%	0.185	C	C	.	.	H	α-helix	trans	-91.3	-7.4	178	-66.3	176.6	0	0	0	112.7	I71 L72 C73 R77 Y144	I71-L75 HydrophobicContact CG2-CD1 3.77Å; I71-L75 HydrophobicContact CG2-CG 4.43Å; I71-L75 WeakPolarHBondContact O-CB 3.23Å; I71-L75 WeakPolarHBondContact O-CG 3.42Å; I71-L75 PolarHBondContact O-N 3.43Å; L72-L75 PolarHBondContact O-N 3.25Å; C73-L75 VanDerWaalsContact C-N 3.26Å; C73-L75 PolarHBondContact O-N 3.01Å; L75-R77 PolarHBondContact O-N 3.27Å; L75-Y144 HydrophobicContact CB-CE1 4.01Å; L75-Y144 HydrophobicContact CD1-CD1 4.12Å; L75-Y144 HydrophobicContact CD1-CE1 4.07Å; L75-Y144 PolarHBondContact O-OH 2.88Å; L75-Y144 VanDerWaalsContact O-OH 3.09Å
76	Q	92.3	Very high	93.4	Very high	88 Å²	88	39.1 Å²	39.1	41%	0.411	19%	0.186	S	C	.	.			trans	-67.1	107.7	-171	-168.3	174.2	34.2	0	0	111.8	L72 C73 I247	L72-Q76 WeakPolarHBondContact O-CB 3.39Å; L72-Q76 PolarHBondContact O-N 2.84Å; C73-Q76 WeakPolarHBondContact O-CB 3.37Å; C73-Q76 PolarHBondContact O-N 2.6Å; Q76-I247 HydrophobicContact CG-CG2 3.59Å
77	R	95.2	Very high	93.8	Very high	108 Å²	108	43.1 Å²	43.1	41%	0.408	21%	0.206	S	C	.	.	S	Bend	trans	-158.5	171.6	175.2	63.4	-171.9	166.9	72.3	2.9	109.9	L75 L79 E142	L75-R77 PolarHBondContact O-N 3.27Å; R77-L79 HydrophobicContact CG-CD2 4.34Å; R77-L79 PolarHBondContact O-N 3.43Å; R77-E142 IonicContact CZ-OE2 3.66Å; R77-E142 IonicContact NH1-OE2 2.77Å; R77-E142 PolarHBondContact NH1-OE2 3.1Å; R77-E142 PolarHBondContact NH2-O 3.18Å; R77-E142 IonicContact NH2-OE2 3.47Å; R77-E142 PolarHBondContact NH2-OE2 2.91Å
78	N	97.7	Very high	94.1	Very high	46 Å²	46	45.9 Å²	45.9	25%	0.246	22%	0.224	C	C	.	.			trans	-68.1	125.7	169.5	-167.2	0.3	0	0	0	109.9	L80 S244 S245 I246	N78-L80 PolarHBondContact OD1-N 2.98Å; N78-S244 PolarHBondContact ND2-O 2.9Å; N78-S245 WeakPolarHBondContact ND2-CB 3.42Å; N78-S245 WeakPolarHBondContact OD1-CA 3.24Å; N78-S245 WeakPolarHBondContact OD1-CB 3.17Å; N78-I246 WeakPolarHBondContact CA-O 3.3Å; N78-I246 PolarHBondContact OD1-N 3.43Å; N78-I246 PolarHBondContact OD1-O 3.04Å
79	L	98.2	Very high	94.3	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.021	23%	0.229	C	C	.	.			trans	-85	-16.1	176.2	-53.1	-174.1	0	0	0	112.3	R77 V137 L139 E142 Y144 I246 I248	R77-L79 HydrophobicContact CG-CD2 4.34Å; R77-L79 PolarHBondContact O-N 3.43Å; L79-V137 HydrophobicContact CB-CG1 3.87Å; L79-V137 HydrophobicContact CB-CG2 4.25Å; L79-V137 HydrophobicContact CD1-CG1 3.98Å; L79-L139 HydrophobicContact CD1-CD2 4.04Å; L79-E142 HydrophobicContact CD2-CB 4.2Å; L79-E142 HydrophobicContact CD2-CG 4.38Å; L79-Y144 HydrophobicContact CD1-CE2 4.06Å; L79-Y144 HydrophobicContact CD2-CE2 3.86Å; L79-I246 HydrophobicContact CB-CB 4.31Å; L79-I246 HydrophobicContact CB-CG2 4.43Å; L79-I246 HydrophobicContact CD1-CG2 4.12Å; L79-I246 HydrophobicContact CG-CG2 4.47Å; L79-I246 WeakPolarHBondContact CG-O 3.42Å; L79-I246 PolarHBondContact N-O 2.82Å; L79-I248 HydrophobicContact CD1-CD1 4.1Å; L79-I248 HydrophobicContact CD1-CG1 4.11Å
80	L	98.1	Very high	94.6	Very high	7 Å²	7	49.5 Å²	49.5	4%	0.037	25%	0.247	C	C	.	.	S	Bend	trans	-78.8	131.1	173.9	-66.3	178.5	0	0	0	111.2	N78 W92 Q135 V137 F223 I246	N78-L80 PolarHBondContact OD1-N 2.98Å; L80-W92 HydrophobicContact CD1-CH2 4.24Å; L80-W92 HydrophobicContact CD2-CH2 4.42Å; L80-Q135 VanDerWaalsContact CA-OE1 3.22Å; L80-Q135 HydrophobicContact CD2-CB 4.04Å; L80-Q135 HydrophobicContact CD2-CG 4.42Å; L80-V137 HydrophobicContact CD2-CG2 4.2Å; L80-F223 HydrophobicContact CD1-CD1 4.12Å; L80-F223 HydrophobicContact CD1-CD2 4Å; L80-F223 HydrophobicContact CD1-CE1 4.28Å; L80-F223 HydrophobicContact CD1-CE2 4.15Å; L80-F223 HydrophobicContact CD1-CG 3.98Å; L80-F223 HydrophobicContact CD1-CZ 4.3Å; L80-F223 HydrophobicContact CD2-CB 4Å; L80-F223 HydrophobicContact CD2-CG 4.26Å; L80-I246 HydrophobicContact CD1-CD1 4.4Å; L80-I246 HydrophobicContact CD1-CG1 4.08Å; L80-I246 HydrophobicContact CD2-CD1 3.93Å; L80-I246 HydrophobicContact CD2-CG1 4.37Å; L80-I246 HydrophobicContact CG-CB 4.36Å; L80-I246 HydrophobicContact CG-CD1 4.09Å; L80-I246 HydrophobicContact CG-CG1 3.98Å
81	R	97.9	Very high	94.8	Very high	153 Å²	153	51.9 Å²	51.9	58%	0.577	27%	0.265	S	S	*	.	S	Bend	trans	-86.9	143.3	173.2	-59.7	-174.9	-175.6	-173.4	2.2	110.8	W92 Q135 E142	R81-W92 PolarHBondContact O-NE1 3.06Å; R81-Q135 PolarHBondContact O-NE2 3.36Å; R81-Q135 VanDerWaalsContact O-NE2 3.16Å; R81-E142 IonicContact NH2-OE1 2.94Å
82	N	97.4	Very high	95.1	Very high	13 Å²	13	50.9 Å²	50.9	7%	0.07	26%	0.259	C	S	.	.	S	Bend	trans	49	56	179.2	-176.6	30.2	0	0	0	113.4	C84 A85 E86 E87 N88 S90 W92	N82-C84 VanDerWaalsContact C-N 3.3Å; N82-C84 PolarHBondContact O-N 3.01Å; N82-A85 VanDerWaalsContact OD1-CA 3.3Å; N82-A85 WeakPolarHBondContact OD1-CA 3.09Å; N82-A85 PolarHBondContact OD1-N 3.35Å; N82-E86 PolarHBondContact OD1-N 3.25Å; N82-E87 HydrophobicContact CB-CB 4.46Å; N82-E87 PolarHBondContact OD1-N 2.86Å; N82-E87 VanDerWaalsContact OD1-N 3.13Å; N82-N88 PolarHBondContact ND2-O 3.21Å; N82-S90 PolarHBondContact ND2-O 2.7Å; N82-W92 PolarHBondContact O-NE1 3.23Å
83	P	97.3	Very high	95.5	Very high	29 Å²	29	59.1 Å²	59.1	19%	0.188	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-23.8	-176.2	30.7	-37.4	0	0	0	113.6	N243 S244	P83-N243 PolarHBondContact O-N 2.82Å; P83-N243 VanDerWaalsContact O-N 3.08Å; P83-S244 WeakPolarHBondContact CB-O 3.38Å
84	C	96.8	Very high	95.9	Very high	20 Å²	20	61.5 Å²	61.5	14%	0.135	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	17.2	-174.5	-57.2	0	0	0	0	113.8	N82 E86 V120 K122	N82-C84 VanDerWaalsContact C-N 3.3Å; N82-C84 PolarHBondContact O-N 3.01Å; C84-E86 VanDerWaalsContact C-N 3.27Å; C84-E86 PolarHBondContact O-N 3.39Å; C84-V120 HydrophobicContact CB-CG1 4.32Å; C84-K122 CarbonylContact O-C 3.57Å; C84-K122 VanDerWaalsContact O-CB 3.29Å; C84-K122 WeakPolarHBondContact O-CB 3.24Å
85	A	95.9	Very high	96.2	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.293	C	S	.	.	S	Bend	trans	61.7	24.7	178.1	0	0	0	0	0	115.8	N82 E87 N88 V104 K122 F124	N82-A85 VanDerWaalsContact OD1-CA 3.3Å; N82-A85 WeakPolarHBondContact OD1-CA 3.09Å; N82-A85 PolarHBondContact OD1-N 3.35Å; A85-E87 VanDerWaalsContact C-N 3.25Å; A85-E87 PolarHBondContact O-N 2.81Å; A85-N88 PolarHBondContact O-N 2.86Å; A85-V104 HydrophobicContact CB-CB 4.36Å; A85-V104 HydrophobicContact CB-CG1 3.57Å; A85-V104 HydrophobicContact CB-CG2 3.87Å; A85-K122 HydrophobicContact CB-CB 4.17Å; A85-K122 WeakPolarHBondContact O-CD 3.26Å; A85-F124 VanDerWaalsContact CA-CZ 3.42Å; A85-F124 HydrophobicContact CB-CD1 3.8Å; A85-F124 HydrophobicContact CB-CD2 4Å; A85-F124 HydrophobicContact CB-CE1 3.43Å; A85-F124 VanDerWaalsContact CB-CE1 3.43Å; A85-F124 HydrophobicContact CB-CE2 3.65Å; A85-F124 HydrophobicContact CB-CG 4.08Å; A85-F124 HydrophobicContact CB-CZ 3.36Å
86	E	96.2	Very high	96.5	Very high	89 Å²	89	61.1 Å²	61.1	42%	0.416	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-32.9	177.5	-68.4	-55.4	155.2	0	0	112.3	N82 C84 K122	N82-E86 PolarHBondContact OD1-N 3.25Å; C84-E86 VanDerWaalsContact C-N 3.27Å; C84-E86 PolarHBondContact O-N 3.39Å; E86-K122 PolarHBondContact O-NZ 2.89Å; E86-K122 WeakPolarHBondContact OE2-CE 3.33Å; E86-K122 IonicContact OE2-NZ 2.7Å; E86-K122 PolarHBondContact OE2-NZ 3.41Å
87	E	95.3	Very high	96.7	Very high	112 Å²	112	59.9 Å²	59.9	52%	0.523	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	34.1	178.7	-60.9	170.5	-145.7	0	0	111.8	N82 A85 L89 S90	N82-E87 HydrophobicContact CB-CB 4.46Å; N82-E87 PolarHBondContact OD1-N 2.86Å; N82-E87 VanDerWaalsContact OD1-N 3.13Å; A85-E87 VanDerWaalsContact C-N 3.25Å; A85-E87 PolarHBondContact O-N 2.81Å; E87-L89 PolarHBondContact O-N 3.21Å; E87-S90 WeakPolarHBondContact O-CB 3.41Å; E87-S90 PolarHBondContact O-N 2.89Å; E87-S90 PolarHBondContact O-OG 2.62Å
88	N	94.9	Very high	96.7	Very high	105 Å²	105	55.3 Å²	55.3	56%	0.561	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	-130.6	-171.9	-62.2	-57.2	0	0	0	111.3	N82 A85 S90 F124	N82-N88 PolarHBondContact ND2-O 3.21Å; A85-N88 PolarHBondContact O-N 2.86Å; N88-S90 VanDerWaalsContact C-N 3.33Å; N88-F124 WeakPolarHBondContact O-CE1 3.48Å
89	L	93.6	Very high	96.7	Very high	49 Å²	49	54.3 Å²	54.3	26%	0.257	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	11.1	176.7	-68.8	164.5	0	0	0	113.2	E87 W92 I94 W102 F124 K133	E87-L89 PolarHBondContact O-N 3.21Å; L89-W92 PolarHBondContact O-N 3.09Å; L89-I94 HydrophobicContact CB-CD1 4.48Å; L89-I94 HydrophobicContact CD1-CD1 4.17Å; L89-I94 HydrophobicContact CD2-CD1 3.98Å; L89-I94 HydrophobicContact CG-CD1 4.44Å; L89-W102 HydrophobicContact CD1-CB 3.8Å; L89-W102 HydrophobicContact CD2-CB 4.09Å; L89-W102 HydrophobicContact CD2-CG 4.38Å; L89-F124 HydrophobicContact CD2-CD1 3.57Å; L89-F124 HydrophobicContact CD2-CE1 3.62Å; L89-F124 HydrophobicContact CG-CE1 4.38Å; L89-K133 HydrophobicContact CD2-CD 4.23Å
90	S	95.1	Very high	96.6	Very high	63 Å²	63	56.6 Å²	56.6	44%	0.441	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	146.6	178.6	-51.6	0	0	0	0	110.6	N82 E87 N88 W92	N82-S90 PolarHBondContact ND2-O 2.7Å; E87-S90 WeakPolarHBondContact O-CB 3.41Å; E87-S90 PolarHBondContact O-N 2.89Å; E87-S90 PolarHBondContact O-OG 2.62Å; N88-S90 VanDerWaalsContact C-N 3.33Å; S90-W92 PolarHBondContact O-N 3.2Å
91	S	94.8	Very high	96.6	Very high	59 Å²	59	64 Å²	64	41%	0.413	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	-1	-174.4	-51.2	0	0	0	0	116.3	Q135	S91-Q135 PolarHBondContact O-NE2 3.04Å
92	W	97.9	Very high	96.6	Very high	17 Å²	17	57.4 Å²	57.4	6%	0.064	30%	0.297	C	S	.	.			trans	-105.6	131.3	174.2	-69.4	94.1	0	0	0	110.9	L80 R81 N82 L89 S90 F124 K133 Q135 F223	L80-W92 HydrophobicContact CD1-CH2 4.24Å; L80-W92 HydrophobicContact CD2-CH2 4.42Å; R81-W92 PolarHBondContact O-NE1 3.06Å; N82-W92 PolarHBondContact O-NE1 3.23Å; L89-W92 PolarHBondContact O-N 3.09Å; S90-W92 PolarHBondContact O-N 3.2Å; W92-F124 AromaticContact CD1-CZ 3.97Å; W92-F124 AromaticContact NE1-CZ 3.8Å; W92-K133 HydrophobicContact CB-CB 4.47Å; W92-K133 HydrophobicContact CB-CD 4.19Å; W92-K133 HydrophobicContact CD2-CD 4.01Å; W92-K133 HydrophobicContact CD2-CG 4.32Å; W92-K133 HydrophobicContact CE3-CB 4.33Å; W92-K133 HydrophobicContact CE3-CD 4.05Å; W92-K133 HydrophobicContact CE3-CG 3.84Å; W92-K133 HydrophobicContact CG-CD 4.06Å; W92-K133 VanDerWaalsContact CZ2-NZ 3.34Å; W92-K133 HydrophobicContact CZ3-CG 4.37Å; W92-Q135 HydrophobicContact CE3-CB 4.03Å; W92-Q135 HydrophobicContact CH2-CB 4.5Å; W92-Q135 HydrophobicContact CZ3-CB 3.95Å; W92-F223 AromaticContact CH2-CD1 3.78Å; W92-F223 HydrophobicContact CH2-CD1 3.78Å; W92-F223 AromaticContact CH2-CE1 3.89Å; W92-F223 HydrophobicContact CH2-CE1 3.89Å; W92-F223 AromaticContact CZ3-CD1 3.81Å; W92-F223 HydrophobicContact CZ3-CD1 3.81Å; W92-F223 HydrophobicContact CZ3-CE1 4.18Å
93	R	98.2	Very high	96.7	Very high	173 Å²	173	60.4 Å²	60.4	65%	0.653	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	125.3	167.4	-179.5	-178.8	-176	-104.8	4.4	108	D95 K133 S134	R93-D95 IonicContact CZ-OD1 3.41Å; R93-D95 IonicContact NH1-OD1 3.35Å; R93-D95 PolarHBondContact NH1-OD1 3.06Å; R93-K133 CarbonylContact O-C 3.51Å; R93-K133 VanDerWaalsContact O-CA 3.22Å; R93-K133 WeakPolarHBondContact O-CA 3.32Å; R93-K133 WeakPolarHBondContact O-CB 3.38Å; R93-S134 PolarHBondContact N-O 2.79Å; R93-S134 PolarHBondContact O-N 3.48Å
94	I	98.2	Very high	96.7	Very high	61 Å²	61	60.6 Å²	60.6	31%	0.313	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	117.1	173.9	-51.5	-57.1	0	0	0	108.1	L89 S96 N97 K133	L89-I94 HydrophobicContact CB-CD1 4.48Å; L89-I94 HydrophobicContact CD1-CD1 4.17Å; L89-I94 HydrophobicContact CD2-CD1 3.98Å; L89-I94 HydrophobicContact CG-CD1 4.44Å; I94-S96 WeakPolarHBondContact CG2-O 3.32Å; I94-N97 HydrophobicContact CG2-CB 3.68Å; I94-K133 HydrophobicContact CD1-CB 4.03Å
95	D	97.7	Very high	96.7	Very high	42 Å²	42	61.5 Å²	61.5	23%	0.225	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-40.8	-179.8	-54.4	-46.8	0	0	0	110.7	R93 L132 S134 Q224	R93-D95 IonicContact CZ-OD1 3.41Å; R93-D95 IonicContact NH1-OD1 3.35Å; R93-D95 PolarHBondContact NH1-OD1 3.06Å; D95-L132 HydrophobicContact CB-CB 4.04Å; D95-L132 PolarHBondContact N-O 3.36Å; D95-S134 VanDerWaalsContact CG-OG 3.25Å; D95-S134 PolarHBondContact OD1-OG 3.4Å; D95-S134 WeakPolarHBondContact OD2-CB 3.42Å; D95-S134 PolarHBondContact OD2-N 3.07Å; D95-S134 PolarHBondContact OD2-OG 3.4Å; D95-Q224 PolarHBondContact OD2-NE2 3.13Å
96	S	97.6	Very high	96.7	Very high	46 Å²	46	66 Å²	66	32%	0.322	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	143.8	175.5	-58.5	0	0	0	0	109.8	I94 M130 C131 L132	I94-S96 WeakPolarHBondContact CG2-O 3.32Å; S96-M130 WeakPolarHBondContact CB-O 3.45Å; S96-C131 CarbonylContact O-C 3.47Å; S96-C131 WeakPolarHBondContact O-CA 3.48Å; S96-L132 PolarHBondContact N-O 3.28Å; S96-L132 VanDerWaalsContact N-O 3.1Å; S96-L132 PolarHBondContact O-N 2.98Å; S96-L132 VanDerWaalsContact O-O 3.07Å
97	N	96.3	Very high	96.6	Very high	61 Å²	61	63.3 Å²	63.3	33%	0.326	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	54.7	-174.5	-150.5	16.8	0	0	0	111.5	I94 R101 W102	I94-N97 HydrophobicContact CG2-CB 3.68Å; N97-R101 HydrophobicContact CB-CG 4.43Å; N97-R101 WeakPolarHBondContact ND2-CB 3.19Å; N97-R101 WeakPolarHBondContact OD1-CA 3.37Å; N97-R101 WeakPolarHBondContact OD1-CB 3.11Å; N97-W102 VanDerWaalsContact OD1-CD1 3.31Å; N97-W102 PolarHBondContact OD1-N 2.99Å
98	G	96.1	Very high	96.4	Very high	13 Å²	13	62 Å²	62	13%	0.134	33%	0.329	C	S	.	.			trans	-68	166.4	-177.1	0	0	0	0	0	114.1	D100 R101 E129 M130 C131	G98-D100 PolarHBondContact O-N 2.76Å; G98-R101 WeakPolarHBondContact O-CA 3.27Å; G98-R101 PolarHBondContact O-N 3Å; G98-E129 WeakPolarHBondContact CA-OE2 3.39Å; G98-M130 PolarHBondContact N-O 3.27Å; G98-C131 PolarHBondContact O-SG 3.01Å; G98-C131 VanDerWaalsContact O-SG 3.38Å
99	G	96.9	Very high	96.1	Very high	24 Å²	24	57.4 Å²	57.4	25%	0.247	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	-133.2	177.6	0	0	0	0	0	113.3	R101 E129	G99-R101 PolarHBondContact O-N 2.66Å; G99-E129 PolarHBondContact N-OE2 2.92Å
100	D	97.5	Very high	96	Very high	53 Å²	53	59 Å²	59	28%	0.283	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	17.4	176.2	-67.6	-37.2	0	0	0	113.2	G98 S127 K234 G235 W236	G98-D100 PolarHBondContact O-N 2.76Å; D100-S127 PolarHBondContact N-OG 2.91Å; D100-K234 WeakPolarHBondContact OD2-CG 3.22Å; D100-G235 VanDerWaalsContact OD2-CA 3.29Å; D100-G235 WeakPolarHBondContact OD2-CA 3.48Å; D100-G235 PolarHBondContact OD2-N 3.21Å; D100-W236 HydrophobicContact CB-CZ2 3.95Å; D100-W236 WeakPolarHBondContact O-CZ2 3.49Å; D100-W236 PolarHBondContact O-NE1 2.84Å
101	R	98	Very high	95.8	Very high	161 Å²	161	59.1 Å²	59.1	61%	0.608	32%	0.322	S	S	*	.			trans	66.8	175.3	173.1	-57.1	175.9	-174.5	-178	1.5	113.8	N97 G98 G99 W236	N97-R101 HydrophobicContact CB-CG 4.43Å; N97-R101 WeakPolarHBondContact ND2-CB 3.19Å; N97-R101 WeakPolarHBondContact OD1-CA 3.37Å; N97-R101 WeakPolarHBondContact OD1-CB 3.11Å; G98-R101 WeakPolarHBondContact O-CA 3.27Å; G98-R101 PolarHBondContact O-N 3Å; G99-R101 PolarHBondContact O-N 2.66Å; R101-W236 PolarHBondContact O-NE1 3.3Å
