A0A093KAF2_STRCA Loading...

Gap junction protein

One gap junction consists of a cluster of closely packed pairs of transmembrane channels, the connexons, through which materials of low MW diffuse from one cell to a neighboring cell. Structural component of lens fiber gap junctions. Gap junctions are dodecameric channels that connect the cytoplasm of adjoining cells. They are formed by the docking of two hexameric hemichannels, one from each cell membrane. Small molecules and ions diffuse from one cell to a neighboring cell via the central pore.

AlphaFold DB , UniProt , Accession A0A093KAF2, Species STRCA (Struthio camelus australis), Gene n/a, Length 513 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	46.3	Very low	64.2	Low	207 Å²	207	96.4 Å²	96.4	100%	1.02	51%	0.505	S	S	*	.				0	149.9	0	-68	158.3	-177.1	0	0	110.2	E42	M1-E42 VanDerWaalsContact CE-OE2 3.3Å; M1-E42 WeakPolarHBondContact CE-OE2 3.42Å
2	G	58.3	Low	64.3	Low	50 Å²	50	100 Å²	100	52%	0.515	52%	0.518	S	S	.	.			trans	-124.9	149.2	-179.1	0	0	0	0	0	112.7	W4	G2-W4 PolarHBondContact O-N 3.29Å
3	D	69.6	Low	63.9	Low	150 Å²	150	101 Å²	101	80%	0.802	52%	0.524	S	S	*	.			trans	-77.9	82.5	-172.1	-77.9	-58.4	0	0	0	114.1	S5	D3-S5 PolarHBondContact O-N 3.23Å; D3-S5 VanDerWaalsContact O-N 3.15Å
4	W	70.6	Confident	63.5	Low	99 Å²	99	94.6 Å²	94.6	38%	0.375	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-12.7	173	-58.2	104.2	0	0	0	114.1	G2 F6 L7 G8 I34	G2-W4 PolarHBondContact O-N 3.29Å; W4-F6 VanDerWaalsContact C-N 3.33Å; W4-F6 PolarHBondContact O-N 3.19Å; W4-L7 HydrophobicContact CE3-CD2 4.09Å; W4-L7 HydrophobicContact CZ3-CD2 4.25Å; W4-L7 PolarHBondContact O-N 2.91Å; W4-L7 VanDerWaalsContact O-N 3.14Å; W4-G8 PolarHBondContact O-N 2.82Å; W4-I34 HydrophobicContact CB-CG2 4.32Å; W4-I34 HydrophobicContact CD2-CG2 4.03Å; W4-I34 HydrophobicContact CE3-CD1 4.06Å; W4-I34 HydrophobicContact CE3-CG2 4.37Å; W4-I34 HydrophobicContact CG-CG2 4Å; W4-I34 HydrophobicContact CZ3-CD1 4.48Å
5	S	69.2	Low	62.8	Low	76 Å²	76	91.9 Å²	91.9	53%	0.531	48%	0.478	S	S	.	.	H	α-helix	trans	-58.4	-38.2	-175.4	61.9	0	0	0	0	113.7	D3 R9	D3-S5 PolarHBondContact O-N 3.23Å; D3-S5 VanDerWaalsContact O-N 3.15Å; S5-R9 WeakPolarHBondContact O-CG 3.4Å; S5-R9 PolarHBondContact O-N 2.66Å; S5-R9 VanDerWaalsContact O-N 3.12Å
6	F	65.1	Low	62.6	Low	145 Å²	145	95.4 Å²	95.4	64%	0.636	49%	0.491	S	S	*	.	H	α-helix	trans	-69.1	-40.9	176.7	-177.4	-110.8	0	0	0	112	W4 R9 L10	W4-F6 VanDerWaalsContact C-N 3.33Å; W4-F6 PolarHBondContact O-N 3.19Å; F6-R9 PolarHBondContact O-N 2.77Å; F6-L10 HydrophobicContact CD1-CD1 3.93Å; F6-L10 HydrophobicContact CE1-CD1 3.49Å; F6-L10 VanDerWaalsContact CE1-CD1 3.49Å; F6-L10 HydrophobicContact CE1-CG 4.44Å; F6-L10 HydrophobicContact CE2-CD1 4.45Å; F6-L10 HydrophobicContact CZ-CD1 3.78Å; F6-L10 HydrophobicContact CZ-CG 4.4Å; F6-L10 WeakPolarHBondContact O-CG 3.44Å; F6-L10 PolarHBondContact O-N 2.73Å; F6-L10 VanDerWaalsContact O-N 3.08Å
7	L	64.9	Low	62.2	Low	33 Å²	33	94.5 Å²	94.5	17%	0.173	48%	0.484	C	S	.	.	H	α-helix	trans	-66	-40.1	177.5	-159.8	73.5	0	0	0	111.1	W4 L10 L11 F30 I34 L90	W4-L7 HydrophobicContact CE3-CD2 4.09Å; W4-L7 HydrophobicContact CZ3-CD2 4.25Å; W4-L7 PolarHBondContact O-N 2.91Å; W4-L7 VanDerWaalsContact O-N 3.14Å; L7-L10 PolarHBondContact O-N 2.86Å; L7-L11 HydrophobicContact CG-CD1 4.21Å; L7-L11 WeakPolarHBondContact O-CD1 3.27Å; L7-L11 PolarHBondContact O-N 3.37Å; L7-F30 HydrophobicContact CD2-CE1 4.28Å; L7-F30 HydrophobicContact CD2-CZ 4.12Å; L7-I34 HydrophobicContact CD2-CD1 4.27Å; L7-L90 HydrophobicContact CD1-CD1 4.06Å
8	G	65.9	Low	62	Low	39 Å²	39	91.1 Å²	91.1	40%	0.402	47%	0.47	S	S	.	.	H	α-helix	trans	-58.2	-52.4	173.1	0	0	0	0	0	112.6	W4 L10 L11 E12	W4-G8 PolarHBondContact O-N 2.82Å; G8-L10 VanDerWaalsContact C-N 3.27Å; G8-L10 PolarHBondContact O-N 3.4Å; G8-L11 PolarHBondContact O-N 3.34Å; G8-L11 VanDerWaalsContact O-N 3.07Å; G8-E12 PolarHBondContact O-N 2.85Å
9	R	66.8	Low	62.2	Low	181 Å²	181	88.1 Å²	88.1	68%	0.683	46%	0.456	S	S	*	.	H	α-helix	trans	-60.4	-33.8	177.8	-71.7	-178.9	-179.2	-157.5	0.8	112.9	S5 F6 N13	S5-R9 WeakPolarHBondContact O-CG 3.4Å; S5-R9 PolarHBondContact O-N 2.66Å; S5-R9 VanDerWaalsContact O-N 3.12Å; F6-R9 PolarHBondContact O-N 2.77Å; R9-N13 PolarHBondContact O-N 3.47Å; R9-N13 PolarHBondContact O-ND2 3.4Å
10	L	65	Low	62.3	Low	59 Å²	59	89.4 Å²	89.4	31%	0.309	47%	0.468	S	S	.	.	H	α-helix	trans	-71.3	-36.6	173.8	-73.9	174.3	0	0	0	112.9	F6 L7 G8 A14 L90 L93	F6-L10 HydrophobicContact CD1-CD1 3.93Å; F6-L10 HydrophobicContact CE1-CD1 3.49Å; F6-L10 VanDerWaalsContact CE1-CD1 3.49Å; F6-L10 HydrophobicContact CE1-CG 4.44Å; F6-L10 HydrophobicContact CE2-CD1 4.45Å; F6-L10 HydrophobicContact CZ-CD1 3.78Å; F6-L10 HydrophobicContact CZ-CG 4.4Å; F6-L10 WeakPolarHBondContact O-CG 3.44Å; F6-L10 PolarHBondContact O-N 2.73Å; F6-L10 VanDerWaalsContact O-N 3.08Å; L7-L10 PolarHBondContact O-N 2.86Å; G8-L10 VanDerWaalsContact C-N 3.27Å; G8-L10 PolarHBondContact O-N 3.4Å; L10-A14 PolarHBondContact O-N 3.36Å; L10-L90 HydrophobicContact CB-CD2 3.87Å; L10-L90 HydrophobicContact CD1-CD2 4.26Å; L10-L93 WeakPolarHBondContact O-CD1 3.33Å
11	L	64.6	Low	62.4	Low	21 Å²	21	91.1 Å²	91.1	11%	0.11	48%	0.476	C	S	.	.	H	α-helix	trans	-70	-31.3	172.9	-100.4	100.2	0	0	0	113.3	L7 G8 A14 Q15 T27 F30	L7-L11 HydrophobicContact CG-CD1 4.21Å; L7-L11 WeakPolarHBondContact O-CD1 3.27Å; L7-L11 PolarHBondContact O-N 3.37Å; G8-L11 PolarHBondContact O-N 3.34Å; G8-L11 VanDerWaalsContact O-N 3.07Å; L11-A14 WeakPolarHBondContact O-CB 3.31Å; L11-A14 PolarHBondContact O-N 2.78Å; L11-A14 VanDerWaalsContact O-N 3.16Å; L11-Q15 WeakPolarHBondContact O-CG 3.36Å; L11-T27 HydrophobicContact CD2-CG2 4Å; L11-F30 HydrophobicContact CD1-CD1 4.02Å; L11-F30 HydrophobicContact CD1-CE1 3.46Å; L11-F30 VanDerWaalsContact CD1-CE1 3.46Å; L11-F30 HydrophobicContact CD1-CZ 3.99Å; L11-F30 HydrophobicContact CD2-CB 4.27Å; L11-F30 HydrophobicContact CD2-CD1 3.35Å; L11-F30 HydrophobicContact CD2-CE1 3.73Å; L11-F30 HydrophobicContact CD2-CG 3.84Å; L11-F30 HydrophobicContact CG-CD1 4.32Å; L11-F30 HydrophobicContact CG-CE1 4.24Å
12	E	65.4	Low	63.3	Low	140 Å²	140	81.5 Å²	81.5	65%	0.654	43%	0.43	S	S	*	.	H	α-helix	trans	-69	-47.3	178.1	-168.7	165.3	-138.1	0	0	110.8	G8 A14 Q15	G8-E12 PolarHBondContact O-N 2.85Å; E12-A14 PolarHBondContact O-N 3.36Å; E12-Q15 WeakPolarHBondContact O-CB 3.4Å; E12-Q15 PolarHBondContact O-N 2.64Å
13	N	59.3	Low	63.8	Low	113 Å²	113	80.9 Å²	80.9	60%	0.604	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-10.1	169.9	-75.2	-87.9	0	0	0	113.5	R9 Q15	R9-N13 PolarHBondContact O-N 3.47Å; R9-N13 PolarHBondContact O-ND2 3.4Å; N13-Q15 VanDerWaalsContact C-N 3.3Å
14	A	57.9	Low	63.9	Low	12 Å²	12	77.5 Å²	77.5	10%	0.099	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-26	172.1	0	0	0	0	0	113.6	L10 L11 E12 E16 L93	L10-A14 PolarHBondContact O-N 3.36Å; L11-A14 WeakPolarHBondContact O-CB 3.31Å; L11-A14 PolarHBondContact O-N 2.78Å; L11-A14 VanDerWaalsContact O-N 3.16Å; E12-A14 PolarHBondContact O-N 3.36Å; A14-E16 VanDerWaalsContact C-N 3.32Å; A14-E16 PolarHBondContact O-N 2.92Å; A14-L93 VanDerWaalsContact CA-CD2 3.47Å; A14-L93 HydrophobicContact CB-CD1 3.26Å; A14-L93 HydrophobicContact CB-CD2 3.74Å; A14-L93 HydrophobicContact CB-CG 4.01Å