102	W	98	Very high	95.6	Very high	16 Å²	16	57.4 Å²	57.4	6%	0.061	31%	0.314	C	S	.	.			trans	-60.7	137.7	167.9	-77.6	103.3	0	0	0	111.4	L89 N97 F124 T126 C131 K133 V241	L89-W102 HydrophobicContact CD1-CB 3.8Å; L89-W102 HydrophobicContact CD2-CB 4.09Å; L89-W102 HydrophobicContact CD2-CG 4.38Å; N97-W102 VanDerWaalsContact OD1-CD1 3.31Å; N97-W102 PolarHBondContact OD1-N 2.99Å; W102-F124 HydrophobicContact CE3-CB 3.77Å; W102-F124 HydrophobicContact CZ3-CB 3.56Å; W102-T126 HydrophobicContact CD2-CG2 4.12Å; W102-T126 HydrophobicContact CE3-CG2 3.75Å; W102-T126 HydrophobicContact CH2-CG2 3.2Å; W102-T126 HydrophobicContact CZ2-CG2 3.59Å; W102-T126 HydrophobicContact CZ3-CG2 3.28Å; W102-C131 HydrophobicContact CD2-CB 4.16Å; W102-C131 HydrophobicContact CG-CB 4.37Å; W102-C131 HydrophobicContact CZ2-CB 4.08Å; W102-C131 WeakPolarHBondContact CZ2-O 3.4Å; W102-K133 HydrophobicContact CH2-CD 4.35Å; W102-K133 HydrophobicContact CH2-CG 4.4Å; W102-K133 HydrophobicContact CZ2-CB 4.34Å; W102-K133 HydrophobicContact CZ2-CD 4.14Å; W102-K133 HydrophobicContact CZ2-CG 3.91Å; W102-V241 HydrophobicContact CH2-CG2 3.9Å; W102-V241 HydrophobicContact CZ3-CG2 3.89Å
103	K	97.9	Very high	95.3	Very high	75 Å²	75	59 Å²	59	33%	0.326	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	153.8	170.4	-178.9	180	175.5	-156.7	0	110.6	E105 F124 V125 W236	K103-E105 HydrophobicContact CD-CG 4.11Å; K103-E105 WeakPolarHBondContact CE-OE1 3.06Å; K103-E105 HydrophobicContact CG-CG 4.12Å; K103-E105 IonicContact NZ-OE1 2.84Å; K103-E105 PolarHBondContact NZ-OE1 2.92Å; K103-F124 CarbonylContact O-C 3.59Å; K103-F124 WeakPolarHBondContact O-CA 3.48Å; K103-V125 HydrophobicContact CB-CG1 3.99Å; K103-V125 PolarHBondContact N-O 3.2Å; K103-V125 PolarHBondContact O-N 3.42Å; K103-W236 HydrophobicContact CB-CD2 4.06Å; K103-W236 HydrophobicContact CB-CG 4.03Å; K103-W236 HydrophobicContact CB-CZ2 4.21Å; K103-W236 VanDerWaalsContact CB-NE1 3.26Å; K103-W236 HydrophobicContact CD-CD2 3.4Å; K103-W236 VanDerWaalsContact CD-CE2 3.42Å; K103-W236 HydrophobicContact CD-CE3 3.62Å; K103-W236 HydrophobicContact CD-CG 3.99Å; K103-W236 HydrophobicContact CD-CH2 3.88Å; K103-W236 HydrophobicContact CD-CZ2 3.67Å; K103-W236 HydrophobicContact CD-CZ3 3.86Å; K103-W236 HydrophobicContact CG-CD2 4.4Å; K103-W236 HydrophobicContact CG-CZ2 4.46Å
104	V	97.9	Very high	95.1	Very high	33 Å²	33	54.8 Å²	54.8	20%	0.2	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	132	171.9	175.6	0	0	0	0	108.7	A85 K122 Y123 F124	A85-V104 HydrophobicContact CB-CB 4.36Å; A85-V104 HydrophobicContact CB-CG1 3.57Å; A85-V104 HydrophobicContact CB-CG2 3.87Å; V104-K122 HydrophobicContact CG1-CB 4.26Å; V104-K122 HydrophobicContact CG1-CD 4.14Å; V104-Y123 WeakPolarHBondContact CA-O 3.45Å; V104-F124 HydrophobicContact CG2-CD1 3.72Å; V104-F124 HydrophobicContact CG2-CE1 3.94Å
105	E	97.1	Very high	94.9	Very high	40 Å²	40	52.4 Å²	52.4	19%	0.187	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	160.8	-179.9	-65	-173.8	158.3	0	0	110.4	K103 K122 Y123 V125	K103-E105 HydrophobicContact CD-CG 4.11Å; K103-E105 WeakPolarHBondContact CE-OE1 3.06Å; K103-E105 HydrophobicContact CG-CG 4.12Å; K103-E105 IonicContact NZ-OE1 2.84Å; K103-E105 PolarHBondContact NZ-OE1 2.92Å; E105-K122 CarbonylContact O-C 3.57Å; E105-K122 VanDerWaalsContact O-CA 3.22Å; E105-K122 WeakPolarHBondContact O-CA 3.39Å; E105-K122 WeakPolarHBondContact O-CB 3.39Å; E105-Y123 HydrophobicContact CB-CD2 4.46Å; E105-Y123 HydrophobicContact CB-CE1 4.08Å; E105-Y123 HydrophobicContact CB-CE2 3.69Å; E105-Y123 VanDerWaalsContact CB-CZ 3.47Å; E105-Y123 WeakPolarHBondContact CB-OH 3.41Å; E105-Y123 HydrophobicContact CG-CE2 4.41Å; E105-Y123 PolarHBondContact N-O 2.89Å; E105-Y123 VanDerWaalsContact N-O 3.08Å; E105-Y123 PolarHBondContact O-N 2.72Å; E105-Y123 PolarHBondContact OE2-OH 2.97Å; E105-V125 HydrophobicContact CG-CG1 4.09Å
106	T	96.3	Very high	94.6	Very high	94 Å²	94	54.8 Å²	54.8	58%	0.577	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	145.7	179.7	48.9	0	0	0	0	111.5	P108 K121 K122	T106-P108 CarbonylContact O-C 3.53Å; T106-K121 CarbonylContact C-O 3.51Å; T106-K121 WeakPolarHBondContact CA-O 3.42Å; T106-K122 HydrophobicContact CG2-CG 4.01Å
107	L	92.6	Very high	94.3	Very high	33 Å²	33	56 Å²	56	17%	0.173	33%	0.331	C	S	.	.	S	Bend	trans	-76.1	145.1	175.1	-70.9	164.3	0	0	0	111.9	F115 V120 K121 Y123 W204	L107-F115 HydrophobicContact CD1-CB 3.62Å; L107-F115 HydrophobicContact CD1-CG 4.44Å; L107-F115 HydrophobicContact CD2-CB 4.39Å; L107-V120 HydrophobicContact CD1-CB 4.26Å; L107-V120 HydrophobicContact CD1-CG1 3.82Å; L107-V120 VanDerWaalsContact CD1-O 3.25Å; L107-V120 WeakPolarHBondContact CD1-O 3.45Å; L107-K121 PolarHBondContact N-O 2.89Å; L107-Y123 HydrophobicContact CD2-CD1 3.5Å; L107-Y123 VanDerWaalsContact CD2-CD1 3.5Å; L107-Y123 HydrophobicContact CD2-CE1 3.9Å; L107-Y123 HydrophobicContact CG-CD1 3.79Å; L107-Y123 HydrophobicContact CG-CE1 4.31Å; L107-W204 HydrophobicContact CD2-CZ2 3.64Å
108	P	90.9	Very high	94	Very high	83 Å²	83	59.4 Å²	59.4	54%	0.539	35%	0.349	S	S	.	.	S	Bend	cis	-75.9	142.9	-11.3	32	-33.3	0	0	0	111.3	T106	T106-P108 CarbonylContact O-C 3.53Å
109	G	90	Very high	93.9	Very high	9 Å²	9	67.2 Å²	67.2	9%	0.093	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-72.4	158.8	174.6	0	0	0	0	0	113.1	C111 G112 Y123	G109-C111 PolarHBondContact O-N 3.37Å; G109-G112 PolarHBondContact O-N 2.75Å; G109-Y123 WeakPolarHBondContact CA-OH 3.31Å
110	S	90.4	Very high	93.8	Very high	84 Å²	84	66.6 Å²	66.6	59%	0.587	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	132.3	174.7	-55.2	0	0	0	0	111.5	G112 R240	S110-G112 PolarHBondContact O-N 2.86Å; S110-G112 VanDerWaalsContact O-N 3.14Å; S110-R240 PolarHBondContact O-NH1 3.34Å; S110-R240 PolarHBondContact O-NH2 3.14Å
111	C	91.1	Very high	93.7	Very high	64 Å²	64	69.7 Å²	69.7	43%	0.432	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	30.9	-177.4	-52.6	0	0	0	0	113.3	G109 A166 D167	G109-C111 PolarHBondContact O-N 3.37Å; C111-A166 HydrophobicContact CB-CB 4.47Å; C111-A166 PolarHBondContact O-N 2.9Å; C111-D167 HydrophobicContact CB-CB 4.43Å; C111-D167 WeakPolarHBondContact CB-OD1 3.28Å
112	G	91.5	Very high	93.7	Very high	24 Å²	24	64.5 Å²	64.5	25%	0.247	36%	0.363	C	S	.	.			trans	-125.8	171.4	177.7	0	0	0	0	0	113.2	G109 S110	G109-G112 PolarHBondContact O-N 2.75Å; S110-G112 PolarHBondContact O-N 2.86Å; S110-G112 VanDerWaalsContact O-N 3.14Å
113	T	91.3	Very high	93.7	Very high	50 Å²	50	63.8 Å²	63.8	31%	0.307	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-101.5	160.5	173.7	60.7	0	0	0	0	111.6	A202 W204	T113-A202 HydrophobicContact CG2-CB 4.5Å; T113-A202 PolarHBondContact OG1-O 2.84Å; T113-W204 PolarHBondContact O-NE1 2.82Å
114	S	92.8	Very high	93.7	Very high	84 Å²	84	60.2 Å²	60.2	59%	0.587	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-64.5	147.6	171.7	-60	0	0	0	0	110.9
115	F	94.4	Very high	93.7	Very high	11 Å²	11	58.7 Å²	58.7	5%	0.048	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-72.8	145	173	-166.8	-101.1	0	0	0	110.6	L107 D117 V120 W161 W204 T242 N243	L107-F115 HydrophobicContact CD1-CB 3.62Å; L107-F115 HydrophobicContact CD1-CG 4.44Å; L107-F115 HydrophobicContact CD2-CB 4.39Å; F115-D117 VanDerWaalsContact C-N 3.3Å; F115-D117 HydrophobicContact CD1-CB 3.89Å; F115-D117 VanDerWaalsContact CD1-N 3.29Å; F115-D117 HydrophobicContact CE1-CB 3.81Å; F115-D117 PolarHBondContact O-N 2.97Å; F115-V120 HydrophobicContact CD1-CB 3.64Å; F115-V120 HydrophobicContact CD1-CG1 4.23Å; F115-V120 HydrophobicContact CD1-CG2 3.65Å; F115-V120 HydrophobicContact CE1-CB 4.11Å; F115-V120 HydrophobicContact CE1-CG2 3.61Å; F115-V120 HydrophobicContact CG-CB 4.2Å; F115-V120 HydrophobicContact CG-CG1 4.4Å; F115-V120 HydrophobicContact CZ-CG2 4.5Å; F115-W161 HydrophobicContact CE2-CB 3.81Å; F115-W161 AromaticContact CE2-CD2 3.57Å; F115-W161 HydrophobicContact CE2-CD2 3.57Å; F115-W161 AromaticContact CE2-CE3 3.69Å; F115-W161 HydrophobicContact CE2-CE3 3.69Å; F115-W161 AromaticContact CE2-CG 3.66Å; F115-W161 HydrophobicContact CE2-CG 3.66Å; F115-W161 HydrophobicContact CE2-CZ3 4.39Å; F115-W161 HydrophobicContact CZ-CB 4.3Å; F115-W161 AromaticContact CZ-CD2 3.57Å; F115-W161 HydrophobicContact CZ-CD2 3.57Å; F115-W161 AromaticContact CZ-CE2 3.77Å; F115-W161 HydrophobicContact CZ-CE3 4.02Å; F115-W161 AromaticContact CZ-CG 3.72Å; F115-W161 HydrophobicContact CZ-CG 3.72Å; F115-W161 HydrophobicContact CZ-CZ2 4.32Å; F115-W204 HydrophobicContact CD2-CB 4.23Å; F115-W204 AromaticContact CD2-CD2 3.57Å; F115-W204 HydrophobicContact CD2-CD2 3.57Å; F115-W204 AromaticContact CD2-CE2 3.92Å; F115-W204 AromaticContact CD2-CE3 3.97Å; F115-W204 HydrophobicContact CD2-CE3 3.97Å; F115-W204 AromaticContact CD2-CG 3.68Å; F115-W204 HydrophobicContact CD2-CG 3.68Å; F115-W204 HydrophobicContact CE2-CB 4.37Å; F115-W204 HydrophobicContact CE2-CD2 4.07Å; F115-W204 HydrophobicContact CE2-CE3 4.06Å; F115-W204 HydrophobicContact CE2-CG 4.22Å; F115-T242 HydrophobicContact CD2-CG2 4.12Å; F115-T242 HydrophobicContact CE2-CG2 4.03Å; F115-N243 HydrophobicContact CE1-CB 4.43Å; F115-N243 HydrophobicContact CZ-CB 3.94Å
116	P	92.1	Very high	93.7	Very high	93 Å²	93	56.8 Å²	56.8	60%	0.604	33%	0.327	S	S	*	.	S	Bend	trans	-60.5	-33.4	-178.6	-26.3	35.5	0	0	0	114.8	W161	P116-W161 HydrophobicContact CG-CH2 4.28Å; P116-W161 HydrophobicContact CG-CZ3 4.18Å
117	D	91.5	Very high	93.8	Very high	72 Å²	72	52.3 Å²	52.3	39%	0.385	30%	0.299	S	S	.	.	S	Bend	trans	-95.5	116.6	175.7	-171.5	-13.6	0	0	0	111.5	F115 K119 V120	F115-D117 VanDerWaalsContact C-N 3.3Å; F115-D117 HydrophobicContact CD1-CB 3.89Å; F115-D117 VanDerWaalsContact CD1-N 3.29Å; F115-D117 HydrophobicContact CE1-CB 3.81Å; F115-D117 PolarHBondContact O-N 2.97Å; D117-K119 PolarHBondContact O-N 3.45Å; D117-K119 WeakPolarHBondContact OD1-CB 3.07Å; D117-K119 WeakPolarHBondContact OD1-CG 3.48Å; D117-K119 PolarHBondContact OD1-N 3.42Å; D117-V120 HydrophobicContact CB-CG2 4.36Å; D117-V120 PolarHBondContact O-N 2.92Å; D117-V120 VanDerWaalsContact O-N 3.1Å
118	N	90.4	Very high	94	Very high	131 Å²	131	52.5 Å²	52.5	70%	0.701	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-14.7	178.3	-70	-22.6	0	0	0	114.3	V120 K121	N118-V120 VanDerWaalsContact C-N 3.35Å; N118-K121 WeakPolarHBondContact O-CE 3.31Å; N118-K121 PolarHBondContact O-NZ 3.34Å
119	K	92.5	Very high	94.3	Very high	178 Å²	178	53 Å²	53	77%	0.774	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-24.2	176.1	-66.2	173.9	176.7	173.8	0	112.9	D117	D117-K119 PolarHBondContact O-N 3.45Å; D117-K119 WeakPolarHBondContact OD1-CB 3.07Å; D117-K119 WeakPolarHBondContact OD1-CG 3.48Å; D117-K119 PolarHBondContact OD1-N 3.42Å
120	V	95.4	Very high	94.7	Very high	10 Å²	10	55.1 Å²	55.1	6%	0.061	30%	0.302	C	S	.	.			trans	-82.6	121.6	178.1	-174.9	0	0	0	0	108.6	C84 L107 F115 D117 N118 T242 N243	C84-V120 HydrophobicContact CB-CG1 4.32Å; L107-V120 HydrophobicContact CD1-CB 4.26Å; L107-V120 HydrophobicContact CD1-CG1 3.82Å; L107-V120 VanDerWaalsContact CD1-O 3.25Å; L107-V120 WeakPolarHBondContact CD1-O 3.45Å; F115-V120 HydrophobicContact CD1-CB 3.64Å; F115-V120 HydrophobicContact CD1-CG1 4.23Å; F115-V120 HydrophobicContact CD1-CG2 3.65Å; F115-V120 HydrophobicContact CE1-CB 4.11Å; F115-V120 HydrophobicContact CE1-CG2 3.61Å; F115-V120 HydrophobicContact CG-CB 4.2Å; F115-V120 HydrophobicContact CG-CG1 4.4Å; F115-V120 HydrophobicContact CZ-CG2 4.5Å; D117-V120 HydrophobicContact CB-CG2 4.36Å; D117-V120 PolarHBondContact O-N 2.92Å; D117-V120 VanDerWaalsContact O-N 3.1Å; N118-V120 VanDerWaalsContact C-N 3.35Å; V120-T242 HydrophobicContact CG1-CG2 3.95Å; V120-N243 HydrophobicContact CG2-CB 4.29Å
121	K	95.3	Very high	95	Very high	119 Å²	119	51.1 Å²	51.1	52%	0.517	27%	0.274	S	S	.	.			trans	-113.9	-21.3	-175	-60.1	-54	-170.7	-171	0	114.4	T106 L107 N118	T106-K121 CarbonylContact C-O 3.51Å; T106-K121 WeakPolarHBondContact CA-O 3.42Å; L107-K121 PolarHBondContact N-O 2.89Å; N118-K121 WeakPolarHBondContact O-CE 3.31Å; N118-K121 PolarHBondContact O-NZ 3.34Å
122	K	97.6	Very high	95.4	Very high	52 Å²	52	49.2 Å²	49.2	23%	0.226	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	163.6	-176.3	-66.4	171	-173.3	151.8	0	111.5	C84 A85 E86 V104 E105 T106 T242	C84-K122 CarbonylContact O-C 3.57Å; C84-K122 VanDerWaalsContact O-CB 3.29Å; C84-K122 WeakPolarHBondContact O-CB 3.24Å; A85-K122 HydrophobicContact CB-CB 4.17Å; A85-K122 WeakPolarHBondContact O-CD 3.26Å; E86-K122 PolarHBondContact O-NZ 2.89Å; E86-K122 WeakPolarHBondContact OE2-CE 3.33Å; E86-K122 IonicContact OE2-NZ 2.7Å; E86-K122 PolarHBondContact OE2-NZ 3.41Å; V104-K122 HydrophobicContact CG1-CB 4.26Å; V104-K122 HydrophobicContact CG1-CD 4.14Å; E105-K122 CarbonylContact O-C 3.57Å; E105-K122 VanDerWaalsContact O-CA 3.22Å; E105-K122 WeakPolarHBondContact O-CA 3.39Å; E105-K122 WeakPolarHBondContact O-CB 3.39Å; T106-K122 HydrophobicContact CG2-CG 4.01Å; K122-T242 PolarHBondContact O-OG1 3.41Å
123	Y	97.9	Very high	95.7	Very high	1 Å²	1	48 Å²	48	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	161.8	173.7	60.6	-93.5	0	0	0	110.6	V104 E105 L107 G109 V125 W204 R240	V104-Y123 WeakPolarHBondContact CA-O 3.45Å; E105-Y123 HydrophobicContact CB-CD2 4.46Å; E105-Y123 HydrophobicContact CB-CE1 4.08Å; E105-Y123 HydrophobicContact CB-CE2 3.69Å; E105-Y123 VanDerWaalsContact CB-CZ 3.47Å; E105-Y123 WeakPolarHBondContact CB-OH 3.41Å; E105-Y123 HydrophobicContact CG-CE2 4.41Å; E105-Y123 PolarHBondContact N-O 2.89Å; E105-Y123 VanDerWaalsContact N-O 3.08Å; E105-Y123 PolarHBondContact O-N 2.72Å; E105-Y123 PolarHBondContact OE2-OH 2.97Å; L107-Y123 HydrophobicContact CD2-CD1 3.5Å; L107-Y123 VanDerWaalsContact CD2-CD1 3.5Å; L107-Y123 HydrophobicContact CD2-CE1 3.9Å; L107-Y123 HydrophobicContact CG-CD1 3.79Å; L107-Y123 HydrophobicContact CG-CE1 4.31Å; G109-Y123 WeakPolarHBondContact CA-OH 3.31Å; Y123-V125 HydrophobicContact CD2-CB 4.12Å; Y123-V125 HydrophobicContact CE2-CB 3.86Å; Y123-V125 HydrophobicContact CE2-CG1 4.22Å; Y123-W204 HydrophobicContact CD1-CZ2 4.39Å; Y123-W204 HydrophobicContact CG-CH2 4.23Å; Y123-W204 HydrophobicContact CG-CZ2 4.46Å; Y123-R240 HydrophobicContact CD2-CB 3.82Å; Y123-R240 HydrophobicContact CD2-CG 3.84Å; Y123-R240 HydrophobicContact CE2-CB 4.24Å; Y123-R240 HydrophobicContact CE2-CG 3.74Å; Y123-R240 HydrophobicContact CG-CB 4.41Å
124	F	98.4	Very high	96.1	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	140.5	167.8	-54.8	-83	0	0	0	109.5	A85 N88 L89 W92 W102 K103 V104 R240 V241	A85-F124 VanDerWaalsContact CA-CZ 3.42Å; A85-F124 HydrophobicContact CB-CD1 3.8Å; A85-F124 HydrophobicContact CB-CD2 4Å; A85-F124 HydrophobicContact CB-CE1 3.43Å; A85-F124 VanDerWaalsContact CB-CE1 3.43Å; A85-F124 HydrophobicContact CB-CE2 3.65Å; A85-F124 HydrophobicContact CB-CG 4.08Å; A85-F124 HydrophobicContact CB-CZ 3.36Å; N88-F124 WeakPolarHBondContact O-CE1 3.48Å; L89-F124 HydrophobicContact CD2-CD1 3.57Å; L89-F124 HydrophobicContact CD2-CE1 3.62Å; L89-F124 HydrophobicContact CG-CE1 4.38Å; W92-F124 AromaticContact CD1-CZ 3.97Å; W92-F124 AromaticContact NE1-CZ 3.8Å; W102-F124 HydrophobicContact CE3-CB 3.77Å; W102-F124 HydrophobicContact CZ3-CB 3.56Å; K103-F124 CarbonylContact O-C 3.59Å; K103-F124 WeakPolarHBondContact O-CA 3.48Å; V104-F124 HydrophobicContact CG2-CD1 3.72Å; V104-F124 HydrophobicContact CG2-CE1 3.94Å; F124-R240 CarbonylContact O-C 3.51Å; F124-R240 VanDerWaalsContact O-CA 3.26Å; F124-R240 WeakPolarHBondContact O-CA 3.3Å; F124-V241 HydrophobicContact CB-CG2 3.87Å; F124-V241 HydrophobicContact CD2-CG2 4.4Å; F124-V241 PolarHBondContact N-O 3.37Å; F124-V241 PolarHBondContact O-N 3Å
125	V	98.1	Very high	96.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.6	175.5	62.6	0	0	0	0	111	K103 E105 Y123 W236 R240	K103-V125 HydrophobicContact CB-CG1 3.99Å; K103-V125 PolarHBondContact N-O 3.2Å; K103-V125 PolarHBondContact O-N 3.42Å; E105-V125 HydrophobicContact CG-CG1 4.09Å; Y123-V125 HydrophobicContact CD2-CB 4.12Å; Y123-V125 HydrophobicContact CE2-CB 3.86Å; Y123-V125 HydrophobicContact CE2-CG1 4.22Å; V125-W236 HydrophobicContact CB-CB 4.43Å; V125-W236 HydrophobicContact CG1-CB 3.72Å; V125-W236 HydrophobicContact CG1-CG 3.95Å; V125-W236 HydrophobicContact CG2-CB 3.87Å; V125-R240 HydrophobicContact CB-CG 4.27Å; V125-R240 HydrophobicContact CG2-CG 3.92Å
126	T	98.2	Very high	96.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.23	C	C	.	.			trans	-95.5	167.6	-180	53.9	0	0	0	0	111.5	W102 C131 G227 W236 G238 P239	W102-T126 HydrophobicContact CD2-CG2 4.12Å; W102-T126 HydrophobicContact CE3-CG2 3.75Å; W102-T126 HydrophobicContact CH2-CG2 3.2Å; W102-T126 HydrophobicContact CZ2-CG2 3.59Å; W102-T126 HydrophobicContact CZ3-CG2 3.28Å; T126-C131 HydrophobicContact CG2-CB 3.51Å; T126-G227 WeakPolarHBondContact CB-O 3.43Å; T126-W236 WeakPolarHBondContact O-CA 3.47Å; T126-G238 PolarHBondContact O-N 3.46Å; T126-G238 VanDerWaalsContact OG1-C 3.23Å; T126-G238 VanDerWaalsContact OG1-CA 3.27Å; T126-G238 WeakPolarHBondContact OG1-CA 3.41Å; T126-P239 HydrophobicContact CG2-CG 4.37Å; T126-P239 PolarHBondContact N-O 3.04Å; T126-P239 WeakPolarHBondContact OG1-CD 3.02Å; T126-P239 WeakPolarHBondContact OG1-CG 3.25Å; T126-P239 PolarHBondContact OG1-O 2.73Å
127	S	97.6	Very high	96.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.203	C	C	.	.			trans	-102.6	-156.7	-178.3	-165.4	0	0	0	0	111.1	D100 Q228 D229 G235	D100-S127 PolarHBondContact N-OG 2.91Å; S127-Q228 WeakPolarHBondContact O-CA 3.38Å; S127-D229 PolarHBondContact O-N 3.17Å; S127-G235 WeakPolarHBondContact CA-O 3.16Å; S127-G235 WeakPolarHBondContact CB-O 3.33Å; S127-G235 PolarHBondContact OG-O 3.07Å
128	F	95.9	Very high	97.1	Very high	38 Å²	38	42.2 Å²	42.2	17%	0.167	20%	0.202	C	C	.	.	S	Bend	trans	-86	-11.8	-176.8	55.3	-92.8	0	0	0	114.6	D229 F232 W233 K234	F128-D229 VanDerWaalsContact CA-CG 3.47Å; F128-D229 WeakPolarHBondContact CA-OD2 3.14Å; F128-D229 WeakPolarHBondContact CB-OD2 3.5Å; F128-F232 HydrophobicContact CD2-CD1 4.43Å; F128-W233 WeakPolarHBondContact CD1-O 3.5Å; F128-K234 HydrophobicContact CE1-CB 4.47Å; F128-K234 HydrophobicContact CE1-CG 4.32Å
129	E	97.4	Very high	97.5	Very high	94 Å²	94	36 Å²	36	44%	0.439	17%	0.168	S	C	.	.	S	Bend	trans	-115	164.1	169	-68.9	175.8	169	0	0	109.9	G98 G99 C131	G98-E129 WeakPolarHBondContact CA-OE2 3.39Å; G99-E129 PolarHBondContact N-OE2 2.92Å; E129-C131 PolarHBondContact O-N 2.89Å; E129-C131 VanDerWaalsContact O-N 3.14Å
130	M	98	Very high	97.6	Very high	53 Å²	53	33.7 Å²	33.7	26%	0.261	16%	0.158	S	C	.	.			trans	-54.5	117.6	-175.4	-169.6	60.8	68.2	0	0	112.7	S96 G98 L132 Q228	S96-M130 WeakPolarHBondContact CB-O 3.45Å; G98-M130 PolarHBondContact N-O 3.27Å; M130-L132 HydrophobicContact CG-CD1 4.14Å; M130-L132 HydrophobicContact CG-CG 3.99Å; M130-L132 HydrophobicContact SD-CD1 4.46Å; M130-L132 HydrophobicContact SD-CD2 4.1Å; M130-L132 HydrophobicContact SD-CG 4.09Å; M130-Q228 HydrophobicContact CE-CG 4.26Å
131	C	98.4	Very high	97.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	122.2	172.3	-78.3	0	0	0	0	108.7	S96 G98 W102 T126 E129 G226 G227	S96-C131 CarbonylContact O-C 3.47Å; S96-C131 WeakPolarHBondContact O-CA 3.48Å; G98-C131 PolarHBondContact O-SG 3.01Å; G98-C131 VanDerWaalsContact O-SG 3.38Å; W102-C131 HydrophobicContact CD2-CB 4.16Å; W102-C131 HydrophobicContact CG-CB 4.37Å; W102-C131 HydrophobicContact CZ2-CB 4.08Å; W102-C131 WeakPolarHBondContact CZ2-O 3.4Å; T126-C131 HydrophobicContact CG2-CB 3.51Å; E129-C131 PolarHBondContact O-N 2.89Å; E129-C131 VanDerWaalsContact O-N 3.14Å; C131-G226 CarbonylContact O-C 3.52Å; C131-G226 VanDerWaalsContact O-CA 3.24Å; C131-G226 WeakPolarHBondContact O-CA 3.18Å; C131-G227 PolarHBondContact N-O 2.86Å; C131-G227 PolarHBondContact O-N 3.1Å
132	L	98.6	Very high	97.7	Very high	23 Å²	23	32.3 Å²	32.3	12%	0.12	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	140	179.7	-67.4	174.3	0	0	0	109.6	D95 S96 M130	D95-L132 HydrophobicContact CB-CB 4.04Å; D95-L132 PolarHBondContact N-O 3.36Å; S96-L132 PolarHBondContact N-O 3.28Å; S96-L132 VanDerWaalsContact N-O 3.1Å; S96-L132 PolarHBondContact O-N 2.98Å; S96-L132 VanDerWaalsContact O-O 3.07Å; M130-L132 HydrophobicContact CG-CD1 4.14Å; M130-L132 HydrophobicContact CG-CG 3.99Å; M130-L132 HydrophobicContact SD-CD1 4.46Å; M130-L132 HydrophobicContact SD-CD2 4.1Å; M130-L132 HydrophobicContact SD-CG 4.09Å
133	K	98.6	Very high	97.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	150.2	171.6	67.9	-177.1	-178.7	69.6	0	110.7	L89 W92 R93 I94 W102 Q224 H225	L89-K133 HydrophobicContact CD2-CD 4.23Å; W92-K133 HydrophobicContact CB-CB 4.47Å; W92-K133 HydrophobicContact CB-CD 4.19Å; W92-K133 HydrophobicContact CD2-CD 4.01Å; W92-K133 HydrophobicContact CD2-CG 4.32Å; W92-K133 HydrophobicContact CE3-CB 4.33Å; W92-K133 HydrophobicContact CE3-CD 4.05Å; W92-K133 HydrophobicContact CE3-CG 3.84Å; W92-K133 HydrophobicContact CG-CD 4.06Å; W92-K133 VanDerWaalsContact CZ2-NZ 3.34Å; W92-K133 HydrophobicContact CZ3-CG 4.37Å; R93-K133 CarbonylContact O-C 3.51Å; R93-K133 VanDerWaalsContact O-CA 3.22Å; R93-K133 WeakPolarHBondContact O-CA 3.32Å; R93-K133 WeakPolarHBondContact O-CB 3.38Å; I94-K133 HydrophobicContact CD1-CB 4.03Å; W102-K133 HydrophobicContact CH2-CD 4.35Å; W102-K133 HydrophobicContact CH2-CG 4.4Å; W102-K133 HydrophobicContact CZ2-CB 4.34Å; W102-K133 HydrophobicContact CZ2-CD 4.14Å; W102-K133 HydrophobicContact CZ2-CG 3.91Å; K133-Q224 WeakPolarHBondContact O-CA 3.26Å; K133-H225 WeakPolarHBondContact CE-NE2 3.42Å; K133-H225 PolarHBondContact N-O 2.77Å; K133-H225 PolarHBondContact NZ-NE2 2.84Å; K133-H225 PolarHBondContact O-N 2.97Å
134	S	98.6	Very high	97.3	Very high	6 Å²	6	32 Å²	32	4%	0.042	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	160.3	-178.6	60.6	0	0	0	0	113.7	R93 D95 F223	R93-S134 PolarHBondContact N-O 2.79Å; R93-S134 PolarHBondContact O-N 3.48Å; D95-S134 VanDerWaalsContact CG-OG 3.25Å; D95-S134 PolarHBondContact OD1-OG 3.4Å; D95-S134 WeakPolarHBondContact OD2-CB 3.42Å; D95-S134 PolarHBondContact OD2-N 3.07Å; D95-S134 PolarHBondContact OD2-OG 3.4Å; S134-F223 CarbonylContact C-O 3.53Å; S134-F223 WeakPolarHBondContact CA-O 3.48Å; S134-F223 VanDerWaalsContact CB-O 3.28Å; S134-F223 WeakPolarHBondContact CB-O 3.22Å
135	Q	98.6	Very high	97	Very high	18 Å²	18	35.2 Å²	35.2	8%	0.084	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	134.5	167.5	-164.6	173.2	100.2	0	0	108.8	L80 R81 S91 W92 F223	L80-Q135 VanDerWaalsContact CA-OE1 3.22Å; L80-Q135 HydrophobicContact CD2-CB 4.04Å; L80-Q135 HydrophobicContact CD2-CG 4.42Å; R81-Q135 PolarHBondContact O-NE2 3.36Å; R81-Q135 VanDerWaalsContact O-NE2 3.16Å; S91-Q135 PolarHBondContact O-NE2 3.04Å; W92-Q135 HydrophobicContact CE3-CB 4.03Å; W92-Q135 HydrophobicContact CH2-CB 4.5Å; W92-Q135 HydrophobicContact CZ3-CB 3.95Å; Q135-F223 PolarHBondContact N-O 2.63Å; Q135-F223 PolarHBondContact O-N 3.1Å
136	M	98.2	Very high	96.8	Very high	91 Å²	91	39 Å²	39	45%	0.448	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	121.8	173.9	-172.2	68.6	76.2	0	0	108.5	Y183 H220 L222	M136-Y183 HydrophobicContact CE-CD1 4.31Å; M136-H220 HydrophobicContact CG-CB 4.49Å; M136-H220 HydrophobicContact SD-CB 3.81Å; M136-L222 HydrophobicContact CE-CB 3.96Å; M136-L222 HydrophobicContact CE-CD1 3.97Å; M136-L222 HydrophobicContact CE-CG 4.42Å; M136-L222 HydrophobicContact SD-CB 3.98Å
137	V	98.3	Very high	96.5	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.024	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.9	176.2	179.6	0	0	0	0	108.9	L79 L80 L139 E142 H220 I221 I246	L79-V137 HydrophobicContact CB-CG1 3.87Å; L79-V137 HydrophobicContact CB-CG2 4.25Å; L79-V137 HydrophobicContact CD1-CG1 3.98Å; L80-V137 HydrophobicContact CD2-CG2 4.2Å; V137-L139 HydrophobicContact CG1-CD2 4.3Å; V137-E142 HydrophobicContact CG1-CG 3.93Å; V137-H220 VanDerWaalsContact O-CA 3.23Å; V137-H220 WeakPolarHBondContact O-CA 3.34Å; V137-I221 HydrophobicContact CB-CB 4.27Å; V137-I221 PolarHBondContact N-O 2.81Å; V137-I221 PolarHBondContact O-N 2.84Å; V137-I246 HydrophobicContact CG2-CD1 4.36Å
138	D	98.1	Very high	96.2	Very high	68 Å²	68	47 Å²	47	36%	0.364	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	108	169	176.2	-19.4	0	0	0	109.2	K140 A141 E142	D138-K140 VanDerWaalsContact C-N 3.28Å; D138-K140 PolarHBondContact O-N 2.81Å; D138-K140 WeakPolarHBondContact OD1-CA 3.36Å; D138-K140 WeakPolarHBondContact OD1-CB 3.37Å; D138-K140 PolarHBondContact OD1-N 2.81Å; D138-A141 HydrophobicContact CB-CB 3.88Å; D138-A141 PolarHBondContact O-N 3.41Å; D138-A141 PolarHBondContact OD1-N 2.9Å; D138-E142 VanDerWaalsContact O-CG 3.27Å; D138-E142 WeakPolarHBondContact O-CG 3.41Å; D138-E142 PolarHBondContact O-N 3.36Å
139	L	97.5	Very high	96.2	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-34.4	-175.2	-68.4	179.2	0	0	0	113.1	L79 V137 E142 G143 Y144 M149 V218 R219 I221 I248	L79-L139 HydrophobicContact CD1-CD2 4.04Å; V137-L139 HydrophobicContact CG1-CD2 4.3Å; L139-E142 PolarHBondContact O-N 3.16Å; L139-G143 PolarHBondContact O-N 3.13Å; L139-Y144 CarbonylContact C-O 3.59Å; L139-Y144 HydrophobicContact CD2-CD2 4.35Å; L139-Y144 WeakPolarHBondContact O-CB 3.36Å; L139-Y144 PolarHBondContact O-N 3.29Å; L139-M149 HydrophobicContact CD1-CE 3.73Å; L139-M149 HydrophobicContact CD1-CG 4.28Å; L139-M149 HydrophobicContact CD1-SD 4.25Å; L139-V218 HydrophobicContact CD1-CG1 3.84Å; L139-R219 WeakPolarHBondContact CB-O 2.96Å; L139-R219 WeakPolarHBondContact CG-O 3.37Å; L139-R219 PolarHBondContact N-O 3.04Å; L139-I221 HydrophobicContact CD1-CD1 4.46Å; L139-I221 HydrophobicContact CD1-CG1 4.37Å; L139-I221 HydrophobicContact CD2-CD1 3.77Å; L139-I221 HydrophobicContact CD2-CG1 4.25Å; L139-I221 HydrophobicContact CG-CD1 4.43Å; L139-I221 HydrophobicContact CG-CG1 4.4Å; L139-I248 HydrophobicContact CD2-CD1 3.6Å
140	K	95.7	Very high	96	Very high	129 Å²	129	43 Å²	43	56%	0.561	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-41.9	180	-174.9	175.2	-173.7	162.5	0	110.7	D138 E142 G143 Y144 E146	D138-K140 VanDerWaalsContact C-N 3.28Å; D138-K140 PolarHBondContact O-N 2.81Å; D138-K140 WeakPolarHBondContact OD1-CA 3.36Å; D138-K140 WeakPolarHBondContact OD1-CB 3.37Å; D138-K140 PolarHBondContact OD1-N 2.81Å; K140-E142 VanDerWaalsContact C-N 3.26Å; K140-E142 PolarHBondContact O-N 2.88Å; K140-G143 PolarHBondContact O-N 2.71Å; K140-Y144 WeakPolarHBondContact CA-O 3.42Å; K140-E146 IonicContact NZ-OE1 2.83Å; K140-E146 PolarHBondContact NZ-OE1 3.07Å
141	A	95.8	Very high	95.7	Very high	74 Å²	74	45.7 Å²	45.7	61%	0.612	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-33.1	174.3	0	0	0	0	0	112.2	D138 G143	D138-A141 HydrophobicContact CB-CB 3.88Å; D138-A141 PolarHBondContact O-N 3.41Å; D138-A141 PolarHBondContact OD1-N 2.9Å; A141-G143 VanDerWaalsContact C-N 3.27Å; A141-G143 PolarHBondContact O-N 2.75Å
142	E	95.6	Very high	95.3	Very high	27 Å²	27	48 Å²	48	13%	0.126	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-3.9	177.6	-61.2	-62	141.3	0	0	113.7	R77 L79 R81 V137 D138 L139 K140 Y144	R77-E142 IonicContact CZ-OE2 3.66Å; R77-E142 IonicContact NH1-OE2 2.77Å; R77-E142 PolarHBondContact NH1-OE2 3.1Å; R77-E142 PolarHBondContact NH2-O 3.18Å; R77-E142 IonicContact NH2-OE2 3.47Å; R77-E142 PolarHBondContact NH2-OE2 2.91Å; L79-E142 HydrophobicContact CD2-CB 4.2Å; L79-E142 HydrophobicContact CD2-CG 4.38Å; R81-E142 IonicContact NH2-OE1 2.94Å; V137-E142 HydrophobicContact CG1-CG 3.93Å; D138-E142 VanDerWaalsContact O-CG 3.27Å; D138-E142 WeakPolarHBondContact O-CG 3.41Å; D138-E142 PolarHBondContact O-N 3.36Å; L139-E142 PolarHBondContact O-N 3.16Å; K140-E142 VanDerWaalsContact C-N 3.26Å; K140-E142 PolarHBondContact O-N 2.88Å; E142-Y144 HydrophobicContact CB-CD2 4.09Å; E142-Y144 HydrophobicContact CB-CE2 4.18Å
143	G	92.6	Very high	95	Very high	43 Å²	43	50.6 Å²	50.6	44%	0.443	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.2	-2.2	172.3	0	0	0	0	0	115.5	L139 K140 A141 C145	L139-G143 PolarHBondContact O-N 3.13Å; K140-G143 PolarHBondContact O-N 2.71Å; A141-G143 VanDerWaalsContact C-N 3.27Å; A141-G143 PolarHBondContact O-N 2.75Å; G143-C145 PolarHBondContact O-N 2.98Å
144	Y	94.4	Very high	94.7	Very high	3 Å²	3	50.6 Å²	50.6	1%	0.012	28%	0.275	C	S	.	.			trans	-87.1	106.5	179.7	-57.5	-88	0	0	0	110	L72 L75 L79 L139 K140 E142 L148 I248	L72-Y144 HydrophobicContact CD2-CD1 4.39Å; L72-Y144 HydrophobicContact CD2-CE1 4.21Å; L75-Y144 HydrophobicContact CB-CE1 4.01Å; L75-Y144 HydrophobicContact CD1-CD1 4.12Å; L75-Y144 HydrophobicContact CD1-CE1 4.07Å; L75-Y144 PolarHBondContact O-OH 2.88Å; L75-Y144 VanDerWaalsContact O-OH 3.09Å; L79-Y144 HydrophobicContact CD1-CE2 4.06Å; L79-Y144 HydrophobicContact CD2-CE2 3.86Å; L139-Y144 CarbonylContact C-O 3.59Å; L139-Y144 HydrophobicContact CD2-CD2 4.35Å; L139-Y144 WeakPolarHBondContact O-CB 3.36Å; L139-Y144 PolarHBondContact O-N 3.29Å; K140-Y144 WeakPolarHBondContact CA-O 3.42Å; E142-Y144 HydrophobicContact CB-CD2 4.09Å; E142-Y144 HydrophobicContact CB-CE2 4.18Å; Y144-L148 HydrophobicContact CD1-CD2 4.15Å; Y144-I248 HydrophobicContact CD1-CB 4.35Å; Y144-I248 HydrophobicContact CD1-CD1 3.63Å; Y144-I248 HydrophobicContact CD1-CG2 4.17Å; Y144-I248 HydrophobicContact CD2-CD1 3.81Å; Y144-I248 HydrophobicContact CE1-CB 3.59Å; Y144-I248 HydrophobicContact CE1-CD1 3.63Å; Y144-I248 HydrophobicContact CE1-CG1 4.1Å; Y144-I248 HydrophobicContact CE1-CG2 3.71Å; Y144-I248 HydrophobicContact CE2-CD1 3.81Å; Y144-I248 HydrophobicContact CE2-CG1 4.48Å; Y144-I248 HydrophobicContact CG-CD1 3.71Å
145	C	92.1	Very high	94.6	Very high	68 Å²	68	51.1 Å²	51.1	46%	0.459	28%	0.277	S	S	.	.			trans	-72.7	159.1	-178.6	67.5	0	0	0	0	112.5	G143 E147 L148 M149	G143-C145 PolarHBondContact O-N 2.98Å; C145-E147 PolarHBondContact O-N 2.85Å; C145-L148 WeakPolarHBondContact O-CB 3.39Å; C145-L148 PolarHBondContact O-N 3.39Å; C145-L148 VanDerWaalsContact SG-CB 3.51Å; C145-M149 WeakPolarHBondContact O-CG 3.4Å; C145-M149 PolarHBondContact O-N 3.43Å; C145-M149 VanDerWaalsContact O-N 3.13Å
146	E	94.6	Very high	94.5	Very high	79 Å²	79	50.2 Å²	50.2	37%	0.369	27%	0.273	S	S	.	.	H	α-helix	trans	-60	-45.6	-176.2	-60.1	-168.6	-145	0	0	112.6	K140 L148 M149 D150 R219	K140-E146 IonicContact NZ-OE1 2.83Å; K140-E146 PolarHBondContact NZ-OE1 3.07Å; E146-L148 VanDerWaalsContact C-N 3.31Å; E146-L148 PolarHBondContact O-N 3.02Å; E146-M149 PolarHBondContact O-N 3.04Å; E146-D150 WeakPolarHBondContact O-CB 3.44Å; E146-D150 PolarHBondContact O-N 2.86Å; E146-R219 IonicContact OE2-CZ 2.73Å; E146-R219 IonicContact OE2-NE 3.77Å; E146-R219 PolarHBondContact OE2-NE 2.89Å; E146-R219 IonicContact OE2-NH2 3.55Å; E146-R219 PolarHBondContact OE2-NH2 3.25Å; E146-R219 VanDerWaalsContact OE2-NH2 3.15Å