15	Q	53.4	Low	64	Low	54 Å²	54	79.8 Å²	79.8	25%	0.252	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	15.4	-155.7	-67.1	-98.1	-54.2	0	0	113.7	L11 E12 N13 K23 T27	L11-Q15 WeakPolarHBondContact O-CG 3.36Å; E12-Q15 WeakPolarHBondContact O-CB 3.4Å; E12-Q15 PolarHBondContact O-N 2.64Å; N13-Q15 VanDerWaalsContact C-N 3.3Å; Q15-K23 VanDerWaalsContact C-CE 3.49Å; Q15-K23 PolarHBondContact NE2-O 2.92Å; Q15-K23 WeakPolarHBondContact O-CD 3.42Å; Q15-K23 WeakPolarHBondContact O-CE 3.32Å; Q15-K23 PolarHBondContact O-NZ 3.12Å; Q15-K23 PolarHBondContact OE1-O 2.99Å; Q15-T27 HydrophobicContact CG-CG2 3.78Å; Q15-T27 VanDerWaalsContact NE2-CG2 3.28Å; Q15-T27 PolarHBondContact NE2-OG1 3.07Å; Q15-T27 PolarHBondContact OE1-OG1 2.9Å
16	E	58.9	Low	64.3	Low	148 Å²	148	77.3 Å²	77.3	69%	0.692	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-28.4	177.5	-64.3	-147.4	129.2	0	0	114.1	A14 K23	A14-E16 VanDerWaalsContact C-N 3.32Å; A14-E16 PolarHBondContact O-N 2.92Å; E16-K23 PolarHBondContact O-NZ 2.81Å
17	H	55.6	Low	64.8	Low	80 Å²	80	71.3 Å²	71.3	37%	0.37	36%	0.362	S	S	.	.	S	Bend	trans	-119.8	-15.7	-164.9	-58.7	-35.1	0	0	0	119.2	M165	H17-M165 HydrophobicContact CB-CE 4.28Å; H17-M165 VanDerWaalsContact O-CE 3.27Å; H17-M165 WeakPolarHBondContact O-CE 3.38Å
18	S	60.1	Low	65.6	Low	33 Å²	33	73.7 Å²	73.7	23%	0.231	38%	0.378	C	S	.	.	S	Bend	trans	-77.6	-173.9	177.8	-55.5	0	0	0	0	114	K23	S18-K23 VanDerWaalsContact N-CE 3.29Å; S18-K23 WeakPolarHBondContact O-CE 3.48Å
19	T	64.3	Low	66.4	Low	33 Å²	33	72.6 Å²	72.6	20%	0.202	36%	0.363	C	S	.	.			trans	-70.8	148.9	178.6	78.3	0	0	0	0	112.3	I21 G22 K23 E245	T19-I21 VanDerWaalsContact C-N 3.32Å; T19-I21 PolarHBondContact O-N 3.01Å; T19-G22 PolarHBondContact O-N 3.07Å; T19-G22 PolarHBondContact OG1-N 3Å; T19-K23 VanDerWaalsContact O-CB 3.31Å; T19-K23 WeakPolarHBondContact O-CB 3.49Å; T19-K23 WeakPolarHBondContact O-CG 3.41Å; T19-K23 PolarHBondContact O-N 3.4Å; T19-E245 VanDerWaalsContact CB-OE1 3.31Å; T19-E245 WeakPolarHBondContact CB-OE1 2.71Å; T19-E245 HydrophobicContact CG2-CG 4.41Å; T19-E245 VanDerWaalsContact CG2-OE1 3.27Å; T19-E245 WeakPolarHBondContact CG2-OE1 3.4Å; T19-E245 PolarHBondContact OG1-OE1 3.39Å
20	V	65.8	Low	67.2	Low	115 Å²	115	64.9 Å²	64.9	70%	0.697	34%	0.335	S	S	*	.	H	α-helix	trans	-59.2	-41.4	-177	-178.8	0	0	0	0	112.3	V24	V20-V24 PolarHBondContact O-N 2.95Å
21	I	64.6	Low	68.1	Low	125 Å²	125	66.3 Å²	66.3	64%	0.641	34%	0.342	S	S	*	.	H	α-helix	trans	-71.9	-46.6	-178.6	-64.8	167.3	0	0	0	110.6	T19	T19-I21 VanDerWaalsContact C-N 3.32Å; T19-I21 PolarHBondContact O-N 3.01Å
22	G	63.8	Low	69.2	Low	5 Å²	5	69.7 Å²	69.7	5%	0.052	36%	0.356	C	S	.	.	H	α-helix	trans	-62	-45.2	177	0	0	0	0	0	112.1	T19 L26	T19-G22 PolarHBondContact O-N 3.07Å; T19-G22 PolarHBondContact OG1-N 3Å; G22-L26 WeakPolarHBondContact O-CB 3.47Å; G22-L26 WeakPolarHBondContact O-CD1 3.3Å; G22-L26 WeakPolarHBondContact O-CG 3.44Å; G22-L26 PolarHBondContact O-N 3.44Å
23	K	68.9	Low	70.4	Confident	37 Å²	37	63.2 Å²	63.2	16%	0.161	33%	0.325	C	S	.	.	H	α-helix	trans	-50.2	-70.6	178.1	-82.4	173.9	178.8	-172.6	0	112.5	Q15 E16 S18 T19 W25 L26 T27	Q15-K23 VanDerWaalsContact C-CE 3.49Å; Q15-K23 PolarHBondContact NE2-O 2.92Å; Q15-K23 WeakPolarHBondContact O-CD 3.42Å; Q15-K23 WeakPolarHBondContact O-CE 3.32Å; Q15-K23 PolarHBondContact O-NZ 3.12Å; Q15-K23 PolarHBondContact OE1-O 2.99Å; E16-K23 PolarHBondContact O-NZ 2.81Å; S18-K23 VanDerWaalsContact N-CE 3.29Å; S18-K23 WeakPolarHBondContact O-CE 3.48Å; T19-K23 VanDerWaalsContact O-CB 3.31Å; T19-K23 WeakPolarHBondContact O-CB 3.49Å; T19-K23 WeakPolarHBondContact O-CG 3.41Å; T19-K23 PolarHBondContact O-N 3.4Å; K23-W25 PolarHBondContact O-N 3.14Å; K23-L26 PolarHBondContact O-N 3.39Å; K23-T27 PolarHBondContact O-N 3.36Å; K23-T27 PolarHBondContact O-OG1 2.96Å
24	V	71.9	Confident	71.8	Confident	80 Å²	80	59.2 Å²	59.2	49%	0.485	30%	0.304	S	S	.	.	H	α-helix	trans	-63.5	-44.4	-165	179.4	0	0	0	0	110.9	V20 T27 V28	V20-V24 PolarHBondContact O-N 2.95Å; V24-T27 PolarHBondContact O-OG1 2.97Å; V24-V28 HydrophobicContact CG1-CG2 4.42Å; V24-V28 WeakPolarHBondContact O-CB 3.48Å; V24-V28 WeakPolarHBondContact O-CG2 3.32Å; V24-V28 PolarHBondContact O-N 2.96Å
25	W	73.5	Confident	73.2	Confident	146 Å²	146	63.9 Å²	63.9	55%	0.553	33%	0.326	S	S	*	.	H	α-helix	trans	-69.7	-38.9	179.5	-81.2	83.9	0	0	0	112.7	K23 V28 L29 L241	K23-W25 PolarHBondContact O-N 3.14Å; W25-V28 PolarHBondContact O-N 3.24Å; W25-L29 HydrophobicContact CE3-CD1 4.31Å; W25-L29 HydrophobicContact CE3-CG 4.49Å; W25-L29 WeakPolarHBondContact O-CB 3.49Å; W25-L29 WeakPolarHBondContact O-CD1 3.42Å; W25-L29 WeakPolarHBondContact O-CG 3.46Å; W25-L29 PolarHBondContact O-N 3.39Å; W25-L241 HydrophobicContact CB-CD1 3.61Å; W25-L241 HydrophobicContact CB-CD2 4.29Å; W25-L241 HydrophobicContact CE3-CD1 4.31Å; W25-L241 HydrophobicContact CG-CD1 4.29Å
26	L	73.6	Confident	74.9	Confident	25 Å²	25	62.5 Å²	62.5	13%	0.131	32%	0.321	C	S	.	.	H	α-helix	trans	-74	-29.9	-178.5	-63.9	173.5	0	0	0	112.9	G22 K23 F30 L241 N242	G22-L26 WeakPolarHBondContact O-CB 3.47Å; G22-L26 WeakPolarHBondContact O-CD1 3.3Å; G22-L26 WeakPolarHBondContact O-CG 3.44Å; G22-L26 PolarHBondContact O-N 3.44Å; K23-L26 PolarHBondContact O-N 3.39Å; L26-F30 WeakPolarHBondContact O-CB 3.48Å; L26-F30 PolarHBondContact O-N 2.98Å; L26-L241 HydrophobicContact CD2-CB 3.92Å; L26-L241 HydrophobicContact CD2-CD1 4.19Å; L26-N242 WeakPolarHBondContact CD1-OD1 3.33Å
27	T	77.3	Confident	76.3	Confident	18 Å²	18	56 Å²	56	11%	0.11	29%	0.291	C	S	.	.	H	α-helix	trans	-71.7	-47	167.5	23.6	0	0	0	0	111.9	L11 Q15 K23 V24 L29 F30 I31	L11-T27 HydrophobicContact CD2-CG2 4Å; Q15-T27 HydrophobicContact CG-CG2 3.78Å; Q15-T27 VanDerWaalsContact NE2-CG2 3.28Å; Q15-T27 PolarHBondContact NE2-OG1 3.07Å; Q15-T27 PolarHBondContact OE1-OG1 2.9Å; K23-T27 PolarHBondContact O-N 3.36Å; K23-T27 PolarHBondContact O-OG1 2.96Å; V24-T27 PolarHBondContact O-OG1 2.97Å; T27-L29 PolarHBondContact O-N 3.38Å; T27-F30 PolarHBondContact O-N 3.21Å; T27-F30 VanDerWaalsContact O-N 3.16Å; T27-I31 WeakPolarHBondContact O-CB 3.45Å; T27-I31 VanDerWaalsContact O-CG1 3.27Å; T27-I31 WeakPolarHBondContact O-CG1 3.4Å; T27-I31 PolarHBondContact O-N 2.97Å
28	V	81.5	Confident	77.8	Confident	83 Å²	83	54.7 Å²	54.7	50%	0.503	30%	0.3	S	S	.	.	H	α-helix	trans	-57.8	-48.9	179.8	168.1	0	0	0	0	110.6	V24 W25 F30 I31 F32	V24-V28 HydrophobicContact CG1-CG2 4.42Å; V24-V28 WeakPolarHBondContact O-CB 3.48Å; V24-V28 WeakPolarHBondContact O-CG2 3.32Å; V24-V28 PolarHBondContact O-N 2.96Å; W25-V28 PolarHBondContact O-N 3.24Å; V28-F30 VanDerWaalsContact C-N 3.34Å; V28-F30 PolarHBondContact O-N 3.4Å; V28-I31 PolarHBondContact O-N 3.47Å; V28-F32 WeakPolarHBondContact O-CB 3.41Å; V28-F32 PolarHBondContact O-N 2.73Å