147	E	92.1	Very high	94.5	Very high	151 Å²	151	47.5 Å²	47.5	71%	0.706	26%	0.261	S	S	*	.	H	α-helix	trans	-60.1	-39.7	178.4	-175.1	-179.4	-171.3	0	0	112.5	C145 T151	C145-E147 PolarHBondContact O-N 2.85Å; E147-T151 WeakPolarHBondContact O-CB 3.37Å; E147-T151 PolarHBondContact O-N 3.3Å; E147-T151 PolarHBondContact O-OG1 3.42Å
148	L	91.6	Very high	94.5	Very high	16 Å²	16	47.4 Å²	47.4	8%	0.084	26%	0.261	C	S	.	.	I	π-helix	trans	-64	-46.6	176.2	175	68.3	0	0	0	110.9	V68 I71 L72 Y144 C145 E146 F152 R153	V68-L148 HydrophobicContact CG1-CD1 3.6Å; V68-L148 HydrophobicContact CG2-CD1 4.49Å; I71-L148 HydrophobicContact CG2-CD2 4.44Å; L72-L148 HydrophobicContact CD2-CD1 4.32Å; L72-L148 HydrophobicContact CD2-CD2 3.9Å; L72-L148 HydrophobicContact CD2-CG 4.46Å; L72-L148 HydrophobicContact CG-CD1 4.46Å; Y144-L148 HydrophobicContact CD1-CD2 4.15Å; C145-L148 WeakPolarHBondContact O-CB 3.39Å; C145-L148 PolarHBondContact O-N 3.39Å; C145-L148 VanDerWaalsContact SG-CB 3.51Å; E146-L148 VanDerWaalsContact C-N 3.31Å; E146-L148 PolarHBondContact O-N 3.02Å; L148-F152 HydrophobicContact CD1-CB 3.98Å; L148-F152 HydrophobicContact CD1-CD1 4.46Å; L148-F152 HydrophobicContact CD1-CG 4.42Å; L148-F152 WeakPolarHBondContact O-CB 3.35Å; L148-F152 PolarHBondContact O-N 3.5Å; L148-F152 VanDerWaalsContact O-N 3.07Å; L148-R153 PolarHBondContact O-N 3.02Å
149	M	95	Very high	94.5	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.01	26%	0.256	C	S	.	.	I	π-helix	trans	-70.2	-30.7	-179.5	-64.2	-52.8	-55.6	0	0	112.8	L139 C145 E146 R153 P154 I156 Y214 I248	L139-M149 HydrophobicContact CD1-CE 3.73Å; L139-M149 HydrophobicContact CD1-CG 4.28Å; L139-M149 HydrophobicContact CD1-SD 4.25Å; C145-M149 WeakPolarHBondContact O-CG 3.4Å; C145-M149 PolarHBondContact O-N 3.43Å; C145-M149 VanDerWaalsContact O-N 3.13Å; E146-M149 PolarHBondContact O-N 3.04Å; M149-R153 WeakPolarHBondContact O-CG 3.16Å; M149-P154 HydrophobicContact CE-CG 4.41Å; M149-P154 HydrophobicContact SD-CG 4.06Å; M149-I156 HydrophobicContact CE-CD1 4.14Å; M149-Y214 HydrophobicContact CE-CE2 4Å; M149-Y214 WeakPolarHBondContact CE-OH 3.16Å; M149-I248 HydrophobicContact CE-CD1 4.43Å; M149-I248 HydrophobicContact SD-CD1 4.21Å
150	D	94.9	Very high	94.5	Very high	48 Å²	48	47 Å²	47	26%	0.257	26%	0.256	S	S	.	.	I	π-helix	trans	-85.2	-38.2	-178	-65.4	-16	0	0	0	112.5	E146 P216 G217 R219	E146-D150 WeakPolarHBondContact O-CB 3.44Å; E146-D150 PolarHBondContact O-N 2.86Å; D150-P216 HydrophobicContact CB-CB 4.09Å; D150-G217 WeakPolarHBondContact OD1-CA 3.43Å; D150-G217 PolarHBondContact OD1-N 2.86Å; D150-R219 IonicContact OD1-CZ 3.61Å; D150-R219 IonicContact OD1-NH1 2.69Å; D150-R219 PolarHBondContact OD1-NH1 3Å; D150-R219 IonicContact OD1-NH2 3.23Å; D150-R219 PolarHBondContact OD1-NH2 2.9Å; D150-R219 IonicContact OD2-CZ 3.15Å; D150-R219 IonicContact OD2-NH1 2.77Å; D150-R219 IonicContact OD2-NH2 3.24Å; D150-R219 PolarHBondContact OD2-NH2 2.89Å
151	T	91	Very high	94.6	Very high	108 Å²	108	42.8 Å²	42.8	66%	0.663	24%	0.236	S	C	*	.	I	π-helix	trans	-91.2	-54.9	-173.5	-49.2	0	0	0	0	111.4	E147	E147-T151 WeakPolarHBondContact O-CB 3.37Å; E147-T151 PolarHBondContact O-N 3.3Å; E147-T151 PolarHBondContact O-OG1 3.42Å
152	F	89.4	Confident	94.7	Very high	50 Å²	50	39.2 Å²	39.2	22%	0.219	21%	0.207	C	C	.	.	I	π-helix	trans	-83.8	-32.4	-173	-168.5	-98.9	0	0	0	112.2	V68 L72 L148 P154 T252	V68-F152 HydrophobicContact CG1-CB 4.38Å; V68-F152 HydrophobicContact CG1-CD1 3.78Å; V68-F152 HydrophobicContact CG1-CD2 3.73Å; V68-F152 HydrophobicContact CG1-CE1 3.92Å; V68-F152 HydrophobicContact CG1-CE2 3.86Å; V68-F152 HydrophobicContact CG1-CG 3.69Å; V68-F152 HydrophobicContact CG1-CZ 3.95Å; L72-F152 HydrophobicContact CD1-CD1 3.75Å; L72-F152 HydrophobicContact CD1-CE1 3.42Å; L72-F152 VanDerWaalsContact CD1-CE1 3.42Å; L72-F152 HydrophobicContact CD1-CZ 4.3Å; L148-F152 HydrophobicContact CD1-CB 3.98Å; L148-F152 HydrophobicContact CD1-CD1 4.46Å; L148-F152 HydrophobicContact CD1-CG 4.42Å; L148-F152 WeakPolarHBondContact O-CB 3.35Å; L148-F152 PolarHBondContact O-N 3.5Å; L148-F152 VanDerWaalsContact O-N 3.07Å; F152-P154 HydrophobicContact CD1-CB 3.93Å; F152-P154 HydrophobicContact CD1-CG 4.45Å; F152-P154 HydrophobicContact CE1-CB 4.21Å; F152-T252 HydrophobicContact CD1-CG2 4.17Å; F152-T252 HydrophobicContact CE1-CG2 3.45Å; F152-T252 VanDerWaalsContact CE1-CG2 3.45Å; F152-T252 HydrophobicContact CE2-CG2 4.42Å; F152-T252 HydrophobicContact CZ-CG2 3.61Å
153	R	92.8	Very high	94.8	Very high	76 Å²	76	38 Å²	38	29%	0.287	20%	0.202	S	C	.	.			trans	47.9	58.9	177.7	-65.5	178.9	-72.7	156.1	5.4	111.9	L148 M149 Y214	L148-R153 PolarHBondContact O-N 3.02Å; M149-R153 WeakPolarHBondContact O-CG 3.16Å; R153-Y214 WeakPolarHBondContact CA-OH 3.19Å; R153-Y214 HydrophobicContact CB-CD2 4.43Å; R153-Y214 HydrophobicContact CB-CE2 3.92Å; R153-Y214 WeakPolarHBondContact CD-O 3.48Å; R153-Y214 HydrophobicContact CG-CD2 4.33Å; R153-Y214 HydrophobicContact CG-CE2 3.98Å; R153-Y214 PolarHBondContact NH1-O 3.2Å; R153-Y214 VanDerWaalsContact NH1-O 3.13Å
154	P	92.9	Very high	95	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.181	C	C	.	.			trans	-59.5	148	-177.7	27.1	-35.7	0	0	0	111.6	L72 M149 F152 I156 Y214 I248 S249	L72-P154 HydrophobicContact CD1-CB 3.92Å; L72-P154 HydrophobicContact CD2-CB 3.93Å; L72-P154 HydrophobicContact CD2-CG 3.96Å; M149-P154 HydrophobicContact CE-CG 4.41Å; M149-P154 HydrophobicContact SD-CG 4.06Å; F152-P154 HydrophobicContact CD1-CB 3.93Å; F152-P154 HydrophobicContact CD1-CG 4.45Å; F152-P154 HydrophobicContact CE1-CB 4.21Å; P154-I156 PolarHBondContact O-N 2.8Å; P154-Y214 VanDerWaalsContact CD-OH 3.26Å; P154-Y214 WeakPolarHBondContact CD-OH 3.43Å; P154-Y214 WeakPolarHBondContact O-CE1 3.33Å; P154-Y214 VanDerWaalsContact O-CZ 3.31Å; P154-Y214 PolarHBondContact O-OH 3.14Å; P154-I248 HydrophobicContact CB-CG2 3.62Å; P154-I248 HydrophobicContact CG-CG2 3.45Å; P154-I248 VanDerWaalsContact CG-CG2 3.45Å; P154-S249 WeakPolarHBondContact CB-O 3.22Å
155	D	94.9	Very high	95	Very high	17 Å²	17	37 Å²	37	9%	0.091	19%	0.185	C	C	.	.			trans	-59.3	130	-180	-70.8	-17.7	0	0	0	111.1	T210 F211 S212 S249 R251 T252 A253	D155-T210 HydrophobicContact CB-CG2 3.71Å; D155-F211 WeakPolarHBondContact CA-O 3.26Å; D155-S212 VanDerWaalsContact CG-OG 3.26Å; D155-S212 VanDerWaalsContact OD1-CB 3.31Å; D155-S212 WeakPolarHBondContact OD1-CB 3.42Å; D155-S212 PolarHBondContact OD1-OG 3.47Å; D155-S249 PolarHBondContact O-N 3.34Å; D155-R251 VanDerWaalsContact CB-O 3.3Å; D155-R251 WeakPolarHBondContact CB-O 3.3Å; D155-R251 VanDerWaalsContact CG-O 3.22Å; D155-R251 PolarHBondContact N-O 3.25Å; D155-R251 VanDerWaalsContact N-O 3.13Å; D155-T252 WeakPolarHBondContact OD2-CA 3.1Å; D155-A253 PolarHBondContact OD1-N 2.94Å
156	I	97.5	Very high	95.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	106.3	174.8	-56.9	170.5	0	0	0	107.4	M149 P154 V158 L178 T210 F211 Y214 I221 I246 I248	M149-I156 HydrophobicContact CE-CD1 4.14Å; P154-I156 PolarHBondContact O-N 2.8Å; I156-V158 HydrophobicContact CG2-CG2 4.37Å; I156-L178 HydrophobicContact CD1-CD1 3.96Å; I156-L178 HydrophobicContact CD1-CD2 3.71Å; I156-T210 WeakPolarHBondContact O-CA 3.14Å; I156-F211 HydrophobicContact CB-CB 4.26Å; I156-F211 HydrophobicContact CB-CD2 4.44Å; I156-F211 HydrophobicContact CG2-CD2 4.5Å; I156-F211 PolarHBondContact N-O 2.8Å; I156-F211 PolarHBondContact O-N 2.86Å; I156-Y214 HydrophobicContact CD1-CD1 4.36Å; I156-Y214 HydrophobicContact CD1-CE1 3.74Å; I156-Y214 HydrophobicContact CD1-CE2 4.41Å; I156-Y214 HydrophobicContact CG1-CE1 3.82Å; I156-I221 HydrophobicContact CD1-CD1 4.12Å; I156-I221 HydrophobicContact CG2-CD1 3.71Å; I156-I246 HydrophobicContact CG2-CG2 3.99Å; I156-I248 HydrophobicContact CG1-CG1 4.31Å
157	V	97.9	Very high	95.2	Very high	33 Å²	33	33.8 Å²	33.8	20%	0.2	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.8	-178.1	-174.4	0	0	0	0	109.3	K159 T210 I246 I247	V157-K159 HydrophobicContact CG1-CG 4.43Å; V157-T210 HydrophobicContact CG2-CG2 4.06Å; V157-I246 WeakPolarHBondContact O-CA 3.39Å; V157-I247 PolarHBondContact N-O 3.34Å; V157-I247 PolarHBondContact O-N 2.81Å
158	V	97.9	Very high	95.3	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.012	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	132.6	179.5	-172	0	0	0	0	108.7	I156 V176 S208 H209 F211 F223 S245 I246	I156-V158 HydrophobicContact CG2-CG2 4.37Å; V158-V176 HydrophobicContact CG1-CG2 3.91Å; V158-V176 HydrophobicContact CG2-CG1 4.07Å; V158-S208 CarbonylContact O-C 3.58Å; V158-S208 VanDerWaalsContact O-CA 3.31Å; V158-S208 WeakPolarHBondContact O-CA 3.46Å; V158-H209 PolarHBondContact N-O 3.4Å; V158-H209 PolarHBondContact O-N 3.13Å; V158-F211 HydrophobicContact CG2-CD2 4.32Å; V158-F211 HydrophobicContact CG2-CE2 4.12Å; V158-F223 HydrophobicContact CG1-CD2 3.79Å; V158-F223 HydrophobicContact CG1-CE2 3.66Å; V158-S245 CarbonylContact C-O 3.55Å; V158-S245 WeakPolarHBondContact CA-O 3.22Å; V158-I246 HydrophobicContact CG1-CG1 4.16Å; V158-I246 HydrophobicContact CG2-CG1 4.26Å
159	K	98.1	Very high	95.5	Very high	62 Å²	62	25.9 Å²	25.9	27%	0.27	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	146	174.7	-61.6	-179	164.4	-135.4	0	110.8	V157 E206 I207 S244 S245	V157-K159 HydrophobicContact CG1-CG 4.43Å; K159-E206 VanDerWaalsContact NZ-CD 3.29Å; K159-E206 IonicContact NZ-OE1 3.82Å; K159-E206 PolarHBondContact NZ-OE1 2.89Å; K159-E206 IonicContact NZ-OE2 3.3Å; K159-E206 PolarHBondContact NZ-OE2 3.22Å; K159-E206 VanDerWaalsContact NZ-OE2 3.1Å; K159-I207 CarbonylContact C-O 3.6Å; K159-I207 VanDerWaalsContact CA-O 3.27Å; K159-I207 WeakPolarHBondContact CA-O 3.41Å; K159-S244 CarbonylContact O-C 3.6Å; K159-S244 WeakPolarHBondContact O-CA 3.41Å; K159-S245 PolarHBondContact N-O 2.89Å; K159-S245 PolarHBondContact O-N 3.33Å
160	D	98.3	Very high	95.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	153.7	167.2	-161.4	32.1	0	0	0	110.8	Y172 E206 I207 F223 H225 S244	D160-Y172 PolarHBondContact OD2-OH 3.44Å; D160-E206 WeakPolarHBondContact O-CA 3.42Å; D160-I207 PolarHBondContact N-O 2.84Å; D160-I207 PolarHBondContact O-N 3.23Å; D160-F223 HydrophobicContact CB-CZ 4.06Å; D160-H225 IonicContact OD1-CE1 3.81Å; D160-H225 IonicContact OD1-ND1 2.66Å; D160-H225 IonicContact OD2-CE1 2.73Å; D160-H225 IonicContact OD2-CG 2.72Å; D160-H225 IonicContact OD2-ND1 3.63Å; D160-H225 PolarHBondContact OD2-ND1 2.61Å; D160-S244 WeakPolarHBondContact OD1-CA 3.03Å; D160-S244 VanDerWaalsContact OD1-CB 3.27Å; D160-S244 WeakPolarHBondContact OD1-CB 3.48Å; D160-S244 PolarHBondContact OD1-OG 2.78Å
161	W	98.1	Very high	95.8	Very high	39 Å²	39	24.7 Å²	24.7	15%	0.148	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	129.5	176.7	-71.1	78.2	0	0	0	110.6	F115 P116 W204 Q205 E206 V241 T242 N243	F115-W161 HydrophobicContact CE2-CB 3.81Å; F115-W161 AromaticContact CE2-CD2 3.57Å; F115-W161 HydrophobicContact CE2-CD2 3.57Å; F115-W161 AromaticContact CE2-CE3 3.69Å; F115-W161 HydrophobicContact CE2-CE3 3.69Å; F115-W161 AromaticContact CE2-CG 3.66Å; F115-W161 HydrophobicContact CE2-CG 3.66Å; F115-W161 HydrophobicContact CE2-CZ3 4.39Å; F115-W161 HydrophobicContact CZ-CB 4.3Å; F115-W161 AromaticContact CZ-CD2 3.57Å; F115-W161 HydrophobicContact CZ-CD2 3.57Å; F115-W161 AromaticContact CZ-CE2 3.77Å; F115-W161 HydrophobicContact CZ-CE3 4.02Å; F115-W161 AromaticContact CZ-CG 3.72Å; F115-W161 HydrophobicContact CZ-CG 3.72Å; F115-W161 HydrophobicContact CZ-CZ2 4.32Å; P116-W161 HydrophobicContact CG-CH2 4.28Å; P116-W161 HydrophobicContact CG-CZ3 4.18Å; W161-W204 HydrophobicContact CB-CE3 4.07Å; W161-W204 HydrophobicContact CB-CZ3 4.45Å; W161-W204 HydrophobicContact CE3-CB 3.85Å; W161-W204 HydrophobicContact CZ3-CB 4.11Å; W161-Q205 WeakPolarHBondContact CA-O 3.15Å; W161-E206 HydrophobicContact CD2-CB 3.94Å; W161-E206 HydrophobicContact CD2-CG 4.35Å; W161-E206 HydrophobicContact CE3-CB 4.04Å; W161-E206 HydrophobicContact CH2-CB 3.85Å; W161-E206 HydrophobicContact CZ2-CB 3.68Å; W161-E206 HydrophobicContact CZ2-CG 3.98Å; W161-E206 VanDerWaalsContact CZ2-OE2 3.3Å; W161-E206 WeakPolarHBondContact CZ2-OE2 3.24Å; W161-E206 HydrophobicContact CZ3-CB 4.02Å; W161-E206 PolarHBondContact NE1-OE2 2.99Å; W161-V241 VanDerWaalsContact O-CA 3.26Å; W161-V241 WeakPolarHBondContact O-CA 3.06Å; W161-T242 WeakPolarHBondContact CB-O 3.41Å; W161-T242 PolarHBondContact N-O 3.38Å; W161-T242 PolarHBondContact O-N 3.02Å; W161-T242 VanDerWaalsContact O-N 3.14Å; W161-N243 HydrophobicContact CG-CB 4.44Å
162	V	97.6	Very high	96.1	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	143	178.7	62.8	0	0	0	0	111.3	Y172 F196 W204 Q205 I207 P239 R240 V241	V162-Y172 HydrophobicContact CB-CD2 4.13Å; V162-Y172 HydrophobicContact CB-CE2 4.33Å; V162-Y172 HydrophobicContact CB-CG 4.25Å; V162-Y172 HydrophobicContact CG1-CD1 4.4Å; V162-Y172 HydrophobicContact CG1-CG 4.43Å; V162-Y172 HydrophobicContact CG2-CD2 3.72Å; V162-Y172 HydrophobicContact CG2-CE2 4.39Å; V162-Y172 HydrophobicContact CG2-CG 3.8Å; V162-F196 HydrophobicContact CG1-CE2 4.26Å; V162-F196 HydrophobicContact CG1-CZ 3.98Å; V162-F196 HydrophobicContact CG2-CE2 4.07Å; V162-W204 WeakPolarHBondContact O-CA 3.44Å; V162-Q205 HydrophobicContact CG1-CB 4.38Å; V162-Q205 PolarHBondContact N-O 3.19Å; V162-Q205 PolarHBondContact O-N 2.68Å; V162-I207 HydrophobicContact CG1-CD1 3.85Å; V162-I207 HydrophobicContact CG1-CG1 4.48Å; V162-P239 HydrophobicContact CG2-CB 3.88Å; V162-R240 CarbonylContact C-O 3.55Å; V162-R240 VanDerWaalsContact CA-O 3.22Å; V162-R240 WeakPolarHBondContact CA-O 3.41Å; V162-V241 HydrophobicContact CB-CG1 4.42Å; V162-V241 HydrophobicContact CG2-CG1 4.26Å
163	A	97.4	Very high	96.5	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.008	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	138.1	168	0	0	0	0	0	111.2	W204 R240	A163-W204 HydrophobicContact CB-CD2 3.49Å; A163-W204 VanDerWaalsContact CB-CD2 3.49Å; A163-W204 HydrophobicContact CB-CE3 3.61Å; A163-W204 HydrophobicContact CB-CG 3.95Å; A163-W204 HydrophobicContact CB-CH2 4.16Å; A163-W204 HydrophobicContact CB-CZ2 4.03Å; A163-W204 HydrophobicContact CB-CZ3 3.96Å; A163-R240 PolarHBondContact N-O 2.67Å; A163-R240 VanDerWaalsContact O-CB 3.31Å; A163-R240 WeakPolarHBondContact O-CB 3.46Å; A163-R240 PolarHBondContact O-N 2.84Å
164	P	96.4	Very high	96.8	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.006	9%	0.089	C	C	.	.			trans	-79.1	179.9	166.3	35.8	-37.5	0	0	0	111.4	F196 N200	P164-F196 HydrophobicContact CB-CB 3.6Å; P164-F196 HydrophobicContact CB-CD1 4.28Å; P164-F196 HydrophobicContact CB-CD2 4.1Å; P164-F196 HydrophobicContact CB-CG 3.73Å; P164-F196 HydrophobicContact CG-CB 3.85Å; P164-F196 HydrophobicContact CG-CD1 3.71Å; P164-F196 HydrophobicContact CG-CD2 4.33Å; P164-F196 HydrophobicContact CG-CE1 4.35Å; P164-F196 HydrophobicContact CG-CG 3.69Å; P164-N200 VanDerWaalsContact CG-OD1 3.25Å; P164-N200 WeakPolarHBondContact CG-OD1 3.41Å