29	L	82.9	Confident	78.9	Confident	17 Å²	17	56.4 Å²	56.4	9%	0.089	32%	0.315	C	S	.	.	H	α-helix	trans	-64.7	-34.9	177.7	-65.7	166	0	0	0	112.7	W25 T27 R33 V234 V237 L241	W25-L29 HydrophobicContact CE3-CD1 4.31Å; W25-L29 HydrophobicContact CE3-CG 4.49Å; W25-L29 WeakPolarHBondContact O-CB 3.49Å; W25-L29 WeakPolarHBondContact O-CD1 3.42Å; W25-L29 WeakPolarHBondContact O-CG 3.46Å; W25-L29 PolarHBondContact O-N 3.39Å; T27-L29 PolarHBondContact O-N 3.38Å; L29-R33 WeakPolarHBondContact O-CG 3.08Å; L29-R33 PolarHBondContact O-N 2.63Å; L29-V234 HydrophobicContact CB-CG1 4.18Å; L29-V234 HydrophobicContact CD2-CG1 3.98Å; L29-V237 HydrophobicContact CD1-CB 4.49Å; L29-V237 HydrophobicContact CD1-CG1 3.84Å; L29-V237 HydrophobicContact CD2-CG1 4.36Å; L29-L241 HydrophobicContact CD1-CD1 3.43Å; L29-L241 VanDerWaalsContact CD1-CD1 3.43Å
30	F	82.2	Confident	79.8	Confident	18 Å²	18	55 Å²	55	8%	0.079	31%	0.308	C	S	.	.	H	α-helix	trans	-71.8	-44.8	178.2	-175	-91.4	0	0	0	112.4	L7 L11 L26 T27 V28 F32 R33 I34 I82	L7-F30 HydrophobicContact CD2-CE1 4.28Å; L7-F30 HydrophobicContact CD2-CZ 4.12Å; L11-F30 HydrophobicContact CD1-CD1 4.02Å; L11-F30 HydrophobicContact CD1-CE1 3.46Å; L11-F30 VanDerWaalsContact CD1-CE1 3.46Å; L11-F30 HydrophobicContact CD1-CZ 3.99Å; L11-F30 HydrophobicContact CD2-CB 4.27Å; L11-F30 HydrophobicContact CD2-CD1 3.35Å; L11-F30 HydrophobicContact CD2-CE1 3.73Å; L11-F30 HydrophobicContact CD2-CG 3.84Å; L11-F30 HydrophobicContact CG-CD1 4.32Å; L11-F30 HydrophobicContact CG-CE1 4.24Å; L26-F30 WeakPolarHBondContact O-CB 3.48Å; L26-F30 PolarHBondContact O-N 2.98Å; T27-F30 PolarHBondContact O-N 3.21Å; T27-F30 VanDerWaalsContact O-N 3.16Å; V28-F30 VanDerWaalsContact C-N 3.34Å; V28-F30 PolarHBondContact O-N 3.4Å; F30-F32 VanDerWaalsContact C-N 3.3Å; F30-F32 PolarHBondContact O-N 3.04Å; F30-R33 PolarHBondContact O-N 2.88Å; F30-I34 HydrophobicContact CD1-CD1 3.95Å; F30-I34 HydrophobicContact CE1-CD1 3.38Å; F30-I34 HydrophobicContact CE1-CG1 4.34Å; F30-I34 HydrophobicContact CZ-CD1 3.97Å; F30-I34 PolarHBondContact O-N 2.85Å; F30-I34 VanDerWaalsContact O-N 3.14Å; F30-I82 HydrophobicContact CE2-CB 4.5Å; F30-I82 HydrophobicContact CE2-CG2 3.72Å; F30-I82 HydrophobicContact CZ-CG2 3.63Å
31	I	85.1	Confident	80.5	Confident	89 Å²	89	50.8 Å²	50.8	46%	0.456	28%	0.284	S	S	.	.	H	α-helix	trans	-60.4	-43.4	173.4	-67.9	165	0	0	0	109.5	T27 V28 R33 I34 L35	T27-I31 WeakPolarHBondContact O-CB 3.45Å; T27-I31 VanDerWaalsContact O-CG1 3.27Å; T27-I31 WeakPolarHBondContact O-CG1 3.4Å; T27-I31 PolarHBondContact O-N 2.97Å; V28-I31 PolarHBondContact O-N 3.47Å; I31-R33 PolarHBondContact O-N 3.05Å; I31-I34 PolarHBondContact O-N 2.99Å; I31-I34 VanDerWaalsContact O-N 3.1Å; I31-L35 HydrophobicContact CG2-CD1 3.86Å; I31-L35 HydrophobicContact CG2-CG 4.19Å; I31-L35 WeakPolarHBondContact O-CG 3.36Å; I31-L35 PolarHBondContact O-N 3.46Å
32	F	86.8	Confident	81.2	Confident	92 Å²	92	50.6 Å²	50.6	40%	0.404	28%	0.281	S	S	.	.	H	α-helix	trans	-61.2	-39.4	178.1	-167	-132.9	0	0	0	112.6	V28 F30 L35 V36 F230 V234	V28-F32 WeakPolarHBondContact O-CB 3.41Å; V28-F32 PolarHBondContact O-N 2.73Å; F30-F32 VanDerWaalsContact C-N 3.3Å; F30-F32 PolarHBondContact O-N 3.04Å; F32-L35 PolarHBondContact O-N 2.9Å; F32-V36 WeakPolarHBondContact O-CG2 3.37Å; F32-V36 PolarHBondContact O-N 3.37Å; F32-F230 AromaticContact CD1-CZ 3.97Å; F32-F230 HydrophobicContact CD1-CZ 3.97Å; F32-F230 HydrophobicContact CE1-CE1 4.2Å; F32-F230 AromaticContact CE1-CE2 3.79Å; F32-F230 HydrophobicContact CE1-CE2 3.79Å; F32-F230 AromaticContact CE1-CZ 3.26Å; F32-F230 HydrophobicContact CE1-CZ 3.26Å; F32-F230 HydrophobicContact CE2-CZ 4.23Å; F32-F230 AromaticContact CZ-CE2 3.83Å; F32-F230 HydrophobicContact CZ-CE2 3.83Å; F32-F230 AromaticContact CZ-CZ 3.43Å; F32-F230 HydrophobicContact CZ-CZ 3.43Å; F32-F230 VanDerWaalsContact CZ-CZ 3.43Å; F32-V234 HydrophobicContact CD1-CG1 4.48Å; F32-V234 HydrophobicContact CD1-CG2 4.01Å; F32-V234 HydrophobicContact CE1-CG2 4.14Å
33	R	90.4	Very high	82.3	Confident	5 Å²	5	57 Å²	57	2%	0.019	31%	0.31	C	S	.	.	H	α-helix	trans	-61.8	-44.6	170.3	-70	-172.2	-155.7	173	11.1	112.4	L29 F30 I31 V36 L37 I82 E184 M231 V234	L29-R33 WeakPolarHBondContact O-CG 3.08Å; L29-R33 PolarHBondContact O-N 2.63Å; F30-R33 PolarHBondContact O-N 2.88Å; I31-R33 PolarHBondContact O-N 3.05Å; R33-V36 PolarHBondContact O-N 2.68Å; R33-L37 WeakPolarHBondContact O-CB 3.33Å; R33-L37 WeakPolarHBondContact O-CD1 3.28Å; R33-L37 PolarHBondContact O-N 2.98Å; R33-I82 HydrophobicContact CB-CD1 4.04Å; R33-I82 HydrophobicContact CB-CG1 4.42Å; R33-E184 IonicContact CZ-OE1 3.36Å; R33-E184 IonicContact CZ-OE2 2.69Å; R33-E184 IonicContact NH1-OE1 3.8Å; R33-E184 PolarHBondContact NH1-OE1 3.12Å; R33-E184 IonicContact NH1-OE2 3.87Å; R33-E184 VanDerWaalsContact NH2-CD 3.3Å; R33-E184 IonicContact NH2-OE1 2.99Å; R33-E184 PolarHBondContact NH2-OE1 3Å; R33-E184 IonicContact NH2-OE2 3.17Å; R33-E184 PolarHBondContact NH2-OE2 3.15Å; R33-M231 HydrophobicContact CB-CE 4.18Å; R33-M231 HydrophobicContact CG-CE 3.99Å; R33-M231 HydrophobicContact CG-SD 4.23Å; R33-V234 HydrophobicContact CG-CB 4.43Å; R33-V234 HydrophobicContact CG-CG1 3.63Å; R33-V234 PolarHBondContact NH2-O 3.24Å
34	I	88.8	Confident	83.2	Confident	29 Å²	29	55.3 Å²	55.3	15%	0.149	30%	0.302	C	S	.	.	H	α-helix	trans	-65.5	-40.2	179	-68.3	178.1	0	0	0	111.1	W4 L7 F30 I31 L37 G38 I82	W4-I34 HydrophobicContact CB-CG2 4.32Å; W4-I34 HydrophobicContact CD2-CG2 4.03Å; W4-I34 HydrophobicContact CE3-CD1 4.06Å; W4-I34 HydrophobicContact CE3-CG2 4.37Å; W4-I34 HydrophobicContact CG-CG2 4Å; W4-I34 HydrophobicContact CZ3-CD1 4.48Å; L7-I34 HydrophobicContact CD2-CD1 4.27Å; F30-I34 HydrophobicContact CD1-CD1 3.95Å; F30-I34 HydrophobicContact CE1-CD1 3.38Å; F30-I34 HydrophobicContact CE1-CG1 4.34Å; F30-I34 HydrophobicContact CZ-CD1 3.97Å; F30-I34 PolarHBondContact O-N 2.85Å; F30-I34 VanDerWaalsContact O-N 3.14Å; I31-I34 PolarHBondContact O-N 2.99Å; I31-I34 VanDerWaalsContact O-N 3.1Å; I34-L37 PolarHBondContact O-N 2.73Å; I34-G38 PolarHBondContact O-N 3.04Å; I34-I82 HydrophobicContact CD1-CG2 4.37Å; I34-I82 HydrophobicContact CG1-CD1 4.38Å; I34-I82 HydrophobicContact CG1-CG2 4.26Å
35	L	88.2	Confident	84	Confident	109 Å²	109	52 Å²	52	57%	0.571	28%	0.281	S	S	*	.	H	α-helix	trans	-63.1	-44.4	175.8	-71.6	172.9	0	0	0	112	I31 F32 G38 A39	I31-L35 HydrophobicContact CG2-CD1 3.86Å; I31-L35 HydrophobicContact CG2-CG 4.19Å; I31-L35 WeakPolarHBondContact O-CG 3.36Å; I31-L35 PolarHBondContact O-N 3.46Å; F32-L35 PolarHBondContact O-N 2.9Å; L35-G38 PolarHBondContact O-N 2.88Å; L35-A39 PolarHBondContact O-N 3.15Å
36	V	87.8	Confident	84.6	Confident	25 Å²	25	47.9 Å²	47.9	15%	0.152	28%	0.284	C	S	.	.	H	α-helix	trans	-72.5	-34	179.4	171.7	0	0	0	0	112.2	F32 R33 A40 F227 F230 M231	F32-V36 WeakPolarHBondContact O-CG2 3.37Å; F32-V36 PolarHBondContact O-N 3.37Å; R33-V36 PolarHBondContact O-N 2.68Å; V36-A40 VanDerWaalsContact O-CB 3.23Å; V36-A40 WeakPolarHBondContact O-CB 3.21Å; V36-A40 PolarHBondContact O-N 2.83Å; V36-F227 HydrophobicContact CG1-CD1 3.87Å; V36-F227 HydrophobicContact CG1-CE1 4.04Å; V36-F230 HydrophobicContact CB-CE1 4.02Å; V36-F230 HydrophobicContact CG1-CD1 4.18Å; V36-F230 HydrophobicContact CG1-CE1 3.78Å; V36-F230 HydrophobicContact CG2-CE1 3.68Å; V36-F230 HydrophobicContact CG2-CZ 3.78Å; V36-M231 HydrophobicContact CG1-SD 4.48Å