165	R	95.5	Very high	97	Very high	25 Å²	25	21.6 Å²	21.6	9%	0.094	11%	0.105	C	C	.	.	B	Isolated β-bridge	trans	-93	148.2	160.9	-65.8	174.8	58.8	157.2	-4.5	109.9	D167 C168 N200 W236	R165-D167 WeakPolarHBondContact CB-OD1 3.42Å; R165-D167 IonicContact CZ-OD1 2.62Å; R165-D167 IonicContact CZ-OD2 3.1Å; R165-D167 IonicContact NE-OD1 3.46Å; R165-D167 PolarHBondContact NE-OD1 2.99Å; R165-D167 IonicContact NE-OD2 3.34Å; R165-D167 IonicContact NH2-OD1 3.92Å; R165-D167 PolarHBondContact NH2-OD1 3.26Å; R165-D167 IonicContact NH2-OD2 3.74Å; R165-D167 PolarHBondContact NH2-OD2 3.32Å; R165-D167 PolarHBondContact O-N 3.42Å; R165-C168 HydrophobicContact CB-CB 4.45Å; R165-C168 PolarHBondContact O-N 3.38Å; R165-N200 PolarHBondContact O-ND2 3.34Å; R165-N200 PolarHBondContact O-OD1 2.79Å; R165-W236 PolarHBondContact NH1-O 2.77Å; R165-W236 VanDerWaalsContact NH1-O 3.17Å
166	A	94.8	Very high	97.2	Very high	33 Å²	33	20.8 Å²	20.8	27%	0.273	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-34.4	176.2	0	0	0	0	0	111.8	C111 W199 A202	C111-A166 HydrophobicContact CB-CB 4.47Å; C111-A166 PolarHBondContact O-N 2.9Å; A166-W199 WeakPolarHBondContact O-CA 3.27Å; A166-W199 PolarHBondContact O-N 3.25Å; A166-A202 HydrophobicContact CB-CB 3.92Å
167	D	95.3	Very high	97.3	Very high	46 Å²	46	21.7 Å²	21.7	25%	0.246	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	0.2	-174.1	66.5	-26.7	0	0	0	114.3	C111 R165 Q198 W233	C111-D167 HydrophobicContact CB-CB 4.43Å; C111-D167 WeakPolarHBondContact CB-OD1 3.28Å; R165-D167 WeakPolarHBondContact CB-OD1 3.42Å; R165-D167 IonicContact CZ-OD1 2.62Å; R165-D167 IonicContact CZ-OD2 3.1Å; R165-D167 IonicContact NE-OD1 3.46Å; R165-D167 PolarHBondContact NE-OD1 2.99Å; R165-D167 IonicContact NE-OD2 3.34Å; R165-D167 IonicContact NH2-OD1 3.92Å; R165-D167 PolarHBondContact NH2-OD1 3.26Å; R165-D167 IonicContact NH2-OD2 3.74Å; R165-D167 PolarHBondContact NH2-OD2 3.32Å; R165-D167 PolarHBondContact O-N 3.42Å; D167-Q198 WeakPolarHBondContact O-CG 3.49Å; D167-Q198 PolarHBondContact O-NE2 2.86Å; D167-W233 WeakPolarHBondContact O-CZ3 3.39Å
168	C	94.6	Very high	97.3	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.096	C	C	.	.	B	Isolated β-bridge	trans	-147.4	140.2	179.4	-169.1	0	0	0	0	112.6	R165 Q231 W233 Y237	R165-C168 HydrophobicContact CB-CB 4.45Å; R165-C168 PolarHBondContact O-N 3.38Å; C168-Q231 VanDerWaalsContact SG-CG 3.52Å; C168-W233 HydrophobicContact CB-CE3 4.33Å; C168-W233 HydrophobicContact CB-CZ3 4.25Å; C168-Y237 HydrophobicContact CB-CD1 3.87Å
169	G	95.9	Very high	97.3	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.097	C	C	.	.			trans	-77.1	153.4	169.1	0	0	0	0	0	111.6	F196 T230	G169-F196 CarbonylContact C-O 3.52Å; G169-F196 WeakPolarHBondContact CA-O 3.39Å; G169-T230 VanDerWaalsContact C-OG1 3.26Å; G169-T230 WeakPolarHBondContact CA-OG1 3.37Å; G169-T230 PolarHBondContact O-N 2.97Å; G169-T230 PolarHBondContact O-OG1 3.28Å
170	C	97	Very high	97.3	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	156.6	179.4	77	0	0	0	0	112.1	T195 F196 Q228	C170-T195 WeakPolarHBondContact O-CA 3.4Å; C170-F196 PolarHBondContact N-O 3.47Å; C170-F196 PolarHBondContact O-N 2.72Å; C170-Q228 CarbonylContact C-O 3.58Å; C170-Q228 WeakPolarHBondContact CA-O 3.46Å; C170-Q228 WeakPolarHBondContact CB-O 3.49Å
171	T	97.7	Very high	97.2	Very high	25 Å²	25	20.8 Å²	20.8	15%	0.153	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.1	176.3	-59.2	0	0	0	0	109.9	P193 V194 T195 G227 Q228	T171-P193 HydrophobicContact CG2-CB 3.57Å; T171-V194 CarbonylContact C-O 3.47Å; T171-V194 WeakPolarHBondContact CA-O 3.27Å; T171-T195 PolarHBondContact OG1-OG1 3.43Å; T171-G227 WeakPolarHBondContact O-CA 3.47Å; T171-Q228 PolarHBondContact N-O 3.3Å; T171-Q228 PolarHBondContact O-N 3.06Å; T171-Q228 VanDerWaalsContact O-N 3.09Å
172	Y	98.2	Very high	97.2	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.008	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143.9	178.2	167.2	-95	0	0	0	111.3	D160 V162 L174 P193 V194 I207 H225 G226 P239 V241	D160-Y172 PolarHBondContact OD2-OH 3.44Å; V162-Y172 HydrophobicContact CB-CD2 4.13Å; V162-Y172 HydrophobicContact CB-CE2 4.33Å; V162-Y172 HydrophobicContact CB-CG 4.25Å; V162-Y172 HydrophobicContact CG1-CD1 4.4Å; V162-Y172 HydrophobicContact CG1-CG 4.43Å; V162-Y172 HydrophobicContact CG2-CD2 3.72Å; V162-Y172 HydrophobicContact CG2-CE2 4.39Å; V162-Y172 HydrophobicContact CG2-CG 3.8Å; Y172-L174 HydrophobicContact CE1-CB 3.8Å; Y172-L174 WeakPolarHBondContact OH-CB 3.31Å; Y172-P193 CarbonylContact O-C 3.38Å; Y172-P193 VanDerWaalsContact O-CA 3.27Å; Y172-P193 WeakPolarHBondContact O-CA 3.27Å; Y172-V194 HydrophobicContact CD1-CB 4.37Å; Y172-V194 HydrophobicContact CD1-CG2 4.42Å; Y172-V194 PolarHBondContact N-O 3.08Å; Y172-V194 PolarHBondContact O-N 3.14Å; Y172-I207 HydrophobicContact CD1-CD1 3.72Å; Y172-I207 HydrophobicContact CE1-CD1 3.21Å; Y172-H225 HydrophobicContact CE2-CB 4.05Å; Y172-G226 CarbonylContact C-O 3.54Å; Y172-G226 WeakPolarHBondContact CA-O 3.38Å; Y172-G226 WeakPolarHBondContact CD2-O 3.3Å; Y172-P239 HydrophobicContact CD2-CB 4.45Å; Y172-V241 HydrophobicContact CD2-CG1 3.86Å; Y172-V241 HydrophobicContact CE2-CG1 3.66Å
173	Q	97.9	Very high	97.1	Very high	67 Å²	67	32 Å²	32	31%	0.313	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	138.7	177.6	-61.4	-174.4	5.2	0	0	110.5	P193 H225 G226	Q173-P193 HydrophobicContact CG-CB 3.88Å; Q173-P193 HydrophobicContact CG-CG 3.96Å; Q173-H225 CarbonylContact O-C 3.51Å; Q173-H225 VanDerWaalsContact O-CA 3.22Å; Q173-H225 WeakPolarHBondContact O-CA 3.4Å; Q173-G226 PolarHBondContact N-O 2.7Å; Q173-G226 PolarHBondContact O-N 2.82Å
174	L	98.3	Very high	97.1	Very high	9 Å²	9	36.9 Å²	36.9	5%	0.047	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	136	174.4	-177.5	57.9	0	0	0	109	Y172 V176 F189 P191 I207 F223 H225	Y172-L174 HydrophobicContact CE1-CB 3.8Å; Y172-L174 WeakPolarHBondContact OH-CB 3.31Å; L174-V176 HydrophobicContact CD1-CG2 3.95Å; L174-V176 HydrophobicContact CG-CG2 4.1Å; L174-F189 HydrophobicContact CD2-CD1 4.34Å; L174-F189 HydrophobicContact CD2-CE1 3.91Å; L174-P191 HydrophobicContact CB-CG 4.24Å; L174-P191 WeakPolarHBondContact O-CD 3.46Å; L174-I207 HydrophobicContact CD2-CG2 3.85Å; L174-F223 HydrophobicContact CD1-CD2 4.44Å; L174-F223 HydrophobicContact CD1-CE1 4.4Å; L174-F223 HydrophobicContact CD1-CE2 3.81Å; L174-F223 HydrophobicContact CD1-CZ 3.79Å; L174-H225 HydrophobicContact CD1-CB 3.94Å
175	R	98.4	Very high	97.2	Very high	91 Å²	91	40 Å²	40	34%	0.343	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	123	173.4	170.5	173.5	-147.6	-168.3	14.4	108.9	Q177 E190 Q224	R175-Q177 HydrophobicContact CG-CG 4.13Å; R175-Q177 VanDerWaalsContact NE-NE2 3.13Å; R175-E190 HydrophobicContact CB-CG 4.13Å; R175-E190 HydrophobicContact CG-CG 3.78Å; R175-E190 IonicContact CZ-OE1 3.37Å; R175-E190 IonicContact CZ-OE2 3.61Å; R175-E190 IonicContact NE-OE1 3.61Å; R175-E190 PolarHBondContact NE-OE1 3.09Å; R175-E190 IonicContact NE-OE2 2.74Å; R175-E190 PolarHBondContact NE-OE2 2.97Å; R175-E190 IonicContact NH2-OE1 3.5Å; R175-E190 PolarHBondContact NH2-OE1 2.87Å; R175-E190 IonicContact NH2-OE2 3.51Å; R175-Q224 HydrophobicContact CB-CB 4.29Å; R175-Q224 PolarHBondContact N-O 3.15Å; R175-Q224 PolarHBondContact O-N 2.77Å; R175-Q224 VanDerWaalsContact O-O 3.1Å
176	V	98.6	Very high	97.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	129.4	175.3	-170	0	0	0	0	109.4	V158 L174 S188 F189 F211 I221 L222 F223	V158-V176 HydrophobicContact CG1-CG2 3.91Å; V158-V176 HydrophobicContact CG2-CG1 4.07Å; L174-V176 HydrophobicContact CD1-CG2 3.95Å; L174-V176 HydrophobicContact CG-CG2 4.1Å; V176-S188 CarbonylContact O-C 3.59Å; V176-S188 WeakPolarHBondContact O-CA 3.29Å; V176-F189 HydrophobicContact CB-CB 4.48Å; V176-F189 PolarHBondContact N-O 3.02Å; V176-F189 PolarHBondContact O-N 3.26Å; V176-F211 HydrophobicContact CB-CE2 4.21Å; V176-F211 HydrophobicContact CB-CZ 4.24Å; V176-F211 HydrophobicContact CG1-CE2 3.8Å; V176-F211 HydrophobicContact CG1-CZ 4.19Å; V176-I221 HydrophobicContact CG1-CG2 3.91Å; V176-L222 CarbonylContact C-O 3.59Å; V176-L222 VanDerWaalsContact CA-O 3.24Å; V176-L222 WeakPolarHBondContact CA-O 3.22Å; V176-F223 HydrophobicContact CG2-CD2 3.99Å; V176-F223 HydrophobicContact CG2-CE2 4.4Å
177	Q	98.6	Very high	97.4	Very high	20 Å²	20	41 Å²	41	9%	0.093	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	132.4	-177.5	-56.8	-172.6	-44.7	0	0	110.9	R175 V185 A187 E190 I221 L222	R175-Q177 HydrophobicContact CG-CG 4.13Å; R175-Q177 VanDerWaalsContact NE-NE2 3.13Å; Q177-V185 HydrophobicContact CB-CG1 4.21Å; Q177-V185 HydrophobicContact CB-CG2 4.43Å; Q177-V185 HydrophobicContact CG-CG1 4.41Å; Q177-A187 WeakPolarHBondContact CA-O 3.26Å; Q177-E190 PolarHBondContact NE2-OE1 3.39Å; Q177-I221 CarbonylContact O-C 3.59Å; Q177-I221 WeakPolarHBondContact O-CA 3.27Å; Q177-L222 HydrophobicContact CB-CB 4.28Å; Q177-L222 PolarHBondContact N-O 2.81Å; Q177-L222 PolarHBondContact O-N 2.82Å
178	L	98.6	Very high	97.6	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	124.6	167.3	-53.6	-172.1	0	0	0	107.8	I156 L186 A187 F211 Y214 V218 I221	I156-L178 HydrophobicContact CD1-CD1 3.96Å; I156-L178 HydrophobicContact CD1-CD2 3.71Å; L178-L186 PolarHBondContact O-N 3.03Å; L178-A187 HydrophobicContact CB-CB 4.24Å; L178-A187 HydrophobicContact CD1-CB 4.14Å; L178-A187 HydrophobicContact CG-CB 4.28Å; L178-A187 PolarHBondContact N-O 2.55Å; L178-A187 PolarHBondContact O-N 3.07Å; L178-F211 HydrophobicContact CD1-CB 3.81Å; L178-F211 HydrophobicContact CD1-CD1 3.82Å; L178-F211 HydrophobicContact CD1-CD2 4.28Å; L178-F211 HydrophobicContact CD1-CE1 4.43Å; L178-F211 HydrophobicContact CD1-CG 3.73Å; L178-F211 HydrophobicContact CD2-CD2 4.12Å; L178-F211 HydrophobicContact CD2-CE2 4.25Å; L178-F211 HydrophobicContact CD2-CG 4.39Å; L178-F211 HydrophobicContact CG-CD1 4.1Å; L178-F211 HydrophobicContact CG-CD2 4.28Å; L178-F211 HydrophobicContact CG-CE1 4.23Å; L178-F211 HydrophobicContact CG-CE2 4.4Å; L178-F211 HydrophobicContact CG-CG 4.12Å; L178-F211 HydrophobicContact CG-CZ 4.37Å; L178-Y214 HydrophobicContact CD1-CD1 3.99Å; L178-Y214 HydrophobicContact CD1-CD2 4.35Å; L178-Y214 HydrophobicContact CD1-CG 3.79Å; L178-V218 HydrophobicContact CB-CG1 3.97Å; L178-V218 HydrophobicContact CB-CG2 3.94Å; L178-V218 HydrophobicContact CD1-CG2 4.19Å; L178-V218 HydrophobicContact CD2-CG1 4.4Å; L178-I221 HydrophobicContact CD2-CB 4.48Å; L178-I221 HydrophobicContact CD2-CD1 4.36Å; L178-I221 HydrophobicContact CD2-CG1 3.85Å; L178-I221 HydrophobicContact CD2-CG2 4.1Å
179	A	98.4	Very high	97.7	Very high	5 Å²	5	43.9 Å²	43.9	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	152.8	-175.5	0	0	0	0	0	112.7	I184 R219 H220	A179-I184 CarbonylContact C-O 3.58Å; A179-I184 WeakPolarHBondContact CA-O 3.18Å; A179-R219 PolarHBondContact O-N 3.05Å; A179-H220 HydrophobicContact CB-CB 4.32Å; A179-H220 PolarHBondContact N-O 3.36Å; A179-H220 PolarHBondContact O-N 2.99Å
180	S	97.9	Very high	97.7	Very high	15 Å²	15	48.2 Å²	48.2	11%	0.105	25%	0.254	C	S	.	.			trans	-72.7	179.7	176.7	76.6	0	0	0	0	112.8	D182 Y183 I184 G217 H220	S180-D182 PolarHBondContact O-N 2.8Å; S180-D182 PolarHBondContact OG-N 3.07Å; S180-Y183 PolarHBondContact O-N 2.89Å; S180-Y183 VanDerWaalsContact O-N 3.1Å; S180-I184 PolarHBondContact N-O 2.88Å; S180-I184 WeakPolarHBondContact OG-CB 3.46Å; S180-I184 PolarHBondContact OG-N 2.68Å; S180-G217 VanDerWaalsContact CA-O 3.31Å; S180-G217 WeakPolarHBondContact CA-O 3.46Å; S180-H220 PolarHBondContact O-ND1 3.31Å
181	A	96.8	Very high	97.6	Very high	58 Å²	58	49.8 Å²	49.8	48%	0.479	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-36.4	171.4	0	0	0	0	0	112.5	Y183 R219	A181-Y183 PolarHBondContact O-N 2.79Å; A181-R219 HydrophobicContact CB-CG 4.06Å
182	D	96.7	Very high	97.5	Very high	129 Å²	129	53.8 Å²	53.8	69%	0.69	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	14.7	179.5	-53.8	-55.8	0	0	0	113	S180 I184	S180-D182 PolarHBondContact O-N 2.8Å; S180-D182 PolarHBondContact OG-N 3.07Å; D182-I184 HydrophobicContact CB-CD1 4.29Å; D182-I184 HydrophobicContact CB-CG1 4.27Å; D182-I184 PolarHBondContact O-N 2.84Å
183	Y	96.2	Very high	97.3	Very high	145 Å²	145	57.1 Å²	57.1	57%	0.569	31%	0.312	S	S	*	.			trans	61.3	23.8	-177.3	-54.9	-80.6	0	0	0	114.8	M136 S180 A181 H220	M136-Y183 HydrophobicContact CE-CD1 4.31Å; S180-Y183 PolarHBondContact O-N 2.89Å; S180-Y183 VanDerWaalsContact O-N 3.1Å; A181-Y183 PolarHBondContact O-N 2.79Å; Y183-H220 AromaticContact CD1-ND1 3.89Å; Y183-H220 AromaticContact CE1-CD2 3.93Å; Y183-H220 AromaticContact CE1-CE1 3.61Å; Y183-H220 AromaticContact CE1-CG 3.87Å; Y183-H220 AromaticContact CE1-ND1 3.68Å; Y183-H220 AromaticContact CE1-NE2 3.77Å; Y183-H220 AromaticContact CZ-CE1 3.8Å; Y183-H220 AromaticContact CZ-NE2 3.93Å
184	I	97.8	Very high	97.1	Very high	103 Å²	103	56.3 Å²	56.3	53%	0.528	31%	0.312	S	S	.	.			trans	-78.9	128.5	172.9	-58	170.8	0	0	0	108.6	A179 S180 D182 L186	A179-I184 CarbonylContact C-O 3.58Å; A179-I184 WeakPolarHBondContact CA-O 3.18Å; S180-I184 PolarHBondContact N-O 2.88Å; S180-I184 WeakPolarHBondContact OG-CB 3.46Å; S180-I184 PolarHBondContact OG-N 2.68Å; D182-I184 HydrophobicContact CB-CD1 4.29Å; D182-I184 HydrophobicContact CB-CG1 4.27Å; D182-I184 PolarHBondContact O-N 2.84Å; I184-L186 PolarHBondContact O-N 2.9Å
185	V	98.1	Very high	97	Very high	67 Å²	67	59.2 Å²	59.2	41%	0.406	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	121.9	179	-179.1	0	0	0	0	110.1	Q177	Q177-V185 HydrophobicContact CB-CG1 4.21Å; Q177-V185 HydrophobicContact CB-CG2 4.43Å; Q177-V185 HydrophobicContact CG-CG1 4.41Å
186	L	97.8	Very high	96.9	Very high	56 Å²	56	55.7 Å²	55.7	29%	0.293	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-33.2	178.8	-60.2	177.7	0	0	0	112.2	L178 I184 P215 V218	L178-L186 PolarHBondContact O-N 3.03Å; I184-L186 PolarHBondContact O-N 2.9Å; L186-P215 HydrophobicContact CB-CG 4.47Å; L186-V218 HydrophobicContact CD1-CG2 3.86Å
187	A	97.6	Very high	96.7	Very high	23 Å²	23	62.2 Å²	62.2	19%	0.19	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	151	174.2	0	0	0	0	0	110	Q177 L178 F211	Q177-A187 WeakPolarHBondContact CA-O 3.26Å; L178-A187 HydrophobicContact CB-CB 4.24Å; L178-A187 HydrophobicContact CD1-CB 4.14Å; L178-A187 HydrophobicContact CG-CB 4.28Å; L178-A187 PolarHBondContact N-O 2.55Å; L178-A187 PolarHBondContact O-N 3.07Å; A187-F211 HydrophobicContact CB-CD1 4.22Å; A187-F211 HydrophobicContact CB-CE1 4.22Å
188	S	97.6	Very high	96.4	Very high	67 Å²	67	62.7 Å²	62.7	47%	0.469	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	142.1	-179.6	59.2	0	0	0	0	111.9	V176	V176-S188 CarbonylContact O-C 3.59Å; V176-S188 WeakPolarHBondContact O-CA 3.29Å
189	F	97.6	Very high	96.1	Very high	40 Å²	40	72.5 Å²	72.5	18%	0.175	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	109.2	167.8	175.8	-113	0	0	0	108.5	L174 V176 P191 H209 F211	L174-F189 HydrophobicContact CD2-CD1 4.34Å; L174-F189 HydrophobicContact CD2-CE1 3.91Å; V176-F189 HydrophobicContact CB-CB 4.48Å; V176-F189 PolarHBondContact N-O 3.02Å; V176-F189 PolarHBondContact O-N 3.26Å; F189-P191 HydrophobicContact CD1-CG 4.43Å; F189-P191 HydrophobicContact CE1-CG 3.74Å; F189-P191 HydrophobicContact CE2-CB 4.24Å; F189-P191 HydrophobicContact CE2-CG 4.27Å; F189-P191 HydrophobicContact CZ-CB 3.94Å; F189-P191 HydrophobicContact CZ-CG 3.64Å; F189-H209 HydrophobicContact CD1-CB 3.6Å; F189-H209 AromaticContact CD1-CG 3.75Å; F189-H209 HydrophobicContact CD2-CB 4.12Å; F189-H209 AromaticContact CD2-CD2 3.87Å; F189-H209 AromaticContact CD2-CE1 3.64Å; F189-H209 AromaticContact CD2-CG 3.51Å; F189-H209 AromaticContact CD2-ND1 3.37Å; F189-H209 WeakPolarHBondContact CD2-ND1 3.44Å; F189-H209 AromaticContact CD2-NE2 3.93Å; F189-H209 HydrophobicContact CE1-CB 3.54Å; F189-H209 HydrophobicContact CE2-CB 4.08Å; F189-H209 AromaticContact CE2-CG 3.83Å; F189-H209 AromaticContact CE2-ND1 3.56Å; F189-H209 HydrophobicContact CG-CB 3.89Å; F189-H209 AromaticContact CG-CD2 3.55Å; F189-H209 AromaticContact CG-CG 3.47Å; F189-H209 VanDerWaalsContact CG-CG 3.47Å; F189-H209 AromaticContact CG-ND1 3.84Å; F189-H209 AromaticContact CG-NE2 3.95Å; F189-H209 HydrophobicContact CZ-CB 3.79Å; F189-F211 HydrophobicContact CB-CE1 4.01Å; F189-F211 HydrophobicContact CB-CE2 4.3Å; F189-F211 HydrophobicContact CB-CZ 3.49Å; F189-F211 VanDerWaalsContact CB-CZ 3.49Å
190	E	95.8	Very high	95.8	Very high	90 Å²	90	73.9 Å²	73.9	42%	0.421	39%	0.394	S	S	.	.			trans	-134.1	75.3	-177.4	-65.1	-176.2	-151	0	0	107.8	R175 Q177	R175-E190 HydrophobicContact CB-CG 4.13Å; R175-E190 HydrophobicContact CG-CG 3.78Å; R175-E190 IonicContact CZ-OE1 3.37Å; R175-E190 IonicContact CZ-OE2 3.61Å; R175-E190 IonicContact NE-OE1 3.61Å; R175-E190 PolarHBondContact NE-OE1 3.09Å; R175-E190 IonicContact NE-OE2 2.74Å; R175-E190 PolarHBondContact NE-OE2 2.97Å; R175-E190 IonicContact NH2-OE1 3.5Å; R175-E190 PolarHBondContact NH2-OE1 2.87Å; R175-E190 IonicContact NH2-OE2 3.51Å; Q177-E190 PolarHBondContact NE2-OE1 3.39Å
191	P	94.1	Very high	95.6	Very high	34 Å²	34	77.3 Å²	77.3	22%	0.221	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-61.3	150.6	177.9	27.2	-35.5	0	0	0	110.2	L174 F189	L174-P191 HydrophobicContact CB-CG 4.24Å; L174-P191 WeakPolarHBondContact O-CD 3.46Å; F189-P191 HydrophobicContact CD1-CG 4.43Å; F189-P191 HydrophobicContact CE1-CG 3.74Å; F189-P191 HydrophobicContact CE2-CB 4.24Å; F189-P191 HydrophobicContact CE2-CG 4.27Å; F189-P191 HydrophobicContact CZ-CB 3.94Å; F189-P191 HydrophobicContact CZ-CG 3.64Å
192	P	95.5	Very high	95.5	Very high	109 Å²	109	74.7 Å²	74.7	71%	0.708	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-52.4	145.4	172.8	-25.3	34	0	0	0	111.4	V194	P192-V194 PolarHBondContact O-N 3.04Å
193	P	94.6	Very high	95.4	Very high	72 Å²	72	74.2 Å²	74.2	47%	0.468	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-53.5	128.4	178.7	-26.5	33.9	0	0	0	112.1	T171 Y172 Q173	T171-P193 HydrophobicContact CG2-CB 3.57Å; Y172-P193 CarbonylContact O-C 3.38Å; Y172-P193 VanDerWaalsContact O-CA 3.27Å; Y172-P193 WeakPolarHBondContact O-CA 3.27Å; Q173-P193 HydrophobicContact CG-CB 3.88Å; Q173-P193 HydrophobicContact CG-CG 3.96Å
194	V	95	Very high	95.4	Very high	49 Å²	49	68.5 Å²	68.5	30%	0.297	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	119.9	178.8	-178.2	0	0	0	0	108.2	T171 Y172 P192 F196	T171-V194 CarbonylContact C-O 3.47Å; T171-V194 WeakPolarHBondContact CA-O 3.27Å; Y172-V194 HydrophobicContact CD1-CB 4.37Å; Y172-V194 HydrophobicContact CD1-CG2 4.42Å; Y172-V194 PolarHBondContact N-O 3.08Å; Y172-V194 PolarHBondContact O-N 3.14Å; P192-V194 PolarHBondContact O-N 3.04Å; V194-F196 HydrophobicContact CB-CE2 4.48Å; V194-F196 HydrophobicContact CG1-CE1 4.27Å; V194-F196 HydrophobicContact CG1-CE2 3.83Å; V194-F196 HydrophobicContact CG1-CZ 3.69Å
195	T	95.9	Very high	95.3	Very high	71 Å²	71	67.6 Å²	67.6	44%	0.436	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.3	-179.8	-59.7	0	0	0	0	110.8	C170 T171 T230	C170-T195 WeakPolarHBondContact O-CA 3.4Å; T171-T195 PolarHBondContact OG1-OG1 3.43Å; T195-T230 HydrophobicContact CG2-CG2 4.27Å
196	F	95.8	Very high	95.2	Very high	16 Å²	16	68.4 Å²	68.4	7%	0.07	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130.2	174	-59.6	-82.5	0	0	0	109.3	V162 P164 G169 C170 V194	V162-F196 HydrophobicContact CG1-CE2 4.26Å; V162-F196 HydrophobicContact CG1-CZ 3.98Å; V162-F196 HydrophobicContact CG2-CE2 4.07Å; P164-F196 HydrophobicContact CB-CB 3.6Å; P164-F196 HydrophobicContact CB-CD1 4.28Å; P164-F196 HydrophobicContact CB-CD2 4.1Å; P164-F196 HydrophobicContact CB-CG 3.73Å; P164-F196 HydrophobicContact CG-CB 3.85Å; P164-F196 HydrophobicContact CG-CD1 3.71Å; P164-F196 HydrophobicContact CG-CD2 4.33Å; P164-F196 HydrophobicContact CG-CE1 4.35Å; P164-F196 HydrophobicContact CG-CG 3.69Å; G169-F196 CarbonylContact C-O 3.52Å; G169-F196 WeakPolarHBondContact CA-O 3.39Å; C170-F196 PolarHBondContact N-O 3.47Å; C170-F196 PolarHBondContact O-N 2.72Å; V194-F196 HydrophobicContact CB-CE2 4.48Å; V194-F196 HydrophobicContact CG1-CE1 4.27Å; V194-F196 HydrophobicContact CG1-CE2 3.83Å; V194-F196 HydrophobicContact CG1-CZ 3.69Å
197	Q	94.6	Very high	95.1	Very high	138 Å²	138	67.2 Å²	67.2	65%	0.645	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-76.8	156.1	174.3	-62.8	-57.3	-41.8	0	0	110.5	N200	Q197-N200 WeakPolarHBondContact O-CB 3.47Å; Q197-N200 PolarHBondContact O-ND2 2.79Å
198	Q	92.1	Very high	95.1	Very high	29 Å²	29	69 Å²	69	14%	0.136	36%	0.356	C	S	.	.	S	Bend	trans	-64.3	157.2	169.7	-171.9	175.4	17.4	0	0	110.1	D167 N200 W233	D167-Q198 WeakPolarHBondContact O-CG 3.49Å; D167-Q198 PolarHBondContact O-NE2 2.86Å; Q198-N200 VanDerWaalsContact C-N 3.31Å; Q198-N200 PolarHBondContact O-N 2.79Å; Q198-W233 VanDerWaalsContact NE2-CH2 3.29Å
199	W	92.6	Very high	95	Very high	207 Å²	207	68.4 Å²	68.4	78%	0.784	35%	0.346	S	S	*	.	S	Bend	trans	60.4	38	-173.4	-46.6	-87	0	0	0	113.5	A166	A166-W199 WeakPolarHBondContact O-CA 3.27Å; A166-W199 PolarHBondContact O-N 3.25Å
200	N	92.8	Very high	95	Very high	34 Å²	34	69.2 Å²	69.2	18%	0.182	35%	0.354	C	S	.	.			trans	-84.8	175.8	173.4	63.1	69.2	0	0	0	112.1	P164 R165 Q197 Q198 A202	P164-N200 VanDerWaalsContact CG-OD1 3.25Å; P164-N200 WeakPolarHBondContact CG-OD1 3.41Å; R165-N200 PolarHBondContact O-ND2 3.34Å; R165-N200 PolarHBondContact O-OD1 2.79Å; Q197-N200 WeakPolarHBondContact O-CB 3.47Å; Q197-N200 PolarHBondContact O-ND2 2.79Å; Q198-N200 VanDerWaalsContact C-N 3.31Å; Q198-N200 PolarHBondContact O-N 2.79Å; N200-A202 PolarHBondContact O-N 3.03Å; N200-A202 WeakPolarHBondContact OD1-CA 3.44Å; N200-A202 PolarHBondContact OD1-N 3.08Å
201	D	92.5	Very high	95	Very high	87 Å²	87	65.6 Å²	65.6	47%	0.465	34%	0.337	S	S	.	.			trans	-80.2	-0.9	179.9	68.7	-3.9	0	0	0	114.4	K203	D201-K203 HydrophobicContact CB-CD 4.49Å; D201-K203 HydrophobicContact CB-CG 4.18Å; D201-K203 PolarHBondContact O-N 2.97Å; D201-K203 VanDerWaalsContact O-N 3.08Å; D201-K203 PolarHBondContact OD1-N 2.81Å; D201-K203 WeakPolarHBondContact OD2-CD 3.4Å; D201-K203 WeakPolarHBondContact OD2-CE 3.29Å; D201-K203 WeakPolarHBondContact OD2-CG 3.22Å; D201-K203 IonicContact OD2-NZ 3.2Å; D201-K203 PolarHBondContact OD2-NZ 2.88Å
202	A	93.9	Very high	95	Very high	3 Å²	3	66.1 Å²	66.1	3%	0.025	34%	0.341	C	S	.	.			trans	50	30.5	-179.1	0	0	0	0	0	114.1	T113 A166 N200	T113-A202 HydrophobicContact CG2-CB 4.5Å; T113-A202 PolarHBondContact OG1-O 2.84Å; A166-A202 HydrophobicContact CB-CB 3.92Å; N200-A202 PolarHBondContact O-N 3.03Å; N200-A202 WeakPolarHBondContact OD1-CA 3.44Å; N200-A202 PolarHBondContact OD1-N 3.08Å
203	K	94.9	Very high	94.8	Very high	118 Å²	118	65.4 Å²	65.4	51%	0.513	33%	0.332	S	S	.	.			trans	-80.4	146.6	179.6	-70.9	-173.5	-164.1	153.6	0	112	D201	D201-K203 HydrophobicContact CB-CD 4.49Å; D201-K203 HydrophobicContact CB-CG 4.18Å; D201-K203 PolarHBondContact O-N 2.97Å; D201-K203 VanDerWaalsContact O-N 3.08Å; D201-K203 PolarHBondContact OD1-N 2.81Å; D201-K203 WeakPolarHBondContact OD2-CD 3.4Å; D201-K203 WeakPolarHBondContact OD2-CE 3.29Å; D201-K203 WeakPolarHBondContact OD2-CG 3.22Å; D201-K203 IonicContact OD2-NZ 3.2Å; D201-K203 PolarHBondContact OD2-NZ 2.88Å
204	W	97.1	Very high	94.8	Very high	25 Å²	25	62.4 Å²	62.4	10%	0.095	31%	0.311	C	S	.	.			trans	-70.3	128.3	169.1	-70.4	94.7	0	0	0	110.7	L107 T113 F115 Y123 W161 V162 A163 R240 T242	L107-W204 HydrophobicContact CD2-CZ2 3.64Å; T113-W204 PolarHBondContact O-NE1 2.82Å; F115-W204 HydrophobicContact CD2-CB 4.23Å; F115-W204 AromaticContact CD2-CD2 3.57Å; F115-W204 HydrophobicContact CD2-CD2 3.57Å; F115-W204 AromaticContact CD2-CE2 3.92Å; F115-W204 AromaticContact CD2-CE3 3.97Å; F115-W204 HydrophobicContact CD2-CE3 3.97Å; F115-W204 AromaticContact CD2-CG 3.68Å; F115-W204 HydrophobicContact CD2-CG 3.68Å; F115-W204 HydrophobicContact CE2-CB 4.37Å; F115-W204 HydrophobicContact CE2-CD2 4.07Å; F115-W204 HydrophobicContact CE2-CE3 4.06Å; F115-W204 HydrophobicContact CE2-CG 4.22Å; Y123-W204 HydrophobicContact CD1-CZ2 4.39Å; Y123-W204 HydrophobicContact CG-CH2 4.23Å; Y123-W204 HydrophobicContact CG-CZ2 4.46Å; W161-W204 HydrophobicContact CB-CE3 4.07Å; W161-W204 HydrophobicContact CB-CZ3 4.45Å; W161-W204 HydrophobicContact CE3-CB 3.85Å; W161-W204 HydrophobicContact CZ3-CB 4.11Å; V162-W204 WeakPolarHBondContact O-CA 3.44Å; A163-W204 HydrophobicContact CB-CD2 3.49Å; A163-W204 VanDerWaalsContact CB-CD2 3.49Å; A163-W204 HydrophobicContact CB-CE3 3.61Å; A163-W204 HydrophobicContact CB-CG 3.95Å; A163-W204 HydrophobicContact CB-CH2 4.16Å; A163-W204 HydrophobicContact CB-CZ2 4.03Å; A163-W204 HydrophobicContact CB-CZ3 3.96Å; W204-R240 HydrophobicContact CH2-CB 3.79Å; W204-R240 HydrophobicContact CZ2-CB 4.41Å; W204-R240 HydrophobicContact CZ3-CB 4.38Å; W204-T242 HydrophobicContact CE3-CG2 4.3Å; W204-T242 HydrophobicContact CH2-CG2 3.73Å; W204-T242 HydrophobicContact CZ2-CG2 4.49Å; W204-T242 HydrophobicContact CZ3-CG2 3.63Å
205	Q	95.7	Very high	94.8	Very high	85 Å²	85	62.8 Å²	62.8	40%	0.397	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129	176.8	-60.7	-171.4	0.7	0	0	109.6	W161 V162	W161-Q205 WeakPolarHBondContact CA-O 3.15Å; V162-Q205 HydrophobicContact CG1-CB 4.38Å; V162-Q205 PolarHBondContact N-O 3.19Å; V162-Q205 PolarHBondContact O-N 2.68Å
206	E	96.4	Very high	94.8	Very high	84 Å²	84	63.2 Å²	63.2	39%	0.393	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	128.6	171.9	-171.9	176.9	92.3	0	0	109.3	K159 D160 W161	K159-E206 VanDerWaalsContact NZ-CD 3.29Å; K159-E206 IonicContact NZ-OE1 3.82Å; K159-E206 PolarHBondContact NZ-OE1 2.89Å; K159-E206 IonicContact NZ-OE2 3.3Å; K159-E206 PolarHBondContact NZ-OE2 3.22Å; K159-E206 VanDerWaalsContact NZ-OE2 3.1Å; D160-E206 WeakPolarHBondContact O-CA 3.42Å; W161-E206 HydrophobicContact CD2-CB 3.94Å; W161-E206 HydrophobicContact CD2-CG 4.35Å; W161-E206 HydrophobicContact CE3-CB 4.04Å; W161-E206 HydrophobicContact CH2-CB 3.85Å; W161-E206 HydrophobicContact CZ2-CB 3.68Å; W161-E206 HydrophobicContact CZ2-CG 3.98Å; W161-E206 VanDerWaalsContact CZ2-OE2 3.3Å; W161-E206 WeakPolarHBondContact CZ2-OE2 3.24Å; W161-E206 HydrophobicContact CZ3-CB 4.02Å; W161-E206 PolarHBondContact NE1-OE2 2.99Å
207	I	95.8	Very high	94.9	Very high	30 Å²	30	63.4 Å²	63.4	15%	0.154	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	122.2	169.1	-61.2	171.3	0	0	0	106.4	K159 D160 V162 Y172 L174	K159-I207 CarbonylContact C-O 3.6Å; K159-I207 VanDerWaalsContact CA-O 3.27Å; K159-I207 WeakPolarHBondContact CA-O 3.41Å; D160-I207 PolarHBondContact N-O 2.84Å; D160-I207 PolarHBondContact O-N 3.23Å; V162-I207 HydrophobicContact CG1-CD1 3.85Å; V162-I207 HydrophobicContact CG1-CG1 4.48Å; Y172-I207 HydrophobicContact CD1-CD1 3.72Å; Y172-I207 HydrophobicContact CE1-CD1 3.21Å; L174-I207 HydrophobicContact CD2-CG2 3.85Å
208	S	96.1	Very high	95	Very high	62 Å²	62	56.9 Å²	56.9	43%	0.434	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	138.9	-177.4	-172	0	0	0	0	110.4	V158	V158-S208 CarbonylContact O-C 3.58Å; V158-S208 VanDerWaalsContact O-CA 3.31Å; V158-S208 WeakPolarHBondContact O-CA 3.46Å
209	H	96.7	Very high	95.3	Very high	53 Å²	53	56.8 Å²	56.8	25%	0.245	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	144.5	171.8	-177.4	71.5	0	0	0	109.9	V158 F189 F211	V158-H209 PolarHBondContact N-O 3.4Å; V158-H209 PolarHBondContact O-N 3.13Å; F189-H209 HydrophobicContact CD1-CB 3.6Å; F189-H209 AromaticContact CD1-CG 3.75Å; F189-H209 HydrophobicContact CD2-CB 4.12Å; F189-H209 AromaticContact CD2-CD2 3.87Å; F189-H209 AromaticContact CD2-CE1 3.64Å; F189-H209 AromaticContact CD2-CG 3.51Å; F189-H209 AromaticContact CD2-ND1 3.37Å; F189-H209 WeakPolarHBondContact CD2-ND1 3.44Å; F189-H209 AromaticContact CD2-NE2 3.93Å; F189-H209 HydrophobicContact CE1-CB 3.54Å; F189-H209 HydrophobicContact CE2-CB 4.08Å; F189-H209 AromaticContact CE2-CG 3.83Å; F189-H209 AromaticContact CE2-ND1 3.56Å; F189-H209 HydrophobicContact CG-CB 3.89Å; F189-H209 AromaticContact CG-CD2 3.55Å; F189-H209 AromaticContact CG-CG 3.47Å; F189-H209 VanDerWaalsContact CG-CG 3.47Å; F189-H209 AromaticContact CG-ND1 3.84Å; F189-H209 AromaticContact CG-NE2 3.95Å; F189-H209 HydrophobicContact CZ-CB 3.79Å; H209-F211 AromaticContact CD2-CD2 3.76Å; H209-F211 AromaticContact CD2-CE1 3.98Å; H209-F211 AromaticContact CD2-CE2 3.6Å; H209-F211 AromaticContact CD2-CZ 3.73Å; H209-F211 AromaticContact NE2-CD1 3.66Å; H209-F211 AromaticContact NE2-CE1 3.65Å; H209-F211 AromaticContact NE2-CG 3.92Å; H209-F211 AromaticContact NE2-CZ 3.9Å
210	T	97.2	Very high	95.6	Very high	58 Å²	58	47.7 Å²	47.7	36%	0.356	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	120.3	176.1	-58.4	0	0	0	0	108.5	D155 I156 V157	D155-T210 HydrophobicContact CB-CG2 3.71Å; I156-T210 WeakPolarHBondContact O-CA 3.14Å; V157-T210 HydrophobicContact CG2-CG2 4.06Å
211	F	96.7	Very high	95.9	Very high	14 Å²	14	46.1 Å²	46.1	6%	0.061	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	116.6	166.8	-62.1	-88.4	0	0	0	108.6	D155 I156 V158 V176 L178 A187 F189 H209 Y214	D155-F211 WeakPolarHBondContact CA-O 3.26Å; I156-F211 HydrophobicContact CB-CB 4.26Å; I156-F211 HydrophobicContact CB-CD2 4.44Å; I156-F211 HydrophobicContact CG2-CD2 4.5Å; I156-F211 PolarHBondContact N-O 2.8Å; I156-F211 PolarHBondContact O-N 2.86Å; V158-F211 HydrophobicContact CG2-CD2 4.32Å; V158-F211 HydrophobicContact CG2-CE2 4.12Å; V176-F211 HydrophobicContact CB-CE2 4.21Å; V176-F211 HydrophobicContact CB-CZ 4.24Å; V176-F211 HydrophobicContact CG1-CE2 3.8Å; V176-F211 HydrophobicContact CG1-CZ 4.19Å; L178-F211 HydrophobicContact CD1-CB 3.81Å; L178-F211 HydrophobicContact CD1-CD1 3.82Å; L178-F211 HydrophobicContact CD1-CD2 4.28Å; L178-F211 HydrophobicContact CD1-CE1 4.43Å; L178-F211 HydrophobicContact CD1-CG 3.73Å; L178-F211 HydrophobicContact CD2-CD2 4.12Å; L178-F211 HydrophobicContact CD2-CE2 4.25Å; L178-F211 HydrophobicContact CD2-CG 4.39Å; L178-F211 HydrophobicContact CG-CD1 4.1Å; L178-F211 HydrophobicContact CG-CD2 4.28Å; L178-F211 HydrophobicContact CG-CE1 4.23Å; L178-F211 HydrophobicContact CG-CE2 4.4Å; L178-F211 HydrophobicContact CG-CG 4.12Å; L178-F211 HydrophobicContact CG-CZ 4.37Å; A187-F211 HydrophobicContact CB-CD1 4.22Å; A187-F211 HydrophobicContact CB-CE1 4.22Å; F189-F211 HydrophobicContact CB-CE1 4.01Å; F189-F211 HydrophobicContact CB-CE2 4.3Å; F189-F211 HydrophobicContact CB-CZ 3.49Å; F189-F211 VanDerWaalsContact CB-CZ 3.49Å; H209-F211 AromaticContact CD2-CD2 3.76Å; H209-F211 AromaticContact CD2-CE1 3.98Å; H209-F211 AromaticContact CD2-CE2 3.6Å; H209-F211 AromaticContact CD2-CZ 3.73Å; H209-F211 AromaticContact NE2-CD1 3.66Å; H209-F211 AromaticContact NE2-CE1 3.65Å; H209-F211 AromaticContact NE2-CG 3.92Å; H209-F211 AromaticContact NE2-CZ 3.9Å; F211-Y214 HydrophobicContact CB-CD1 3.95Å