37	L	88.8	Confident	85.3	Confident	12 Å²	12	47.5 Å²	47.5	6%	0.063	28%	0.282	C	S	.	.	H	α-helix	trans	-61.2	-45.2	165.8	-99.4	72.6	0	0	0	111.2	R33 I34 A39 A41 W78 V79 I82 M231	R33-L37 WeakPolarHBondContact O-CB 3.33Å; R33-L37 WeakPolarHBondContact O-CD1 3.28Å; R33-L37 PolarHBondContact O-N 2.98Å; I34-L37 PolarHBondContact O-N 2.73Å; L37-A39 VanDerWaalsContact C-N 3.33Å; L37-A39 PolarHBondContact O-N 3Å; L37-A41 WeakPolarHBondContact O-CB 3.48Å; L37-A41 PolarHBondContact O-N 2.93Å; L37-W78 HydrophobicContact CD1-CB 3.93Å; L37-W78 HydrophobicContact CD1-CE3 4.12Å; L37-W78 HydrophobicContact CD2-CB 4.21Å; L37-V79 HydrophobicContact CD2-CG2 3.58Å; L37-I82 HydrophobicContact CD1-CD1 4.09Å; L37-I82 HydrophobicContact CD2-CD1 3.7Å; L37-I82 HydrophobicContact CG-CD1 4.47Å; L37-M231 HydrophobicContact CD1-CE 3.44Å; L37-M231 VanDerWaalsContact CD1-CE 3.44Å; L37-M231 HydrophobicContact CD1-SD 4.18Å
38	G	87.1	Confident	85.8	Confident	53 Å²	53	48 Å²	48	55%	0.546	28%	0.283	S	S	.	.	H	α-helix	trans	-61.9	-38.2	-179.3	0	0	0	0	0	113.5	I34 L35	I34-G38 PolarHBondContact O-N 3.04Å; L35-G38 PolarHBondContact O-N 2.88Å
39	A	84.4	Confident	86.1	Confident	68 Å²	68	49.7 Å²	49.7	56%	0.562	29%	0.285	S	S	*	.	H	α-helix	trans	-77.1	-53	176.5	0	0	0	0	0	112.3	L35 L37	L35-A39 PolarHBondContact O-N 3.15Å; L37-A39 VanDerWaalsContact C-N 3.33Å; L37-A39 PolarHBondContact O-N 3Å
40	A	82.1	Confident	86.4	Confident	5 Å²	5	52.7 Å²	52.7	4%	0.041	31%	0.308	C	S	.	.	H	α-helix	trans	-81.5	-18.5	-169.3	0	0	0	0	0	114.1	V36 E42 V44 W45 F227	V36-A40 VanDerWaalsContact O-CB 3.23Å; V36-A40 WeakPolarHBondContact O-CB 3.21Å; V36-A40 PolarHBondContact O-N 2.83Å; A40-E42 PolarHBondContact O-N 3.27Å; A40-V44 HydrophobicContact CB-CB 4.48Å; A40-V44 HydrophobicContact CB-CG2 3.97Å; A40-V44 VanDerWaalsContact O-CB 3.28Å; A40-V44 WeakPolarHBondContact O-CB 3.36Å; A40-V44 PolarHBondContact O-N 3.49Å; A40-W45 HydrophobicContact CB-CZ3 4.02Å; A40-F227 HydrophobicContact CB-CD1 3.9Å; A40-F227 HydrophobicContact CB-CE1 3.63Å; A40-F227 HydrophobicContact CB-CE2 4.35Å; A40-F227 HydrophobicContact CB-CG 4.37Å; A40-F227 HydrophobicContact CB-CZ 3.88Å
41	A	81.6	Confident	86.9	Confident	25 Å²	25	55.7 Å²	55.7	21%	0.207	33%	0.325	C	S	.	.	H	α-helix	trans	-63.6	-43.6	-171.2	0	0	0	0	0	113.8	L37 I75	L37-A41 WeakPolarHBondContact O-CB 3.48Å; L37-A41 PolarHBondContact O-N 2.93Å; A41-I75 VanDerWaalsContact CA-CD1 3.49Å; A41-I75 HydrophobicContact CB-CD1 3.76Å; A41-I75 HydrophobicContact CB-CG1 4.21Å; A41-I75 HydrophobicContact CB-CG2 4.06Å; A41-I75 WeakPolarHBondContact O-CD1 3.42Å
42	E	79.4	Confident	87.4	Confident	122 Å²	122	51.5 Å²	51.5	57%	0.57	30%	0.303	S	S	*	.	H	α-helix	trans	-89.7	-32.8	-175.8	-63.9	179.7	-176.7	0	0	111.5	M1 A40 G46	M1-E42 VanDerWaalsContact CE-OE2 3.3Å; M1-E42 WeakPolarHBondContact CE-OE2 3.42Å; A40-E42 PolarHBondContact O-N 3.27Å; E42-G46 WeakPolarHBondContact O-CA 3.41Å; E42-G46 PolarHBondContact O-N 3.21Å
43	E	85.4	Confident	87.8	Confident	140 Å²	140	50.5 Å²	50.5	65%	0.654	31%	0.305	S	S	*	.	H	α-helix	trans	-76.3	-43	178.8	-177.8	172	-155.3	0	0	113.5
44	V	88.4	Confident	88.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-99.2	-26.5	-165.7	-172.9	0	0	0	0	112.4	A40 E223 K224 F227	A40-V44 HydrophobicContact CB-CB 4.48Å; A40-V44 HydrophobicContact CB-CG2 3.97Å; A40-V44 VanDerWaalsContact O-CB 3.28Å; A40-V44 WeakPolarHBondContact O-CB 3.36Å; A40-V44 PolarHBondContact O-N 3.49Å; V44-E223 HydrophobicContact CG1-CB 4.5Å; V44-E223 HydrophobicContact CG1-CG 3.92Å; V44-K224 HydrophobicContact CG1-CG 3.83Å; V44-K224 WeakPolarHBondContact O-CE 3.14Å; V44-K224 PolarHBondContact O-NZ 2.91Å; V44-F227 HydrophobicContact CB-CE2 4.48Å; V44-F227 HydrophobicContact CG1-CD2 4.06Å; V44-F227 HydrophobicContact CG1-CE2 4.22Å; V44-F227 HydrophobicContact CG2-CD2 4.19Å; V44-F227 HydrophobicContact CG2-CE2 3.61Å; V44-F227 HydrophobicContact CG2-CZ 4.15Å
45	W	89.6	Confident	88.5	Confident	10 Å²	10	55.1 Å²	55.1	4%	0.038	33%	0.331	C	S	.	.	S	Bend	trans	-123.1	6.3	174.4	-66	-98.2	0	0	0	113.5	A40 D47 E48 H74 I75 W78 K224 F227	A40-W45 HydrophobicContact CB-CZ3 4.02Å; W45-D47 PolarHBondContact O-N 3.15Å; W45-E48 HydrophobicContact CB-CB 4.03Å; W45-E48 HydrophobicContact CB-CG 4.34Å; W45-E48 VanDerWaalsContact CD1-OE2 3.23Å; W45-E48 VanDerWaalsContact O-CB 3.29Å; W45-E48 WeakPolarHBondContact O-CB 3.45Å; W45-E48 VanDerWaalsContact O-CG 3.25Å; W45-E48 WeakPolarHBondContact O-CG 3.5Å; W45-E48 PolarHBondContact O-N 3.06Å; W45-H74 HydrophobicContact CZ2-CB 4.02Å; W45-H74 AromaticContact NE1-ND1 3.94Å; W45-I75 HydrophobicContact CB-CD1 3.5Å; W45-I75 VanDerWaalsContact CB-CD1 3.5Å; W45-I75 HydrophobicContact CD2-CD1 3.81Å; W45-I75 HydrophobicContact CD2-CG1 4.04Å; W45-I75 HydrophobicContact CE3-CD1 3.71Å; W45-I75 HydrophobicContact CE3-CG1 3.85Å; W45-I75 HydrophobicContact CG-CD1 3.76Å; W45-I75 HydrophobicContact CG-CG1 4.38Å; W45-I75 HydrophobicContact CZ3-CG1 4.42Å; W45-W78 AromaticContact CH2-CH2 3.48Å; W45-W78 HydrophobicContact CH2-CH2 3.48Å; W45-W78 VanDerWaalsContact CH2-CH2 3.48Å; W45-W78 AromaticContact CH2-CZ3 3.42Å; W45-W78 HydrophobicContact CH2-CZ3 3.42Å; W45-W78 VanDerWaalsContact CH2-CZ3 3.42Å; W45-W78 AromaticContact CZ2-CH2 3.69Å; W45-W78 HydrophobicContact CZ2-CH2 3.69Å; W45-W78 AromaticContact CZ2-CZ3 3.88Å; W45-W78 HydrophobicContact CZ2-CZ3 3.88Å; W45-W78 HydrophobicContact CZ3-CH2 4.43Å; W45-W78 AromaticContact CZ3-CZ3 3.94Å; W45-W78 HydrophobicContact CZ3-CZ3 3.94Å; W45-K224 HydrophobicContact CD2-CG 4.4Å; W45-K224 HydrophobicContact CZ2-CB 4.03Å; W45-K224 HydrophobicContact CZ2-CG 3.9Å; W45-F227 HydrophobicContact CH2-CB 3.67Å; W45-F227 HydrophobicContact CH2-CD2 4.47Å; W45-F227 HydrophobicContact CH2-CG 4.24Å; W45-F227 HydrophobicContact CZ3-CB 4.35Å; W45-F227 HydrophobicContact CZ3-CG 4.49Å
46	G	85.6	Confident	88.9	Confident	60 Å²	60	52 Å²	52	62%	0.619	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-28.9	170.1	0	0	0	0	0	112.3	E42	E42-G46 WeakPolarHBondContact O-CA 3.41Å; E42-G46 PolarHBondContact O-N 3.21Å
47	D	87.5	Confident	89.2	Confident	17 Å²	17	60.2 Å²	60.2	9%	0.091	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	5.1	176.2	73.4	5.9	0	0	0	114.9	W45 Q49 S50 D51 S219 R220 K224	W45-D47 PolarHBondContact O-N 3.15Å; D47-Q49 PolarHBondContact O-N 2.97Å; D47-S50 WeakPolarHBondContact CA-OG 3.25Å; D47-S50 PolarHBondContact O-N 3.3Å; D47-S50 VanDerWaalsContact O-N 3.17Å; D47-S50 PolarHBondContact O-OG 3.26Å; D47-D51 HydrophobicContact CB-CB 4.28Å; D47-D51 PolarHBondContact O-N 3.22Å; D47-D51 VanDerWaalsContact O-N 3.12Å; D47-S219 PolarHBondContact OD1-OG 3.41Å; D47-S219 PolarHBondContact OD2-OG 3.16Å; D47-R220 VanDerWaalsContact OD2-CD 3.24Å; D47-R220 WeakPolarHBondContact OD2-CD 2.94Å; D47-R220 IonicContact OD2-CZ 2.66Å; D47-R220 IonicContact OD2-NE 3.14Å; D47-R220 PolarHBondContact OD2-NE 3.35Å; D47-R220 IonicContact OD2-NH2 2.74Å; D47-K224 IonicContact OD1-NZ 3.18Å; D47-K224 PolarHBondContact OD1-NZ 3.41Å
48	E	88	Confident	89.6	Confident	29 Å²	29	63.2 Å²	63.2	14%	0.136	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.9	-164.2	70.7	174.5	173.6	0	0	114.1	W45 Y66 S73 R76	W45-E48 HydrophobicContact CB-CB 4.03Å; W45-E48 HydrophobicContact CB-CG 4.34Å; W45-E48 VanDerWaalsContact CD1-OE2 3.23Å; W45-E48 VanDerWaalsContact O-CB 3.29Å; W45-E48 WeakPolarHBondContact O-CB 3.45Å; W45-E48 VanDerWaalsContact O-CG 3.25Å; W45-E48 WeakPolarHBondContact O-CG 3.5Å; W45-E48 PolarHBondContact O-N 3.06Å; E48-Y66 VanDerWaalsContact CG-OH 3.28Å; E48-Y66 WeakPolarHBondContact CG-OH 3.21Å; E48-Y66 WeakPolarHBondContact O-CE2 3.42Å; E48-Y66 PolarHBondContact OE1-OH 3.31Å; E48-S73 VanDerWaalsContact CD-CB 3.44Å; E48-S73 WeakPolarHBondContact OE1-CB 3.47Å; E48-S73 PolarHBondContact OE1-OG 2.96Å; E48-S73 WeakPolarHBondContact OE2-CB 3.22Å; E48-S73 PolarHBondContact OE2-OG 3.16Å; E48-R76 IonicContact OE1-NH1 2.88Å; E48-R76 PolarHBondContact OE1-NH1 3.13Å
49	Q	88	Confident	90	Very high	118 Å²	118	65.5 Å²	65.5	55%	0.551	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-21.4	179.6	-170.3	-179.6	-16.6	0	0	113.7	D47 Y66	D47-Q49 PolarHBondContact O-N 2.97Å; Q49-Y66 HydrophobicContact CB-CE1 4.29Å; Q49-Y66 HydrophobicContact CB-CE2 4.28Å; Q49-Y66 HydrophobicContact CG-CD1 4.16Å; Q49-Y66 HydrophobicContact CG-CE1 4.13Å; Q49-Y66 HydrophobicContact CG-CG 4.42Å
50	S	90.1	Very high	90.6	Very high	80 Å²	80	63.9 Å²	63.9	56%	0.559	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-33.2	178.9	54.4	0	0	0	0	112.7	D47	D47-S50 WeakPolarHBondContact CA-OG 3.25Å; D47-S50 PolarHBondContact O-N 3.3Å; D47-S50 VanDerWaalsContact O-N 3.17Å; D47-S50 PolarHBondContact O-OG 3.26Å
51	D	92.4	Very high	91.3	Very high	81 Å²	81	63.6 Å²	63.6	43%	0.433	36%	0.36	S	S	.	.	S	Bend	trans	-107.5	5.6	-171.3	-66.1	41.5	0	0	0	111.4	D47 T53 S219	D47-D51 HydrophobicContact CB-CB 4.28Å; D47-D51 PolarHBondContact O-N 3.22Å; D47-D51 VanDerWaalsContact O-N 3.12Å; D51-T53 PolarHBondContact O-N 3.29Å; D51-S219 VanDerWaalsContact CB-CB 3.48Å
52	F	94.5	Very high	91.9	Very high	2 Å²	2	65.9 Å²	65.9	1%	0.009	37%	0.366	C	S	.	.			trans	-81.4	102.2	167.3	178.3	-92.1	0	0	0	109.2	E62 C65 Y66 A69 F70 C216 F217 I218	F52-E62 HydrophobicContact CD1-CG 4.01Å; F52-E62 HydrophobicContact CE1-CG 4.37Å; F52-E62 WeakPolarHBondContact O-CG 3.42Å; F52-C65 HydrophobicContact CE1-CB 4.08Å; F52-C65 HydrophobicContact CZ-CB 4.2Å; F52-Y66 HydrophobicContact CB-CD2 4.07Å; F52-Y66 HydrophobicContact CD1-CD2 4.05Å; F52-Y66 HydrophobicContact CD1-CG 4.38Å; F52-Y66 HydrophobicContact CD2-CD2 4.29Å; F52-Y66 AromaticContact CG-CD2 3.88Å; F52-Y66 HydrophobicContact CG-CD2 3.88Å; F52-A69 HydrophobicContact CE2-CB 4.46Å; F52-F70 HydrophobicContact CD2-CE2 4.21Å; F52-F70 HydrophobicContact CE2-CE2 4.23Å; F52-C216 HydrophobicContact CE1-CB 3.93Å; F52-C216 HydrophobicContact CE2-CB 3.94Å; F52-C216 HydrophobicContact CZ-CB 3.43Å; F52-C216 VanDerWaalsContact CZ-CB 3.43Å; F52-F217 WeakPolarHBondContact CA-O 3.25Å; F52-I218 HydrophobicContact CD2-CG1 4.43Å; F52-I218 HydrophobicContact CE2-CD1 4.39Å; F52-I218 HydrophobicContact CE2-CG1 4.38Å
53	T	95.8	Very high	92.7	Very high	71 Å²	71	64.6 Å²	64.6	44%	0.436	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.8	-172.3	41.2	0	0	0	0	112.1	D51 E62 C216 F217	D51-T53 PolarHBondContact O-N 3.29Å; T53-E62 VanDerWaalsContact CA-OE2 3.31Å; T53-E62 WeakPolarHBondContact CA-OE2 3.33Å; T53-C216 CarbonylContact O-C 3.53Å; T53-C216 WeakPolarHBondContact O-CA 3.33Å; T53-F217 PolarHBondContact N-O 3.13Å; T53-F217 PolarHBondContact O-N 3.27Å
54	C	96.9	Very high	93.2	Very high	13 Å²	13	59.6 Å²	59.6	9%	0.088	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	140.2	176	-64.7	0	0	0	0	112.2	T56 E62 V214 C216	C54-T56 HydrophobicContact CB-CG2 4.1Å; C54-T56 PolarHBondContact O-N 3.4Å; C54-E62 HydrophobicContact CB-CB 4.46Å; C54-E62 HydrophobicContact CB-CG 4.48Å; C54-E62 PolarHBondContact N-OE2 3.4Å; C54-V214 HydrophobicContact CB-CG2 4.43Å; C54-C216 HydrophobicContact CB-CB 4.07Å; C54-C216 WeakPolarHBondContact CB-SG 3.41Å; C54-C216 WeakPolarHBondContact SG-CB 3.45Å; C54-C216 CovalentContact SG-SG 2.04Å; C54-C216 PolarHBondContact SG-SG 3.17Å
55	N	96.6	Very high	93.6	Very high	117 Å²	117	59.6 Å²	59.6	63%	0.626	34%	0.342	S	S	*	.	S	Bend	trans	-74.9	69.2	177	-172.1	13	0	0	0	111.6	D215 F217	N55-D215 PolarHBondContact N-O 2.87Å; N55-F217 HydrophobicContact CB-CE2 4.48Å
56	T	96.1	Very high	93.9	Very high	44 Å²	44	60.3 Å²	60.3	27%	0.27	35%	0.345	S	S	.	.			trans	-160.4	155.7	-179.8	-166.5	0	0	0	0	111.4	C54 Q58 C61 V214	C54-T56 HydrophobicContact CB-CG2 4.1Å; C54-T56 PolarHBondContact O-N 3.4Å; T56-Q58 HydrophobicContact CG2-CB 4.3Å; T56-Q58 PolarHBondContact OG1-N 3.05Å; T56-C61 HydrophobicContact CG2-CB 3.97Å; T56-V214 HydrophobicContact CG2-CG1 4.4Å
57	Q	95.9	Very high	94.3	Very high	198 Å²	198	61.2 Å²	61.2	93%	0.925	34%	0.336	S	S	*	.			trans	-100.8	7.4	170.2	-66.9	179.7	69.8	0	0	112.2	P59	Q57-P59 WeakPolarHBondContact O-CD 3.35Å
58	Q	95.8	Very high	94.7	Very high	74 Å²	74	65 Å²	65	35%	0.346	35%	0.351	S	S	.	.			trans	-74.8	115.8	-178.4	179.6	61.7	39.2	0	0	111.5	T56 G60 C61 P209 P211	T56-Q58 HydrophobicContact CG2-CB 4.3Å; T56-Q58 PolarHBondContact OG1-N 3.05Å; Q58-G60 PolarHBondContact O-N 3.35Å; Q58-C61 HydrophobicContact CB-CB 4.02Å; Q58-C61 HydrophobicContact CG-CB 4.04Å; Q58-C61 WeakPolarHBondContact O-CB 3.46Å; Q58-C61 PolarHBondContact O-N 3.49Å; Q58-P209 HydrophobicContact CG-CB 4.48Å; Q58-P209 HydrophobicContact CG-CG 4.49Å; Q58-P209 WeakPolarHBondContact CG-O 3.27Å; Q58-P211 HydrophobicContact CB-CG 4.47Å
59	P	96.6	Very high	94.9	Very high	102 Å²	102	64.4 Å²	64.4	66%	0.662	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	138.7	178.6	24.7	-34.7	0	0	0	111.8	Q57 C61 P209	Q57-P59 WeakPolarHBondContact O-CD 3.35Å; P59-C61 PolarHBondContact O-N 3.45Å; P59-P209 WeakPolarHBondContact O-CG 3.39Å
60	G	95.5	Very high	95.2	Very high	33 Å²	33	59.9 Å²	59.9	34%	0.34	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	-8.8	179	0	0	0	0	0	115.9	Q58 N63 V64	Q58-G60 PolarHBondContact O-N 3.35Å; G60-N63 PolarHBondContact O-N 3.17Å; G60-V64 PolarHBondContact O-N 3.42Å
61	C	96.8	Very high	95.4	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61.4	-44.9	176.2	172.7	0	0	0	0	111.3	T56 Q58 P59 N63 V64 C65 C210	T56-C61 HydrophobicContact CG2-CB 3.97Å; Q58-C61 HydrophobicContact CB-CB 4.02Å; Q58-C61 HydrophobicContact CG-CB 4.04Å; Q58-C61 WeakPolarHBondContact O-CB 3.46Å; Q58-C61 PolarHBondContact O-N 3.49Å; P59-C61 PolarHBondContact O-N 3.45Å; C61-N63 PolarHBondContact O-N 3.2Å; C61-V64 WeakPolarHBondContact O-CG2 3.44Å; C61-V64 PolarHBondContact O-N 3.47Å; C61-C65 WeakPolarHBondContact O-CB 3.46Å; C61-C65 PolarHBondContact O-N 3.36Å; C61-C65 PolarHBondContact O-SG 2.89Å; C61-C210 VanDerWaalsContact CA-SG 3.51Å; C61-C210 HydrophobicContact CB-CB 4.06Å; C61-C210 WeakPolarHBondContact CB-SG 3.3Å; C61-C210 WeakPolarHBondContact SG-CB 3.33Å; C61-C210 CovalentContact SG-SG 2.03Å; C61-C210 PolarHBondContact SG-SG 3.14Å
62	E	95.8	Very high	95.4	Very high	72 Å²	72	58.5 Å²	58.5	34%	0.336	32%	0.321	S	S	.	.	H	α-helix	trans	-57.7	-47.9	178.5	-167.7	163.7	86.5	0	0	112.6	F52 T53 C54 V64 C65 Y66	F52-E62 HydrophobicContact CD1-CG 4.01Å; F52-E62 HydrophobicContact CE1-CG 4.37Å; F52-E62 WeakPolarHBondContact O-CG 3.42Å; T53-E62 VanDerWaalsContact CA-OE2 3.31Å; T53-E62 WeakPolarHBondContact CA-OE2 3.33Å; C54-E62 HydrophobicContact CB-CB 4.46Å; C54-E62 HydrophobicContact CB-CG 4.48Å; C54-E62 PolarHBondContact N-OE2 3.4Å; E62-V64 PolarHBondContact O-N 3.04Å; E62-C65 PolarHBondContact O-N 3.12Å; E62-Y66 WeakPolarHBondContact O-CB 3.37Å; E62-Y66 PolarHBondContact O-N 3Å