212	S	93.7	Very high	96.2	Very high	44 Å²	44	43.2 Å²	43.2	31%	0.308	24%	0.236	S	C	.	.			trans	-120.3	153.2	172.1	-61.8	0	0	0	0	109.4	D155 Y214	D155-S212 VanDerWaalsContact CG-OG 3.26Å; D155-S212 VanDerWaalsContact OD1-CB 3.31Å; D155-S212 WeakPolarHBondContact OD1-CB 3.42Å; D155-S212 PolarHBondContact OD1-OG 3.47Å; S212-Y214 PolarHBondContact O-N 2.88Å
213	D	91.2	Very high	96.4	Very high	95 Å²	95	43.1 Å²	43.1	51%	0.508	23%	0.234	S	C	.	.	S	Bend	trans	51.8	29.9	176.2	-63.1	-52	0	0	0	114.8	A253	D213-A253 WeakPolarHBondContact OD2-CB 3.41Å
214	Y	94.6	Very high	96.6	Very high	8 Å²	8	39.2 Å²	39.2	3%	0.031	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-63.6	160.4	178.3	46.6	-96.1	0	0	0	111.9	M149 R153 P154 I156 L178 F211 S212 V218	M149-Y214 HydrophobicContact CE-CE2 4Å; M149-Y214 WeakPolarHBondContact CE-OH 3.16Å; R153-Y214 WeakPolarHBondContact CA-OH 3.19Å; R153-Y214 HydrophobicContact CB-CD2 4.43Å; R153-Y214 HydrophobicContact CB-CE2 3.92Å; R153-Y214 WeakPolarHBondContact CD-O 3.48Å; R153-Y214 HydrophobicContact CG-CD2 4.33Å; R153-Y214 HydrophobicContact CG-CE2 3.98Å; R153-Y214 PolarHBondContact NH1-O 3.2Å; R153-Y214 VanDerWaalsContact NH1-O 3.13Å; P154-Y214 VanDerWaalsContact CD-OH 3.26Å; P154-Y214 WeakPolarHBondContact CD-OH 3.43Å; P154-Y214 WeakPolarHBondContact O-CE1 3.33Å; P154-Y214 VanDerWaalsContact O-CZ 3.31Å; P154-Y214 PolarHBondContact O-OH 3.14Å; I156-Y214 HydrophobicContact CD1-CD1 4.36Å; I156-Y214 HydrophobicContact CD1-CE1 3.74Å; I156-Y214 HydrophobicContact CD1-CE2 4.41Å; I156-Y214 HydrophobicContact CG1-CE1 3.82Å; L178-Y214 HydrophobicContact CD1-CD1 3.99Å; L178-Y214 HydrophobicContact CD1-CD2 4.35Å; L178-Y214 HydrophobicContact CD1-CG 3.79Å; F211-Y214 HydrophobicContact CB-CD1 3.95Å; S212-Y214 PolarHBondContact O-N 2.88Å; Y214-V218 HydrophobicContact CD2-CB 4.34Å; Y214-V218 HydrophobicContact CD2-CG2 3.61Å; Y214-V218 HydrophobicContact CE2-CB 4.33Å; Y214-V218 HydrophobicContact CE2-CG2 4.1Å; Y214-V218 HydrophobicContact CG-CG2 4.4Å
215	P	95.1	Very high	96.7	Very high	57 Å²	57	38 Å²	38	37%	0.37	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-59.4	147.9	176.5	-23.4	34.2	0	0	0	111.8	L186	L186-P215 HydrophobicContact CB-CG 4.47Å
216	P	96	Very high	96.8	Very high	80 Å²	80	34 Å²	34	52%	0.519	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	160.1	168.6	29.5	-35.5	0	0	0	110.5	D150	D150-P216 HydrophobicContact CB-CB 4.09Å
217	G	96.8	Very high	96.9	Very high	21 Å²	21	30 Å²	30	22%	0.216	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.9	2.3	178.4	0	0	0	0	0	114.5	D150 S180 R219	D150-G217 WeakPolarHBondContact OD1-CA 3.43Å; D150-G217 PolarHBondContact OD1-N 2.86Å; S180-G217 VanDerWaalsContact CA-O 3.31Å; S180-G217 WeakPolarHBondContact CA-O 3.46Å; G217-R219 PolarHBondContact O-N 2.73Å
218	V	98.2	Very high	97	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.18	C	C	.	.			trans	-64.8	124.6	175.6	178.8	0	0	0	0	109.9	L139 L178 L186 Y214	L139-V218 HydrophobicContact CD1-CG1 3.84Å; L178-V218 HydrophobicContact CB-CG1 3.97Å; L178-V218 HydrophobicContact CB-CG2 3.94Å; L178-V218 HydrophobicContact CD1-CG2 4.19Å; L178-V218 HydrophobicContact CD2-CG1 4.4Å; L186-V218 HydrophobicContact CD1-CG2 3.86Å; Y214-V218 HydrophobicContact CD2-CB 4.34Å; Y214-V218 HydrophobicContact CD2-CG2 3.61Å; Y214-V218 HydrophobicContact CE2-CB 4.33Å; Y214-V218 HydrophobicContact CE2-CG2 4.1Å; Y214-V218 HydrophobicContact CG-CG2 4.4Å
219	R	98.3	Very high	97	Very high	28 Å²	28	28 Å²	28	11%	0.106	16%	0.159	C	C	.	.			trans	-127.9	-27.3	178.6	-61.4	-60.8	177	-95.1	0.3	112.8	L139 E146 D150 A179 A181 G217	L139-R219 WeakPolarHBondContact CB-O 2.96Å; L139-R219 WeakPolarHBondContact CG-O 3.37Å; L139-R219 PolarHBondContact N-O 3.04Å; E146-R219 IonicContact OE2-CZ 2.73Å; E146-R219 IonicContact OE2-NE 3.77Å; E146-R219 PolarHBondContact OE2-NE 2.89Å; E146-R219 IonicContact OE2-NH2 3.55Å; E146-R219 PolarHBondContact OE2-NH2 3.25Å; E146-R219 VanDerWaalsContact OE2-NH2 3.15Å; D150-R219 IonicContact OD1-CZ 3.61Å; D150-R219 IonicContact OD1-NH1 2.69Å; D150-R219 PolarHBondContact OD1-NH1 3Å; D150-R219 IonicContact OD1-NH2 3.23Å; D150-R219 PolarHBondContact OD1-NH2 2.9Å; D150-R219 IonicContact OD2-CZ 3.15Å; D150-R219 IonicContact OD2-NH1 2.77Å; D150-R219 IonicContact OD2-NH2 3.24Å; D150-R219 PolarHBondContact OD2-NH2 2.89Å; A179-R219 PolarHBondContact O-N 3.05Å; A181-R219 HydrophobicContact CB-CG 4.06Å; G217-R219 PolarHBondContact O-N 2.73Å
220	H	98.5	Very high	96.9	Very high	16 Å²	16	27.9 Å²	27.9	7%	0.074	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	150.1	-177.6	-53.1	103.1	0	0	0	111.4	M136 V137 A179 S180 Y183	M136-H220 HydrophobicContact CG-CB 4.49Å; M136-H220 HydrophobicContact SD-CB 3.81Å; V137-H220 VanDerWaalsContact O-CA 3.23Å; V137-H220 WeakPolarHBondContact O-CA 3.34Å; A179-H220 HydrophobicContact CB-CB 4.32Å; A179-H220 PolarHBondContact N-O 3.36Å; A179-H220 PolarHBondContact O-N 2.99Å; S180-H220 PolarHBondContact O-ND1 3.31Å; Y183-H220 AromaticContact CD1-ND1 3.89Å; Y183-H220 AromaticContact CE1-CD2 3.93Å; Y183-H220 AromaticContact CE1-CE1 3.61Å; Y183-H220 AromaticContact CE1-CG 3.87Å; Y183-H220 AromaticContact CE1-ND1 3.68Å; Y183-H220 AromaticContact CE1-NE2 3.77Å; Y183-H220 AromaticContact CZ-CE1 3.8Å; Y183-H220 AromaticContact CZ-NE2 3.93Å
221	I	98.7	Very high	96.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	116.4	169.9	-50.4	170.9	0	0	0	108.3	V137 L139 I156 V176 Q177 L178 I246	V137-I221 HydrophobicContact CB-CB 4.27Å; V137-I221 PolarHBondContact N-O 2.81Å; V137-I221 PolarHBondContact O-N 2.84Å; L139-I221 HydrophobicContact CD1-CD1 4.46Å; L139-I221 HydrophobicContact CD1-CG1 4.37Å; L139-I221 HydrophobicContact CD2-CD1 3.77Å; L139-I221 HydrophobicContact CD2-CG1 4.25Å; L139-I221 HydrophobicContact CG-CD1 4.43Å; L139-I221 HydrophobicContact CG-CG1 4.4Å; I156-I221 HydrophobicContact CD1-CD1 4.12Å; I156-I221 HydrophobicContact CG2-CD1 3.71Å; V176-I221 HydrophobicContact CG1-CG2 3.91Å; Q177-I221 CarbonylContact O-C 3.59Å; Q177-I221 WeakPolarHBondContact O-CA 3.27Å; L178-I221 HydrophobicContact CD2-CB 4.48Å; L178-I221 HydrophobicContact CD2-CD1 4.36Å; L178-I221 HydrophobicContact CD2-CG1 3.85Å; L178-I221 HydrophobicContact CD2-CG2 4.1Å; I221-I246 HydrophobicContact CB-CD1 4.4Å; I221-I246 HydrophobicContact CD1-CG2 3.84Å; I221-I246 HydrophobicContact CG2-CD1 3.7Å
222	L	98.7	Very high	96.5	Very high	27 Å²	27	34.5 Å²	34.5	14%	0.141	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	121.4	169.1	176.3	64	0	0	0	108.5	M136 V176 Q177	M136-L222 HydrophobicContact CE-CB 3.96Å; M136-L222 HydrophobicContact CE-CD1 3.97Å; M136-L222 HydrophobicContact CE-CG 4.42Å; M136-L222 HydrophobicContact SD-CB 3.98Å; V176-L222 CarbonylContact C-O 3.59Å; V176-L222 VanDerWaalsContact CA-O 3.24Å; V176-L222 WeakPolarHBondContact CA-O 3.22Å; Q177-L222 HydrophobicContact CB-CB 4.28Å; Q177-L222 PolarHBondContact N-O 2.81Å; Q177-L222 PolarHBondContact O-N 2.82Å
223	F	98.8	Very high	96.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.2	167.7	-176.4	-82.9	0	0	0	108.7	L80 W92 S134 Q135 V158 D160 L174 V176 H225 I246	L80-F223 HydrophobicContact CD1-CD1 4.12Å; L80-F223 HydrophobicContact CD1-CD2 4Å; L80-F223 HydrophobicContact CD1-CE1 4.28Å; L80-F223 HydrophobicContact CD1-CE2 4.15Å; L80-F223 HydrophobicContact CD1-CG 3.98Å; L80-F223 HydrophobicContact CD1-CZ 4.3Å; L80-F223 HydrophobicContact CD2-CB 4Å; L80-F223 HydrophobicContact CD2-CG 4.26Å; W92-F223 AromaticContact CH2-CD1 3.78Å; W92-F223 HydrophobicContact CH2-CD1 3.78Å; W92-F223 AromaticContact CH2-CE1 3.89Å; W92-F223 HydrophobicContact CH2-CE1 3.89Å; W92-F223 AromaticContact CZ3-CD1 3.81Å; W92-F223 HydrophobicContact CZ3-CD1 3.81Å; W92-F223 HydrophobicContact CZ3-CE1 4.18Å; S134-F223 CarbonylContact C-O 3.53Å; S134-F223 WeakPolarHBondContact CA-O 3.48Å; S134-F223 VanDerWaalsContact CB-O 3.28Å; S134-F223 WeakPolarHBondContact CB-O 3.22Å; Q135-F223 PolarHBondContact N-O 2.63Å; Q135-F223 PolarHBondContact O-N 3.1Å; V158-F223 HydrophobicContact CG1-CD2 3.79Å; V158-F223 HydrophobicContact CG1-CE2 3.66Å; D160-F223 HydrophobicContact CB-CZ 4.06Å; L174-F223 HydrophobicContact CD1-CD2 4.44Å; L174-F223 HydrophobicContact CD1-CE1 4.4Å; L174-F223 HydrophobicContact CD1-CE2 3.81Å; L174-F223 HydrophobicContact CD1-CZ 3.79Å; V176-F223 HydrophobicContact CG2-CD2 3.99Å; V176-F223 HydrophobicContact CG2-CE2 4.4Å; F223-H225 HydrophobicContact CE1-CB 4.12Å; F223-H225 AromaticContact CE1-CD2 3.96Å; F223-H225 AromaticContact CE1-CE1 3.92Å; F223-H225 AromaticContact CE1-CG 3.69Å; F223-H225 AromaticContact CE1-ND1 3.67Å; F223-H225 AromaticContact CZ-ND1 3.97Å; F223-I246 HydrophobicContact CB-CD1 3.87Å; F223-I246 HydrophobicContact CD2-CD1 4.07Å; F223-I246 HydrophobicContact CD2-CG1 4.24Å; F223-I246 HydrophobicContact CG-CD1 4.35Å
224	Q	98.7	Very high	96.7	Very high	36 Å²	36	40.6 Å²	40.6	17%	0.168	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	134.8	176.3	177.6	178.9	76.6	0	0	109.8	D95 K133 R175	D95-Q224 PolarHBondContact OD2-NE2 3.13Å; K133-Q224 WeakPolarHBondContact O-CA 3.26Å; R175-Q224 HydrophobicContact CB-CB 4.29Å; R175-Q224 PolarHBondContact N-O 3.15Å; R175-Q224 PolarHBondContact O-N 2.77Å; R175-Q224 VanDerWaalsContact O-O 3.1Å
225	H	98.6	Very high	96.8	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	168.4	174.4	71.2	170.8	0	0	0	112.2	K133 D160 Y172 Q173 L174 F223 V241 S244	K133-H225 WeakPolarHBondContact CE-NE2 3.42Å; K133-H225 PolarHBondContact N-O 2.77Å; K133-H225 PolarHBondContact NZ-NE2 2.84Å; K133-H225 PolarHBondContact O-N 2.97Å; D160-H225 IonicContact OD1-CE1 3.81Å; D160-H225 IonicContact OD1-ND1 2.66Å; D160-H225 IonicContact OD2-CE1 2.73Å; D160-H225 IonicContact OD2-CG 2.72Å; D160-H225 IonicContact OD2-ND1 3.63Å; D160-H225 PolarHBondContact OD2-ND1 2.61Å; Y172-H225 HydrophobicContact CE2-CB 4.05Å; Q173-H225 CarbonylContact O-C 3.51Å; Q173-H225 VanDerWaalsContact O-CA 3.22Å; Q173-H225 WeakPolarHBondContact O-CA 3.4Å; L174-H225 HydrophobicContact CD1-CB 3.94Å; F223-H225 HydrophobicContact CE1-CB 4.12Å; F223-H225 AromaticContact CE1-CD2 3.96Å; F223-H225 AromaticContact CE1-CE1 3.92Å; F223-H225 AromaticContact CE1-CG 3.69Å; F223-H225 AromaticContact CE1-ND1 3.67Å; F223-H225 AromaticContact CZ-ND1 3.97Å; H225-V241 VanDerWaalsContact CE1-CG2 3.41Å; H225-V241 WeakPolarHBondContact CE1-CG2 3.25Å; H225-S244 PolarHBondContact CE1-OG 3.43Å
226	G	98.3	Very high	96.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.1	-146.7	171.9	0	0	0	0	0	111.6	C131 Y172 Q173	C131-G226 CarbonylContact O-C 3.52Å; C131-G226 VanDerWaalsContact O-CA 3.24Å; C131-G226 WeakPolarHBondContact O-CA 3.18Å; Y172-G226 CarbonylContact C-O 3.54Å; Y172-G226 WeakPolarHBondContact CA-O 3.38Å; Y172-G226 WeakPolarHBondContact CD2-O 3.3Å; Q173-G226 PolarHBondContact N-O 2.7Å; Q173-G226 PolarHBondContact O-N 2.82Å
227	G	97.9	Very high	96.9	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.4	-161	-176.1	0	0	0	0	0	113.3	T126 C131 T171	T126-G227 WeakPolarHBondContact CB-O 3.43Å; C131-G227 PolarHBondContact N-O 2.86Å; C131-G227 PolarHBondContact O-N 3.1Å; T171-G227 WeakPolarHBondContact O-CA 3.47Å
228	Q	97.7	Very high	96.9	Very high	49 Å²	49	39.4 Å²	39.4	23%	0.229	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	165.8	-177.9	58.7	177.9	54	0	0	110.9	S127 M130 C170 T171 P239	S127-Q228 WeakPolarHBondContact O-CA 3.38Å; M130-Q228 HydrophobicContact CE-CG 4.26Å; C170-Q228 CarbonylContact C-O 3.58Å; C170-Q228 WeakPolarHBondContact CA-O 3.46Å; C170-Q228 WeakPolarHBondContact CB-O 3.49Å; T171-Q228 PolarHBondContact N-O 3.3Å; T171-Q228 PolarHBondContact O-N 3.06Å; T171-Q228 VanDerWaalsContact O-N 3.09Å; Q228-P239 WeakPolarHBondContact O-CD 3.31Å
229	D	96.3	Very high	96.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	170.4	168.1	86.2	22.1	0	0	0	112.3	S127 F128 Q231 F232 W233	S127-D229 PolarHBondContact O-N 3.17Å; F128-D229 VanDerWaalsContact CA-CG 3.47Å; F128-D229 WeakPolarHBondContact CA-OD2 3.14Å; F128-D229 WeakPolarHBondContact CB-OD2 3.5Å; D229-Q231 PolarHBondContact OD1-N 3.32Å; D229-F232 WeakPolarHBondContact OD1-CA 3.36Å; D229-F232 PolarHBondContact OD1-N 3.41Å; D229-W233 PolarHBondContact OD2-N 3.01Å
230	T	95.2	Very high	96.9	Very high	52 Å²	52	38.3 Å²	38.3	32%	0.319	17%	0.172	S	C	.	.	S	Bend	trans	-110	0.1	173.1	65.5	0	0	0	0	113.7	G169 T195	G169-T230 VanDerWaalsContact C-OG1 3.26Å; G169-T230 WeakPolarHBondContact CA-OG1 3.37Å; G169-T230 PolarHBondContact O-N 2.97Å; G169-T230 PolarHBondContact O-OG1 3.28Å; T195-T230 HydrophobicContact CG2-CG2 4.27Å
231	Q	92.2	Very high	96.9	Very high	72 Å²	72	37.6 Å²	37.6	34%	0.336	17%	0.168	S	C	.	.	S	Bend	trans	-109.2	-5.9	-172.9	-61.7	-61.1	-32.8	0	0	112.9	C168 D229 W233	C168-Q231 VanDerWaalsContact SG-CG 3.52Å; D229-Q231 PolarHBondContact OD1-N 3.32Å; Q231-W233 VanDerWaalsContact C-N 3.27Å; Q231-W233 HydrophobicContact CB-CD2 3.84Å; Q231-W233 HydrophobicContact CB-CE3 4.44Å; Q231-W233 HydrophobicContact CB-CG 3.89Å; Q231-W233 HydrophobicContact CB-CZ2 4.42Å; Q231-W233 PolarHBondContact O-N 3.03Å
232	F	94.3	Very high	96.8	Very high	138 Å²	138	37.6 Å²	37.6	61%	0.605	17%	0.168	S	C	*	.			trans	54.6	41	-174.2	-76.3	-94.3	0	0	0	113	F128 D229	F128-F232 HydrophobicContact CD2-CD1 4.43Å; D229-F232 WeakPolarHBondContact OD1-CA 3.36Å; D229-F232 PolarHBondContact OD1-N 3.41Å
233	W	92.4	Very high	96.8	Very high	101 Å²	101	38.5 Å²	38.5	38%	0.383	17%	0.173	S	C	.	.			trans	-91.4	124	-177.1	-74.5	-3	0	0	0	111	F128 D167 C168 Q198 D229 Q231 G235 Y237	F128-W233 WeakPolarHBondContact CD1-O 3.5Å; D167-W233 WeakPolarHBondContact O-CZ3 3.39Å; C168-W233 HydrophobicContact CB-CE3 4.33Å; C168-W233 HydrophobicContact CB-CZ3 4.25Å; Q198-W233 VanDerWaalsContact NE2-CH2 3.29Å; D229-W233 PolarHBondContact OD2-N 3.01Å; Q231-W233 VanDerWaalsContact C-N 3.27Å; Q231-W233 HydrophobicContact CB-CD2 3.84Å; Q231-W233 HydrophobicContact CB-CE3 4.44Å; Q231-W233 HydrophobicContact CB-CG 3.89Å; Q231-W233 HydrophobicContact CB-CZ2 4.42Å; Q231-W233 PolarHBondContact O-N 3.03Å; W233-G235 PolarHBondContact O-N 2.82Å; W233-Y237 HydrophobicContact CB-CD2 3.87Å; W233-Y237 HydrophobicContact CB-CE2 4.21Å; W233-Y237 HydrophobicContact CB-CG 4.07Å; W233-Y237 AromaticContact CE3-CD1 3.63Å; W233-Y237 HydrophobicContact CE3-CD1 3.63Å; W233-Y237 AromaticContact CE3-CE1 3.6Å; W233-Y237 HydrophobicContact CE3-CE1 3.6Å; W233-Y237 HydrophobicContact CE3-CG 4.27Å; W233-Y237 HydrophobicContact CZ3-CD1 4.3Å; W233-Y237 HydrophobicContact CZ3-CE1 4.13Å
234	K	95.8	Very high	96.8	Very high	166 Å²	166	38.5 Å²	38.5	72%	0.722	17%	0.173	S	C	*	.	S	Bend	trans	-54.7	131.5	176.6	-172.8	175.7	-179.7	176.5	0	110.7	D100 F128 Y237	D100-K234 WeakPolarHBondContact OD2-CG 3.22Å; F128-K234 HydrophobicContact CE1-CB 4.47Å; F128-K234 HydrophobicContact CE1-CG 4.32Å; K234-Y237 VanDerWaalsContact O-CE2 3.25Å; K234-Y237 WeakPolarHBondContact O-CE2 3.25Å