63	N	95.4	Very high	95.3	Very high	96 Å²	96	58.5 Å²	58.5	51%	0.513	32%	0.321	S	S	.	.	H	α-helix	trans	-59.1	-44.4	178.1	-55.5	85.4	0	0	0	112.8	G60 C61 C65 D67	G60-N63 PolarHBondContact O-N 3.17Å; C61-N63 PolarHBondContact O-N 3.2Å; N63-C65 VanDerWaalsContact C-N 3.34Å; N63-D67 WeakPolarHBondContact O-CB 3.47Å; N63-D67 PolarHBondContact O-N 2.89Å; N63-D67 VanDerWaalsContact O-N 3.08Å
64	V	96.5	Very high	95.1	Very high	34 Å²	34	55.2 Å²	55.2	21%	0.206	30%	0.3	C	S	.	.	H	α-helix	trans	-74.6	-26.5	-179.8	-57.7	0	0	0	0	112.4	G60 C61 E62 K68 R207	G60-V64 PolarHBondContact O-N 3.42Å; C61-V64 WeakPolarHBondContact O-CG2 3.44Å; C61-V64 PolarHBondContact O-N 3.47Å; E62-V64 PolarHBondContact O-N 3.04Å; V64-K68 WeakPolarHBondContact O-CB 3.32Å; V64-K68 PolarHBondContact O-N 3.49Å; V64-K68 VanDerWaalsContact O-N 3.14Å; V64-R207 HydrophobicContact CB-CG 4.24Å; V64-R207 HydrophobicContact CG2-CB 4.19Å; V64-R207 HydrophobicContact CG2-CG 4.14Å; V64-R207 WeakPolarHBondContact O-CD 3.33Å; V64-R207 PolarHBondContact O-NH1 3.1Å
65	C	96.6	Very high	94.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-75.2	-40.9	174.3	-68.1	0	0	0	0	111.7	F52 C61 E62 N63 K68 A69 C205 C210	F52-C65 HydrophobicContact CE1-CB 4.08Å; F52-C65 HydrophobicContact CZ-CB 4.2Å; C61-C65 WeakPolarHBondContact O-CB 3.46Å; C61-C65 PolarHBondContact O-N 3.36Å; C61-C65 PolarHBondContact O-SG 2.89Å; E62-C65 PolarHBondContact O-N 3.12Å; N63-C65 VanDerWaalsContact C-N 3.34Å; C65-K68 PolarHBondContact O-N 2.95Å; C65-A69 WeakPolarHBondContact O-CB 3.26Å; C65-A69 PolarHBondContact O-N 3.27Å; C65-C205 WeakPolarHBondContact CA-SG 3.44Å; C65-C205 HydrophobicContact CB-CB 3.7Å; C65-C205 WeakPolarHBondContact CB-SG 2.95Å; C65-C205 WeakPolarHBondContact SG-CB 3.18Å; C65-C205 CovalentContact SG-SG 2.02Å; C65-C205 PolarHBondContact SG-SG 3.43Å; C65-C210 PolarHBondContact SG-SG 3.22Å
66	Y	95.2	Very high	94.7	Very high	25 Å²	25	57.4 Å²	57.4	10%	0.098	30%	0.3	C	S	.	.	H	α-helix	trans	-57.5	-51.8	171.4	178.2	-98.5	0	0	0	111.2	E48 Q49 F52 E62 K68 A69 F70	E48-Y66 VanDerWaalsContact CG-OH 3.28Å; E48-Y66 WeakPolarHBondContact CG-OH 3.21Å; E48-Y66 WeakPolarHBondContact O-CE2 3.42Å; E48-Y66 PolarHBondContact OE1-OH 3.31Å; Q49-Y66 HydrophobicContact CB-CE1 4.29Å; Q49-Y66 HydrophobicContact CB-CE2 4.28Å; Q49-Y66 HydrophobicContact CG-CD1 4.16Å; Q49-Y66 HydrophobicContact CG-CE1 4.13Å; Q49-Y66 HydrophobicContact CG-CG 4.42Å; F52-Y66 HydrophobicContact CB-CD2 4.07Å; F52-Y66 HydrophobicContact CD1-CD2 4.05Å; F52-Y66 HydrophobicContact CD1-CG 4.38Å; F52-Y66 HydrophobicContact CD2-CD2 4.29Å; F52-Y66 AromaticContact CG-CD2 3.88Å; F52-Y66 HydrophobicContact CG-CD2 3.88Å; E62-Y66 WeakPolarHBondContact O-CB 3.37Å; E62-Y66 PolarHBondContact O-N 3Å; Y66-K68 PolarHBondContact O-N 3.28Å; Y66-A69 PolarHBondContact O-N 3.17Å; Y66-A69 VanDerWaalsContact O-N 3.13Å; Y66-F70 AromaticContact CD2-CD2 3.92Å; Y66-F70 HydrophobicContact CD2-CD2 3.92Å; Y66-F70 HydrophobicContact CE2-CB 4.37Å; Y66-F70 AromaticContact CE2-CD2 3.73Å; Y66-F70 HydrophobicContact CE2-CD2 3.73Å; Y66-F70 HydrophobicContact CE2-CG 4.43Å; Y66-F70 PolarHBondContact O-N 3.14Å
67	D	95	Very high	94.6	Very high	80 Å²	80	56.1 Å²	56.1	43%	0.428	29%	0.291	S	S	.	.	H	α-helix	trans	-58.4	-31.3	175.5	177.4	78.4	0	0	0	113	N63 P71 R207	N63-D67 WeakPolarHBondContact O-CB 3.47Å; N63-D67 PolarHBondContact O-N 2.89Å; N63-D67 VanDerWaalsContact O-N 3.08Å; D67-P71 WeakPolarHBondContact O-CA 3.4Å; D67-R207 IonicContact OD2-CZ 3.41Å; D67-R207 IonicContact OD2-NH1 2.77Å; D67-R207 PolarHBondContact OD2-NH1 2.92Å; D67-R207 IonicContact OD2-NH2 3.49Å; D67-R207 PolarHBondContact OD2-NH2 2.91Å
68	K	94.8	Very high	94.5	Very high	95 Å²	95	46.9 Å²	46.9	41%	0.413	25%	0.247	S	C	.	.	H	α-helix	trans	-80.4	-31.5	177.3	-158.5	-169.7	175.7	-173.9	0	113	V64 C65 Y66 Y203 R207	V64-K68 WeakPolarHBondContact O-CB 3.32Å; V64-K68 PolarHBondContact O-N 3.49Å; V64-K68 VanDerWaalsContact O-N 3.14Å; C65-K68 PolarHBondContact O-N 2.95Å; Y66-K68 PolarHBondContact O-N 3.28Å; K68-Y203 WeakPolarHBondContact CD-OH 3.5Å; K68-Y203 VanDerWaalsContact CG-OH 3.28Å; K68-Y203 WeakPolarHBondContact CG-OH 3.49Å; K68-Y203 PolarHBondContact O-OH 2.71Å; K68-R207 HydrophobicContact CD-CB 4.29Å
69	A	93.4	Very high	94.4	Very high	17 Å²	17	45.3 Å²	45.3	14%	0.14	24%	0.243	C	C	.	.	H	α-helix	trans	-80.4	-37.9	178.6	0	0	0	0	0	111.9	F52 C65 Y66 Y203	F52-A69 HydrophobicContact CE2-CB 4.46Å; C65-A69 WeakPolarHBondContact O-CB 3.26Å; C65-A69 PolarHBondContact O-N 3.27Å; Y66-A69 PolarHBondContact O-N 3.17Å; Y66-A69 VanDerWaalsContact O-N 3.13Å; A69-Y203 HydrophobicContact CB-CD1 4.08Å; A69-Y203 HydrophobicContact CB-CD2 3.91Å; A69-Y203 HydrophobicContact CB-CE1 4.01Å; A69-Y203 HydrophobicContact CB-CE2 3.83Å; A69-Y203 HydrophobicContact CB-CG 4.03Å
70	F	93.9	Very high	94.3	Very high	23 Å²	23	43.8 Å²	43.8	10%	0.101	23%	0.229	C	C	.	.			trans	-131.5	64.3	-174.4	-55.5	-67.7	0	0	0	111.8	F52 Y66 I72 L199 I218	F52-F70 HydrophobicContact CD2-CE2 4.21Å; F52-F70 HydrophobicContact CE2-CE2 4.23Å; Y66-F70 AromaticContact CD2-CD2 3.92Å; Y66-F70 HydrophobicContact CD2-CD2 3.92Å; Y66-F70 HydrophobicContact CE2-CB 4.37Å; Y66-F70 AromaticContact CE2-CD2 3.73Å; Y66-F70 HydrophobicContact CE2-CD2 3.73Å; Y66-F70 HydrophobicContact CE2-CG 4.43Å; Y66-F70 PolarHBondContact O-N 3.14Å; F70-I72 PolarHBondContact O-N 3.4Å; F70-L199 HydrophobicContact CE1-CD1 3.83Å; F70-L199 HydrophobicContact CE1-CD2 4.28Å; F70-L199 HydrophobicContact CZ-CD1 4Å; F70-L199 HydrophobicContact CZ-CD2 4.33Å; F70-I218 HydrophobicContact CE2-CG1 4.11Å; F70-I218 HydrophobicContact CZ-CG1 3.85Å; F70-I218 HydrophobicContact CZ-CG2 4.04Å
71	P	93.5	Very high	94.2	Very high	85 Å²	85	42.4 Å²	42.4	55%	0.552	21%	0.213	S	C	*	.	S	Bend	trans	-61.7	-18.1	-178.7	27	-36.6	0	0	0	113.5	D67	D67-P71 WeakPolarHBondContact O-CA 3.4Å
72	I	93.9	Very high	94	Very high	48 Å²	48	42.4 Å²	42.4	25%	0.246	21%	0.213	C	C	.	.	S	Bend	trans	-141.8	145.7	157.1	-179.5	172	0	0	0	106.1	F70 R76 L80 Y195	F70-I72 PolarHBondContact O-N 3.4Å; I72-R76 HydrophobicContact CD1-CB 3.94Å; I72-R76 HydrophobicContact CG1-CB 3.69Å; I72-L80 HydrophobicContact CD1-CD1 3.87Å; I72-Y195 WeakPolarHBondContact CG2-OH 3.31Å; I72-Y195 PolarHBondContact O-OH 2.89Å
73	S	91.9	Very high	93.8	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.014	22%	0.216	C	C	.	.			trans	-89.4	155.4	175.5	63	0	0	0	0	113.3	E48 I75 R76 F77	E48-S73 VanDerWaalsContact CD-CB 3.44Å; E48-S73 WeakPolarHBondContact OE1-CB 3.47Å; E48-S73 PolarHBondContact OE1-OG 2.96Å; E48-S73 WeakPolarHBondContact OE2-CB 3.22Å; E48-S73 PolarHBondContact OE2-OG 3.16Å; S73-I75 VanDerWaalsContact C-N 3.31Å; S73-I75 PolarHBondContact O-N 3.45Å; S73-R76 WeakPolarHBondContact O-CB 3.27Å; S73-R76 PolarHBondContact O-N 3.37Å; S73-R76 PolarHBondContact OG-NH1 3.14Å; S73-F77 PolarHBondContact O-N 3.01Å
74	H	91.5	Very high	93.7	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-54.9	-41.6	-169.6	-70.4	85.4	0	0	0	113.3	W45 F77 W78 Y195 I228	W45-H74 HydrophobicContact CZ2-CB 4.02Å; W45-H74 AromaticContact NE1-ND1 3.94Å; H74-F77 WeakPolarHBondContact O-CB 3.35Å; H74-F77 PolarHBondContact O-N 2.76Å; H74-W78 HydrophobicContact CB-CE3 4.47Å; H74-W78 HydrophobicContact CB-CH2 3.86Å; H74-W78 HydrophobicContact CB-CZ2 4Å; H74-W78 HydrophobicContact CB-CZ3 4.11Å; H74-W78 VanDerWaalsContact O-CD2 3.28Å; H74-W78 PolarHBondContact O-N 3.35Å; H74-Y195 AromaticContact CD2-CD2 3.86Å; H74-Y195 AromaticContact CD2-CE2 3.94Å; H74-Y195 AromaticContact CE1-CD1 3.51Å; H74-Y195 AromaticContact CE1-CE1 3.76Å; H74-Y195 AromaticContact CE1-CG 3.8Å; H74-Y195 AromaticContact NE2-CD1 3.46Å; H74-Y195 WeakPolarHBondContact NE2-CD1 3.33Å; H74-Y195 AromaticContact NE2-CD2 3.55Å; H74-Y195 AromaticContact NE2-CE1 3.89Å; H74-Y195 AromaticContact NE2-CE2 3.97Å; H74-Y195 AromaticContact NE2-CG 3.24Å; H74-I228 VanDerWaalsContact NE2-CD1 3.32Å; H74-I228 WeakPolarHBondContact NE2-CD1 3.33Å
75	I	91.8	Very high	93.5	Very high	28 Å²	28	40.8 Å²	40.8	14%	0.144	20%	0.201	C	C	.	.	H	α-helix	trans	-63.2	-45.5	176.7	-60.9	154.2	0	0	0	111.2	A41 W45 S73 F77 W78 V79	A41-I75 VanDerWaalsContact CA-CD1 3.49Å; A41-I75 HydrophobicContact CB-CD1 3.76Å; A41-I75 HydrophobicContact CB-CG1 4.21Å; A41-I75 HydrophobicContact CB-CG2 4.06Å; A41-I75 WeakPolarHBondContact O-CD1 3.42Å; W45-I75 HydrophobicContact CB-CD1 3.5Å; W45-I75 VanDerWaalsContact CB-CD1 3.5Å; W45-I75 HydrophobicContact CD2-CD1 3.81Å; W45-I75 HydrophobicContact CD2-CG1 4.04Å; W45-I75 HydrophobicContact CE3-CD1 3.71Å; W45-I75 HydrophobicContact CE3-CG1 3.85Å; W45-I75 HydrophobicContact CG-CD1 3.76Å; W45-I75 HydrophobicContact CG-CG1 4.38Å; W45-I75 HydrophobicContact CZ3-CG1 4.42Å; S73-I75 VanDerWaalsContact C-N 3.31Å; S73-I75 PolarHBondContact O-N 3.45Å; I75-F77 VanDerWaalsContact C-N 3.26Å; I75-F77 PolarHBondContact O-N 2.91Å; I75-W78 PolarHBondContact O-N 2.81Å; I75-V79 HydrophobicContact CG2-CG2 4.24Å; I75-V79 WeakPolarHBondContact O-CG2 3.33Å; I75-V79 PolarHBondContact O-N 3.33Å
76	R	92.8	Very high	93.2	Very high	149 Å²	149	41.1 Å²	41.1	56%	0.562	20%	0.203	S	C	*	.	H	α-helix	trans	-60.9	-39.7	178.3	-65.6	178.2	173.2	97.2	-5.8	110.3	E48 I72 S73 L80	E48-R76 IonicContact OE1-NH1 2.88Å; E48-R76 PolarHBondContact OE1-NH1 3.13Å; I72-R76 HydrophobicContact CD1-CB 3.94Å; I72-R76 HydrophobicContact CG1-CB 3.69Å; S73-R76 WeakPolarHBondContact O-CB 3.27Å; S73-R76 PolarHBondContact O-N 3.37Å; S73-R76 PolarHBondContact OG-NH1 3.14Å; R76-L80 WeakPolarHBondContact O-CG 3.36Å; R76-L80 PolarHBondContact O-N 2.92Å; R76-L80 VanDerWaalsContact O-N 3.11Å
77	F	94.3	Very high	93	Very high	16 Å²	16	42.5 Å²	42.5	7%	0.07	22%	0.215	C	C	.	.	H	α-helix	trans	-62.5	-45.4	173.6	-172.9	-90.7	0	0	0	112.7	S73 H74 I75 L80 Q81 F187 Q191 L194 Y195	S73-F77 PolarHBondContact O-N 3.01Å; H74-F77 WeakPolarHBondContact O-CB 3.35Å; H74-F77 PolarHBondContact O-N 2.76Å; I75-F77 VanDerWaalsContact C-N 3.26Å; I75-F77 PolarHBondContact O-N 2.91Å; F77-L80 PolarHBondContact O-N 3.1Å; F77-Q81 PolarHBondContact O-N 2.97Å; F77-F187 HydrophobicContact CD1-CD1 4.25Å; F77-F187 HydrophobicContact CE1-CB 4.3Å; F77-F187 AromaticContact CE1-CD1 3.69Å; F77-F187 HydrophobicContact CE1-CD1 3.69Å; F77-F187 WeakPolarHBondContact CE1-O 3.38Å; F77-F187 HydrophobicContact CE2-CD1 4.03Å; F77-F187 HydrophobicContact CE2-CE1 4.36Å; F77-F187 HydrophobicContact CZ-CB 4.34Å; F77-F187 AromaticContact CZ-CD1 3.57Å; F77-F187 HydrophobicContact CZ-CD1 3.57Å; F77-F187 HydrophobicContact CZ-CE1 4.34Å; F77-F187 HydrophobicContact CZ-CG 4.39Å; F77-F187 VanDerWaalsContact CZ-O 3.31Å; F77-F187 WeakPolarHBondContact CZ-O 3.42Å; F77-Q191 HydrophobicContact CE1-CB 3.73Å; F77-Q191 HydrophobicContact CE1-CG 4.26Å; F77-Q191 HydrophobicContact CZ-CB 4.07Å; F77-L194 HydrophobicContact CD2-CD1 4.06Å; F77-L194 HydrophobicContact CE2-CD1 3.74Å; F77-Y195 HydrophobicContact CD2-CE2 4.48Å; F77-Y195 HydrophobicContact CG-CE2 4.33Å
78	W	93.8	Very high	92.8	Very high	5 Å²	5	39.1 Å²	39.1	2%	0.019	20%	0.197	C	C	.	.	H	α-helix	trans	-71.2	-33.3	177.7	-61.3	-36.9	0	0	0	114	L37 W45 H74 I75 L80 Q81 I82 F227 I228 M231	L37-W78 HydrophobicContact CD1-CB 3.93Å; L37-W78 HydrophobicContact CD1-CE3 4.12Å; L37-W78 HydrophobicContact CD2-CB 4.21Å; W45-W78 AromaticContact CH2-CH2 3.48Å; W45-W78 HydrophobicContact CH2-CH2 3.48Å; W45-W78 VanDerWaalsContact CH2-CH2 3.48Å; W45-W78 AromaticContact CH2-CZ3 3.42Å; W45-W78 HydrophobicContact CH2-CZ3 3.42Å; W45-W78 VanDerWaalsContact CH2-CZ3 3.42Å; W45-W78 AromaticContact CZ2-CH2 3.69Å; W45-W78 HydrophobicContact CZ2-CH2 3.69Å; W45-W78 AromaticContact CZ2-CZ3 3.88Å; W45-W78 HydrophobicContact CZ2-CZ3 3.88Å; W45-W78 HydrophobicContact CZ3-CH2 4.43Å; W45-W78 AromaticContact CZ3-CZ3 3.94Å; W45-W78 HydrophobicContact CZ3-CZ3 3.94Å; H74-W78 HydrophobicContact CB-CE3 4.47Å; H74-W78 HydrophobicContact CB-CH2 3.86Å; H74-W78 HydrophobicContact CB-CZ2 4Å; H74-W78 HydrophobicContact CB-CZ3 4.11Å; H74-W78 VanDerWaalsContact O-CD2 3.28Å; H74-W78 PolarHBondContact O-N 3.35Å; I75-W78 PolarHBondContact O-N 2.81Å; W78-L80 VanDerWaalsContact C-N 3.32Å; W78-Q81 WeakPolarHBondContact O-CB 3.31Å; W78-Q81 PolarHBondContact O-N 3.36Å; W78-I82 WeakPolarHBondContact O-CB 3.33Å; W78-I82 VanDerWaalsContact O-CG1 3.28Å; W78-I82 WeakPolarHBondContact O-CG1 3.46Å; W78-I82 PolarHBondContact O-N 3.42Å; W78-F227 HydrophobicContact CH2-CB 4.46Å; W78-I228 HydrophobicContact CH2-CG1 4.01Å; W78-I228 HydrophobicContact CZ2-CB 4.43Å; W78-I228 HydrophobicContact CZ2-CG1 3.83Å; W78-M231 HydrophobicContact CB-CE 4.01Å; W78-M231 HydrophobicContact CD2-CB 4.47Å; W78-M231 HydrophobicContact CD2-CE 4.02Å; W78-M231 HydrophobicContact CD2-CG 4.15Å; W78-M231 HydrophobicContact CE3-CE 4.43Å; W78-M231 HydrophobicContact CE3-CG 4.3Å; W78-M231 HydrophobicContact CG-CE 3.81Å; W78-M231 HydrophobicContact CH2-CG 4.26Å; W78-M231 HydrophobicContact CZ2-CB 4.07Å; W78-M231 HydrophobicContact CZ2-CG 4.11Å; W78-M231 HydrophobicContact CZ3-CG 4.35Å
79	V	93.2	Very high	92.4	Very high	40 Å²	40	36.2 Å²	36.2	24%	0.242	19%	0.187	C	C	.	.	H	α-helix	trans	-60.2	-45.8	171	168.1	0	0	0	0	109.8	L37 I75 I82 I83	L37-V79 HydrophobicContact CD2-CG2 3.58Å; I75-V79 HydrophobicContact CG2-CG2 4.24Å; I75-V79 WeakPolarHBondContact O-CG2 3.33Å; I75-V79 PolarHBondContact O-N 3.33Å; V79-I82 PolarHBondContact O-N 2.93Å; V79-I83 HydrophobicContact CG1-CD1 3.82Å; V79-I83 VanDerWaalsContact O-CG1 3.29Å; V79-I83 WeakPolarHBondContact O-CG1 3.43Å; V79-I83 PolarHBondContact O-N 3.01Å
80	L	94.2	Very high	92	Very high	71 Å²	71	37.9 Å²	37.9	37%	0.372	19%	0.193	S	C	.	.	H	α-helix	trans	-61.3	-45.7	173.7	-68.5	171.4	0	0	0	111.5	I72 R76 F77 W78 I82 I83 F84 F187	I72-L80 HydrophobicContact CD1-CD1 3.87Å; R76-L80 WeakPolarHBondContact O-CG 3.36Å; R76-L80 PolarHBondContact O-N 2.92Å; R76-L80 VanDerWaalsContact O-N 3.11Å; F77-L80 PolarHBondContact O-N 3.1Å; W78-L80 VanDerWaalsContact C-N 3.32Å; L80-I82 VanDerWaalsContact C-N 3.33Å; L80-I82 PolarHBondContact O-N 3.2Å; L80-I83 PolarHBondContact O-N 3.12Å; L80-F84 HydrophobicContact CD2-CE2 4.48Å; L80-F84 WeakPolarHBondContact O-CD2 3.28Å; L80-F84 PolarHBondContact O-N 3.42Å; L80-F187 HydrophobicContact CB-CE1 3.93Å; L80-F187 HydrophobicContact CB-CZ 4.05Å