235	G	95.8	Very high	96.7	Very high	10 Å²	10	37.5 Å²	37.5	10%	0.103	17%	0.171	C	C	.	.	S	Bend	trans	115.3	-151.1	-175.5	0	0	0	0	0	113.1	D100 S127 W233	D100-G235 VanDerWaalsContact OD2-CA 3.29Å; D100-G235 WeakPolarHBondContact OD2-CA 3.48Å; D100-G235 PolarHBondContact OD2-N 3.21Å; S127-G235 WeakPolarHBondContact CA-O 3.16Å; S127-G235 WeakPolarHBondContact CB-O 3.33Å; S127-G235 PolarHBondContact OG-O 3.07Å; W233-G235 PolarHBondContact O-N 2.82Å
236	W	97.6	Very high	96.7	Very high	74 Å²	74	37.5 Å²	37.5	28%	0.28	17%	0.171	S	C	.	.	S	Bend	trans	-113.7	78.5	-174.1	-62.7	-80.4	0	0	0	110.6	D100 R101 K103 V125 T126 R165	D100-W236 HydrophobicContact CB-CZ2 3.95Å; D100-W236 WeakPolarHBondContact O-CZ2 3.49Å; D100-W236 PolarHBondContact O-NE1 2.84Å; R101-W236 PolarHBondContact O-NE1 3.3Å; K103-W236 HydrophobicContact CB-CD2 4.06Å; K103-W236 HydrophobicContact CB-CG 4.03Å; K103-W236 HydrophobicContact CB-CZ2 4.21Å; K103-W236 VanDerWaalsContact CB-NE1 3.26Å; K103-W236 HydrophobicContact CD-CD2 3.4Å; K103-W236 VanDerWaalsContact CD-CE2 3.42Å; K103-W236 HydrophobicContact CD-CE3 3.62Å; K103-W236 HydrophobicContact CD-CG 3.99Å; K103-W236 HydrophobicContact CD-CH2 3.88Å; K103-W236 HydrophobicContact CD-CZ2 3.67Å; K103-W236 HydrophobicContact CD-CZ3 3.86Å; K103-W236 HydrophobicContact CG-CD2 4.4Å; K103-W236 HydrophobicContact CG-CZ2 4.46Å; V125-W236 HydrophobicContact CB-CB 4.43Å; V125-W236 HydrophobicContact CG1-CB 3.72Å; V125-W236 HydrophobicContact CG1-CG 3.95Å; V125-W236 HydrophobicContact CG2-CB 3.87Å; T126-W236 WeakPolarHBondContact O-CA 3.47Å; R165-W236 PolarHBondContact NH1-O 2.77Å; R165-W236 VanDerWaalsContact NH1-O 3.17Å
237	Y	96.4	Very high	96.7	Very high	58 Å²	58	39.8 Å²	39.8	23%	0.227	18%	0.183	C	C	.	.			trans	-111.3	-3	-177.2	-69.9	-94	0	0	0	113.5	C168 W233 K234	C168-Y237 HydrophobicContact CB-CD1 3.87Å; W233-Y237 HydrophobicContact CB-CD2 3.87Å; W233-Y237 HydrophobicContact CB-CE2 4.21Å; W233-Y237 HydrophobicContact CB-CG 4.07Å; W233-Y237 AromaticContact CE3-CD1 3.63Å; W233-Y237 HydrophobicContact CE3-CD1 3.63Å; W233-Y237 AromaticContact CE3-CE1 3.6Å; W233-Y237 HydrophobicContact CE3-CE1 3.6Å; W233-Y237 HydrophobicContact CE3-CG 4.27Å; W233-Y237 HydrophobicContact CZ3-CD1 4.3Å; W233-Y237 HydrophobicContact CZ3-CE1 4.13Å; K234-Y237 VanDerWaalsContact O-CE2 3.25Å; K234-Y237 WeakPolarHBondContact O-CE2 3.25Å
238	G	97.1	Very high	96.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	-77.3	-174.2	177.5	0	0	0	0	0	113.5	T126	T126-G238 PolarHBondContact O-N 3.46Å; T126-G238 VanDerWaalsContact OG1-C 3.23Å; T126-G238 VanDerWaalsContact OG1-CA 3.27Å; T126-G238 WeakPolarHBondContact OG1-CA 3.41Å
239	P	97.4	Very high	96.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.176	C	C	.	.			trans	-58.3	145.4	177.4	26.1	-37.8	0	0	0	112.8	T126 V162 Y172 Q228	T126-P239 HydrophobicContact CG2-CG 4.37Å; T126-P239 PolarHBondContact N-O 3.04Å; T126-P239 WeakPolarHBondContact OG1-CD 3.02Å; T126-P239 WeakPolarHBondContact OG1-CG 3.25Å; T126-P239 PolarHBondContact OG1-O 2.73Å; V162-P239 HydrophobicContact CG2-CB 3.88Å; Y172-P239 HydrophobicContact CD2-CB 4.45Å; Q228-P239 WeakPolarHBondContact O-CD 3.31Å
240	R	98.1	Very high	95.4	Very high	5 Å²	5	39.4 Å²	39.4	2%	0.019	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	132.7	169.2	-58.6	168.3	169.8	161	-7.5	108.8	S110 Y123 F124 V125 V162 A163 W204	S110-R240 PolarHBondContact O-NH1 3.34Å; S110-R240 PolarHBondContact O-NH2 3.14Å; Y123-R240 HydrophobicContact CD2-CB 3.82Å; Y123-R240 HydrophobicContact CD2-CG 3.84Å; Y123-R240 HydrophobicContact CE2-CB 4.24Å; Y123-R240 HydrophobicContact CE2-CG 3.74Å; Y123-R240 HydrophobicContact CG-CB 4.41Å; F124-R240 CarbonylContact O-C 3.51Å; F124-R240 VanDerWaalsContact O-CA 3.26Å; F124-R240 WeakPolarHBondContact O-CA 3.3Å; V125-R240 HydrophobicContact CB-CG 4.27Å; V125-R240 HydrophobicContact CG2-CG 3.92Å; V162-R240 CarbonylContact C-O 3.55Å; V162-R240 VanDerWaalsContact CA-O 3.22Å; V162-R240 WeakPolarHBondContact CA-O 3.41Å; A163-R240 PolarHBondContact N-O 2.67Å; A163-R240 VanDerWaalsContact O-CB 3.31Å; A163-R240 WeakPolarHBondContact O-CB 3.46Å; A163-R240 PolarHBondContact O-N 2.84Å; W204-R240 HydrophobicContact CH2-CB 3.79Å; W204-R240 HydrophobicContact CZ2-CB 4.41Å; W204-R240 HydrophobicContact CZ3-CB 4.38Å
241	V	98.3	Very high	94.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	140.6	-179.8	-60.1	0	0	0	0	111	W102 F124 W161 V162 Y172 H225	W102-V241 HydrophobicContact CH2-CG2 3.9Å; W102-V241 HydrophobicContact CZ3-CG2 3.89Å; F124-V241 HydrophobicContact CB-CG2 3.87Å; F124-V241 HydrophobicContact CD2-CG2 4.4Å; F124-V241 PolarHBondContact N-O 3.37Å; F124-V241 PolarHBondContact O-N 3Å; W161-V241 VanDerWaalsContact O-CA 3.26Å; W161-V241 WeakPolarHBondContact O-CA 3.06Å; V162-V241 HydrophobicContact CB-CG1 4.42Å; V162-V241 HydrophobicContact CG2-CG1 4.26Å; Y172-V241 HydrophobicContact CD2-CG1 3.86Å; Y172-V241 HydrophobicContact CE2-CG1 3.66Å; H225-V241 VanDerWaalsContact CE1-CG2 3.41Å; H225-V241 WeakPolarHBondContact CE1-CG2 3.25Å
242	T	98.1	Very high	92.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	174.7	177.9	-162.7	0	0	0	0	111	F115 V120 K122 W161 W204 S244	F115-T242 HydrophobicContact CD2-CG2 4.12Å; F115-T242 HydrophobicContact CE2-CG2 4.03Å; V120-T242 HydrophobicContact CG1-CG2 3.95Å; K122-T242 PolarHBondContact O-OG1 3.41Å; W161-T242 WeakPolarHBondContact CB-O 3.41Å; W161-T242 PolarHBondContact N-O 3.38Å; W161-T242 PolarHBondContact O-N 3.02Å; W161-T242 VanDerWaalsContact O-N 3.14Å; W204-T242 HydrophobicContact CE3-CG2 4.3Å; W204-T242 HydrophobicContact CH2-CG2 3.73Å; W204-T242 HydrophobicContact CZ2-CG2 4.49Å; W204-T242 HydrophobicContact CZ3-CG2 3.63Å; T242-S244 PolarHBondContact O-N 3.18Å
243	N	97.7	Very high	90.8	Very high	46 Å²	46	33.1 Å²	33.1	25%	0.246	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	53.3	32.9	172.4	-161.5	44.2	0	0	0	114.1	P83 F115 V120 W161	P83-N243 PolarHBondContact O-N 2.82Å; P83-N243 VanDerWaalsContact O-N 3.08Å; F115-N243 HydrophobicContact CE1-CB 4.43Å; F115-N243 HydrophobicContact CZ-CB 3.94Å; V120-N243 HydrophobicContact CG2-CB 4.29Å; W161-N243 HydrophobicContact CG-CB 4.44Å
244	S	98.4	Very high	88.9	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	140.1	176.3	-43	0	0	0	0	110.2	N78 P83 K159 D160 H225 T242	N78-S244 PolarHBondContact ND2-O 2.9Å; P83-S244 WeakPolarHBondContact CB-O 3.38Å; K159-S244 CarbonylContact O-C 3.6Å; K159-S244 WeakPolarHBondContact O-CA 3.41Å; D160-S244 WeakPolarHBondContact OD1-CA 3.03Å; D160-S244 VanDerWaalsContact OD1-CB 3.27Å; D160-S244 WeakPolarHBondContact OD1-CB 3.48Å; D160-S244 PolarHBondContact OD1-OG 2.78Å; H225-S244 PolarHBondContact CE1-OG 3.43Å; T242-S244 PolarHBondContact O-N 3.18Å
245	S	98.3	Very high	86.8	Confident	16 Å²	16	29.1 Å²	29.1	11%	0.112	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	147	175.3	62.6	0	0	0	0	114.4	N78 V158 K159	N78-S245 WeakPolarHBondContact ND2-CB 3.42Å; N78-S245 WeakPolarHBondContact OD1-CA 3.24Å; N78-S245 WeakPolarHBondContact OD1-CB 3.17Å; V158-S245 CarbonylContact C-O 3.55Å; V158-S245 WeakPolarHBondContact CA-O 3.22Å; K159-S245 PolarHBondContact N-O 2.89Å; K159-S245 PolarHBondContact O-N 3.33Å
246	I	98.4	Very high	84.4	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	122.5	164.4	-64.5	176.5	0	0	0	106.3	N78 L79 L80 V137 I156 V157 V158 I221 F223	N78-I246 WeakPolarHBondContact CA-O 3.3Å; N78-I246 PolarHBondContact OD1-N 3.43Å; N78-I246 PolarHBondContact OD1-O 3.04Å; L79-I246 HydrophobicContact CB-CB 4.31Å; L79-I246 HydrophobicContact CB-CG2 4.43Å; L79-I246 HydrophobicContact CD1-CG2 4.12Å; L79-I246 HydrophobicContact CG-CG2 4.47Å; L79-I246 WeakPolarHBondContact CG-O 3.42Å; L79-I246 PolarHBondContact N-O 2.82Å; L80-I246 HydrophobicContact CD1-CD1 4.4Å; L80-I246 HydrophobicContact CD1-CG1 4.08Å; L80-I246 HydrophobicContact CD2-CD1 3.93Å; L80-I246 HydrophobicContact CD2-CG1 4.37Å; L80-I246 HydrophobicContact CG-CB 4.36Å; L80-I246 HydrophobicContact CG-CD1 4.09Å; L80-I246 HydrophobicContact CG-CG1 3.98Å; V137-I246 HydrophobicContact CG2-CD1 4.36Å; I156-I246 HydrophobicContact CG2-CG2 3.99Å; V157-I246 WeakPolarHBondContact O-CA 3.39Å; V158-I246 HydrophobicContact CG1-CG1 4.16Å; V158-I246 HydrophobicContact CG2-CG1 4.26Å; I221-I246 HydrophobicContact CB-CD1 4.4Å; I221-I246 HydrophobicContact CD1-CG2 3.84Å; I221-I246 HydrophobicContact CG2-CD1 3.7Å; F223-I246 HydrophobicContact CB-CD1 3.87Å; F223-I246 HydrophobicContact CD2-CD1 4.07Å; F223-I246 HydrophobicContact CD2-CG1 4.24Å; F223-I246 HydrophobicContact CG-CD1 4.35Å
247	I	97.4	Very high	82	Confident	49 Å²	49	33.1 Å²	33.1	25%	0.251	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	127.2	179.7	-59	178.9	0	0	0	108.1	Q76 V157	Q76-I247 HydrophobicContact CG-CG2 3.59Å; V157-I247 PolarHBondContact N-O 3.34Å; V157-I247 PolarHBondContact O-N 2.81Å
248	I	95.5	Very high	79.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	119.7	169.1	-61.8	-177.8	0	0	0	107.9	L72 L79 L139 Y144 M149 P154 I156	L72-I248 HydrophobicContact CD2-CG2 3.94Å; L79-I248 HydrophobicContact CD1-CD1 4.1Å; L79-I248 HydrophobicContact CD1-CG1 4.11Å; L139-I248 HydrophobicContact CD2-CD1 3.6Å; Y144-I248 HydrophobicContact CD1-CB 4.35Å; Y144-I248 HydrophobicContact CD1-CD1 3.63Å; Y144-I248 HydrophobicContact CD1-CG2 4.17Å; Y144-I248 HydrophobicContact CD2-CD1 3.81Å; Y144-I248 HydrophobicContact CE1-CB 3.59Å; Y144-I248 HydrophobicContact CE1-CD1 3.63Å; Y144-I248 HydrophobicContact CE1-CG1 4.1Å; Y144-I248 HydrophobicContact CE1-CG2 3.71Å; Y144-I248 HydrophobicContact CE2-CD1 3.81Å; Y144-I248 HydrophobicContact CE2-CG1 4.48Å; Y144-I248 HydrophobicContact CG-CD1 3.71Å; M149-I248 HydrophobicContact CE-CD1 4.43Å; M149-I248 HydrophobicContact SD-CD1 4.21Å; P154-I248 HydrophobicContact CB-CG2 3.62Å; P154-I248 HydrophobicContact CG-CG2 3.45Å; P154-I248 VanDerWaalsContact CG-CG2 3.45Å; I156-I248 HydrophobicContact CG1-CG1 4.31Å
249	S	88.8	Confident	76.6	Confident	13 Å²	13	39 Å²	39	9%	0.091	23%	0.231	C	C	.	.			trans	-86.7	151.6	-177.9	-170.8	0	0	0	0	111	P154 D155 R251	P154-S249 WeakPolarHBondContact CB-O 3.22Å; D155-S249 PolarHBondContact O-N 3.34Å; S249-R251 PolarHBondContact O-N 2.74Å; S249-R251 WeakPolarHBondContact OG-CB 3.1Å; S249-R251 PolarHBondContact OG-N 2.74Å
250	H	80.3	Confident	73.8	Confident	28 Å²	28	50.5 Å²	50.5	13%	0.13	28%	0.275	C	S	.	.	S	Bend	trans	-75.1	-10.5	164.9	66.1	-87.7	0	0	0	112.3	F69 L72	F69-H250 HydrophobicContact CD2-CB 4.11Å; F69-H250 AromaticContact CD2-CD2 3.79Å; F69-H250 HydrophobicContact CE2-CB 4.37Å; F69-H250 AromaticContact CE2-CD2 3.39Å; F69-H250 WeakPolarHBondContact CE2-CD2 3.15Å; F69-H250 AromaticContact CE2-CG 3.9Å; F69-H250 AromaticContact CE2-NE2 3.92Å; L72-H250 HydrophobicContact CB-CB 3.87Å; L72-H250 HydrophobicContact CD1-CB 4.42Å
251	R	70.4	Confident	70.8	Confident	66 Å²	66	56.6 Å²	56.6	25%	0.249	31%	0.313	C	S	.	.			trans	-80.4	150.5	175.3	-62.1	-176.4	166.8	170.3	-10.3	110.3	E61 D155 S249 P257	E61-R251 IonicContact OE1-CZ 3.74Å; E61-R251 IonicContact OE1-NH2 3.06Å; E61-R251 PolarHBondContact OE1-NH2 3.48Å; D155-R251 VanDerWaalsContact CB-O 3.3Å; D155-R251 WeakPolarHBondContact CB-O 3.3Å; D155-R251 VanDerWaalsContact CG-O 3.22Å; D155-R251 PolarHBondContact N-O 3.25Å; D155-R251 VanDerWaalsContact N-O 3.13Å; S249-R251 PolarHBondContact O-N 2.74Å; S249-R251 WeakPolarHBondContact OG-CB 3.1Å; S249-R251 PolarHBondContact OG-N 2.74Å; R251-P257 VanDerWaalsContact NH1-CB 3.29Å
252	T	60.9	Low	67.7	Low	15 Å²	15	63.8 Å²	63.8	9%	0.092	35%	0.351	C	S	.	.			trans	-129.9	155.9	175.8	52.1	0	0	0	0	107.1	F152 D155 K254 N255	F152-T252 HydrophobicContact CD1-CG2 4.17Å; F152-T252 HydrophobicContact CE1-CG2 3.45Å; F152-T252 VanDerWaalsContact CE1-CG2 3.45Å; F152-T252 HydrophobicContact CE2-CG2 4.42Å; F152-T252 HydrophobicContact CZ-CG2 3.61Å; D155-T252 WeakPolarHBondContact OD2-CA 3.1Å; T252-K254 PolarHBondContact O-N 2.84Å; T252-N255 CarbonylContact O-C 3.5Å; T252-N255 PolarHBondContact O-N 2.75Å
253	A	54.5	Low	64.7	Low	49 Å²	49	69.4 Å²	69.4	41%	0.405	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-23.6	172.7	0	0	0	0	0	114.8	D155 D213 N255	D155-A253 PolarHBondContact OD1-N 2.94Å; D213-A253 WeakPolarHBondContact OD2-CB 3.41Å; A253-N255 VanDerWaalsContact C-N 3.34Å
254	K	51.5	Low	61.7	Low	142 Å²	142	76.4 Å²	76.4	62%	0.617	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-14.8	174.9	-63	178.9	-178.2	176.5	0	115.4	T252	T252-K254 PolarHBondContact O-N 2.84Å
255	N	51.8	Low	58.9	Low	40 Å²	40	89.4 Å²	89.4	21%	0.214	48%	0.479	C	S	.	.	S	Bend	trans	-137.5	78.1	179.4	-93.2	-24.6	0	0	0	109.4	P62 T252 A253	P62-N255 PolarHBondContact O-ND2 3.49Å; T252-N255 CarbonylContact O-C 3.5Å; T252-N255 PolarHBondContact O-N 2.75Å; A253-N255 VanDerWaalsContact C-N 3.34Å
256	P	45.5	Very low	57	Low	90 Å²	90	93.1 Å²	93.1	58%	0.584	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-67.2	160.1	-178.9	27.4	-33.3	0	0	0	111.7
257	P	47	Very low	54.8	Low	78 Å²	78	97.9 Å²	97.9	51%	0.506	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-52.8	146.2	170.1	-18.7	28.6	0	0	0	111.1	R251 A259	R251-P257 VanDerWaalsContact NH1-CB 3.29Å; P257-A259 PolarHBondContact O-N 3.38Å
258	P	43.4	Very low	52.4	Low	89 Å²	89	100.7 Å²	100.7	58%	0.578	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-56.2	131.5	161.5	24.3	-31.8	0	0	0	107.8	E61 R260	E61-P258 VanDerWaalsContact OE1-CD 3.26Å; E61-P258 WeakPolarHBondContact OE1-CD 3.18Å; P258-R260 PolarHBondContact O-N 3.08Å; P258-R260 VanDerWaalsContact O-N 3.13Å
259	A	37.8	Very low	49.9	Very low	92 Å²	92	106.6 Å²	106.6	76%	0.76	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-52.1	123.3	178.2	0	0	0	0	0	108.5	P257 T261	P257-A259 PolarHBondContact O-N 3.38Å; A259-T261 PolarHBondContact O-N 3.24Å
260	R	36.8	Very low	47.4	Very low	242 Å²	242	112.4 Å²	112.4	91%	0.913	60%	0.6	S	S	*	*			trans	-64	104.4	165.7	-89.4	179.7	165.1	-179.5	-5.3	106.1	P258 L262	P258-R260 PolarHBondContact O-N 3.08Å; P258-R260 VanDerWaalsContact O-N 3.13Å; R260-L262 PolarHBondContact O-N 3.2Å; R260-L262 VanDerWaalsContact O-N 3.07Å
261	T	35.4	Very low	45.3	Very low	133 Å²	133	118.1 Å²	118.1	82%	0.816	63%	0.631	S	S	*	*			trans	-60.5	109.8	158.9	33.8	0	0	0	0	106.3	A259	A259-T261 PolarHBondContact O-N 3.24Å
262	L	33	Very low	43.5	Very low	152 Å²	152	121.8 Å²	121.8	80%	0.796	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-56.9	138.8	163.5	-72.9	161.6	0	0	0	106.8	R260 E264	R260-L262 PolarHBondContact O-N 3.2Å; R260-L262 VanDerWaalsContact O-N 3.07Å; L262-E264 PolarHBondContact O-N 3.33Å; L262-E264 VanDerWaalsContact O-N 3.15Å
263	P	34.8	Very low	42.1	Very low	117 Å²	117	130 Å²	130	76%	0.76	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-57.1	122.6	165.1	-13.8	27	0	0	0	107.2	E265	P263-E265 PolarHBondContact O-N 3.15Å
264	E	34.8	Very low	41.1	Very low	194 Å²	194	136.8 Å²	136.8	91%	0.907	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-60.1	123.4	163	-68	-179.9	157.2	0	0	106.8	L262	L262-E264 PolarHBondContact O-N 3.33Å; L262-E264 VanDerWaalsContact O-N 3.15Å
265	E	41.3	Very low	40.1	Very low	272 Å²	272	136.3 Å²	136.3	100%	1.271	74%	0.737	S	S	*	*			trans	-67.7	0	167.3	-76.1	-172.3	154.3	0	0	110.9	P263	P263-E265 PolarHBondContact O-N 3.15Å

Retrieved 265 of 265 residues in 53.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).