81	Q	94.6	Very high	91.8	Very high	3 Å²	3	42.3 Å²	42.3	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-54.8	-47.8	175.3	-176.2	179.8	4.2	0	0	111.8	F77 W78 I83 F84 V85 E184 F187	F77-Q81 PolarHBondContact O-N 2.97Å; W78-Q81 WeakPolarHBondContact O-CB 3.31Å; W78-Q81 PolarHBondContact O-N 3.36Å; Q81-I83 PolarHBondContact O-N 3.49Å; Q81-F84 PolarHBondContact O-N 2.98Å; Q81-V85 HydrophobicContact CG-CG2 4.17Å; Q81-V85 WeakPolarHBondContact O-CB 3.41Å; Q81-V85 WeakPolarHBondContact O-CG2 3.32Å; Q81-V85 PolarHBondContact O-N 2.81Å; Q81-E184 PolarHBondContact NE2-OE1 3.42Å; Q81-F187 HydrophobicContact CB-CB 4.08Å; Q81-F187 HydrophobicContact CB-CD1 3.56Å; Q81-F187 HydrophobicContact CB-CD2 4.17Å; Q81-F187 HydrophobicContact CB-CE1 4.02Å; Q81-F187 HydrophobicContact CB-CG 3.66Å; Q81-F187 HydrophobicContact CG-CB 3.64Å; Q81-F187 HydrophobicContact CG-CD1 4.11Å; Q81-F187 HydrophobicContact CG-CD2 4.12Å; Q81-F187 HydrophobicContact CG-CG 3.69Å
82	I	91.6	Very high	91.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.2	-41.4	179.4	-73.4	165.3	0	0	0	111.1	F30 R33 I34 L37 W78 V79 L80 S86	F30-I82 HydrophobicContact CE2-CB 4.5Å; F30-I82 HydrophobicContact CE2-CG2 3.72Å; F30-I82 HydrophobicContact CZ-CG2 3.63Å; R33-I82 HydrophobicContact CB-CD1 4.04Å; R33-I82 HydrophobicContact CB-CG1 4.42Å; I34-I82 HydrophobicContact CD1-CG2 4.37Å; I34-I82 HydrophobicContact CG1-CD1 4.38Å; I34-I82 HydrophobicContact CG1-CG2 4.26Å; L37-I82 HydrophobicContact CD1-CD1 4.09Å; L37-I82 HydrophobicContact CD2-CD1 3.7Å; L37-I82 HydrophobicContact CG-CD1 4.47Å; W78-I82 WeakPolarHBondContact O-CB 3.33Å; W78-I82 VanDerWaalsContact O-CG1 3.28Å; W78-I82 WeakPolarHBondContact O-CG1 3.46Å; W78-I82 PolarHBondContact O-N 3.42Å; V79-I82 PolarHBondContact O-N 2.93Å; L80-I82 VanDerWaalsContact C-N 3.33Å; L80-I82 PolarHBondContact O-N 3.2Å; I82-S86 VanDerWaalsContact O-CB 3.25Å; I82-S86 WeakPolarHBondContact O-CB 3.5Å; I82-S86 PolarHBondContact O-N 2.92Å; I82-S86 PolarHBondContact O-OG 3.44Å
83	I	91.8	Very high	90.9	Very high	76 Å²	76	37.3 Å²	37.3	39%	0.39	19%	0.185	S	C	.	.	H	α-helix	trans	-65.3	-51.6	176.2	-68.2	164.8	0	0	0	110.9	V79 L80 Q81 V85 S86 T87	V79-I83 HydrophobicContact CG1-CD1 3.82Å; V79-I83 VanDerWaalsContact O-CG1 3.29Å; V79-I83 WeakPolarHBondContact O-CG1 3.43Å; V79-I83 PolarHBondContact O-N 3.01Å; L80-I83 PolarHBondContact O-N 3.12Å; Q81-I83 PolarHBondContact O-N 3.49Å; I83-V85 PolarHBondContact O-N 3.39Å; I83-S86 PolarHBondContact O-N 3.36Å; I83-S86 PolarHBondContact O-OG 3.12Å; I83-S86 VanDerWaalsContact O-OG 3.09Å; I83-T87 WeakPolarHBondContact O-CB 3.36Å; I83-T87 PolarHBondContact O-N 3.03Å; I83-T87 PolarHBondContact O-OG1 3.43Å
84	F	94.3	Very high	90.6	Very high	90 Å²	90	39.1 Å²	39.1	40%	0.395	20%	0.204	S	C	.	.	H	α-helix	trans	-67.5	-35.5	-178.6	-83.2	-79.8	0	0	0	113	L80 Q81 P88 F183 F187	L80-F84 HydrophobicContact CD2-CE2 4.48Å; L80-F84 WeakPolarHBondContact O-CD2 3.28Å; L80-F84 PolarHBondContact O-N 3.42Å; Q81-F84 PolarHBondContact O-N 2.98Å; F84-P88 WeakPolarHBondContact O-CD 3.44Å; F84-F183 HydrophobicContact CB-CB 4.4Å; F84-F183 HydrophobicContact CB-CD1 4.4Å; F84-F183 HydrophobicContact CB-CD2 4.38Å; F84-F183 HydrophobicContact CB-CG 4.17Å; F84-F183 HydrophobicContact CD1-CD1 4.25Å; F84-F183 AromaticContact CD1-CE1 3.94Å; F84-F183 HydrophobicContact CD1-CE1 3.94Å; F84-F183 HydrophobicContact CD1-CE2 4.43Å; F84-F183 HydrophobicContact CD1-CZ 4.05Å; F84-F183 WeakPolarHBondContact O-CD2 3.48Å; F84-F187 HydrophobicContact CB-CE2 3.63Å; F84-F187 HydrophobicContact CB-CZ 4.21Å; F84-F187 AromaticContact CD2-CE2 3.94Å; F84-F187 HydrophobicContact CD2-CE2 3.94Å; F84-F187 AromaticContact CD2-CZ 3.69Å; F84-F187 HydrophobicContact CD2-CZ 3.69Å; F84-F187 HydrophobicContact CE2-CZ 4.44Å; F84-F187 AromaticContact CG-CE2 3.97Å; F84-F187 HydrophobicContact CG-CE2 3.97Å; F84-F187 HydrophobicContact CG-CZ 4.21Å
85	V	91.9	Very high	90.4	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.012	22%	0.217	C	C	.	.	H	α-helix	trans	-74.8	-29.2	177.1	171.7	0	0	0	0	112.1	Q81 I83 K180 F183 E184	Q81-V85 HydrophobicContact CG-CG2 4.17Å; Q81-V85 WeakPolarHBondContact O-CB 3.41Å; Q81-V85 WeakPolarHBondContact O-CG2 3.32Å; Q81-V85 PolarHBondContact O-N 2.81Å; I83-V85 PolarHBondContact O-N 3.39Å; V85-K180 HydrophobicContact CG1-CD 4.34Å; V85-K180 HydrophobicContact CG1-CG 3.87Å; V85-F183 HydrophobicContact CG2-CB 4.23Å; V85-E184 HydrophobicContact CG2-CB 4.34Å
86	S	89.1	Confident	90	Very high	7 Å²	7	41.3 Å²	41.3	5%	0.049	22%	0.215	C	C	.	.	H	α-helix	trans	-83	-31.6	174.7	59.4	0	0	0	0	114	I82 I83 T89 L90	I82-S86 VanDerWaalsContact O-CB 3.25Å; I82-S86 WeakPolarHBondContact O-CB 3.5Å; I82-S86 PolarHBondContact O-N 2.92Å; I82-S86 PolarHBondContact O-OG 3.44Å; I83-S86 PolarHBondContact O-N 3.36Å; I83-S86 PolarHBondContact O-OG 3.12Å; I83-S86 VanDerWaalsContact O-OG 3.09Å; S86-T89 WeakPolarHBondContact O-CA 3.33Å; S86-T89 VanDerWaalsContact O-CB 3.22Å; S86-T89 WeakPolarHBondContact O-CB 3.16Å; S86-T89 PolarHBondContact O-N 3.46Å; S86-L90 PolarHBondContact O-N 3.15Å
87	T	90.9	Very high	89.5	Confident	55 Å²	55	37.9 Å²	37.9	34%	0.337	21%	0.207	S	C	.	.	H	α-helix	trans	-53.1	-48.4	-176.2	-67.8	0	0	0	0	114.1	I83 T89 L90 I91	I83-T87 WeakPolarHBondContact O-CB 3.36Å; I83-T87 PolarHBondContact O-N 3.03Å; I83-T87 PolarHBondContact O-OG1 3.43Å; T87-T89 PolarHBondContact O-N 3.14Å; T87-L90 PolarHBondContact O-N 3.47Å; T87-I91 HydrophobicContact CG2-CD1 3.82Å; T87-I91 HydrophobicContact CG2-CG1 4.47Å; T87-I91 WeakPolarHBondContact O-CG1 3.2Å; T87-I91 PolarHBondContact O-N 2.91Å
88	P	91.5	Very high	89	Confident	9 Å²	9	42.7 Å²	42.7	6%	0.058	23%	0.23	C	C	.	.	H	α-helix	trans	-57.3	-31.4	173.9	-26.7	34.6	0	0	0	113.4	F84 Y92 N176 F179 F183	F84-P88 WeakPolarHBondContact O-CD 3.44Å; P88-Y92 PolarHBondContact O-N 3.46Å; P88-Y92 VanDerWaalsContact O-N 3.14Å; P88-N176 PolarHBondContact O-ND2 3.34Å; P88-F179 HydrophobicContact CB-CB 4.18Å; P88-F179 HydrophobicContact CG-CB 3.87Å; P88-F183 HydrophobicContact CG-CD2 3.9Å; P88-F183 HydrophobicContact CG-CE2 3.82Å
89	T	86	Confident	88.6	Confident	34 Å²	34	44.2 Å²	44.2	21%	0.209	24%	0.238	C	C	.	.	H	α-helix	trans	-71.3	-51.8	178.5	-51.7	0	0	0	0	109.3	S86 T87 I91 Y92 L93 N176	S86-T89 WeakPolarHBondContact O-CA 3.33Å; S86-T89 VanDerWaalsContact O-CB 3.22Å; S86-T89 WeakPolarHBondContact O-CB 3.16Å; S86-T89 PolarHBondContact O-N 3.46Å; T87-T89 PolarHBondContact O-N 3.14Å; T89-I91 PolarHBondContact O-N 3.03Å; T89-Y92 WeakPolarHBondContact O-CB 3.4Å; T89-Y92 PolarHBondContact O-N 3.04Å; T89-L93 HydrophobicContact CG2-CD1 4.44Å; T89-L93 WeakPolarHBondContact O-CG 3.12Å; T89-L93 PolarHBondContact O-N 3.43Å; T89-N176 VanDerWaalsContact CA-ND2 3.26Å; T89-N176 WeakPolarHBondContact CA-ND2 3.46Å; T89-N176 PolarHBondContact N-ND2 3.46Å
90	L	85.8	Confident	88.1	Confident	51 Å²	51	45.1 Å²	45.1	27%	0.267	24%	0.243	S	C	.	.	H	α-helix	trans	-55.7	-38.7	176.1	-60.7	178	0	0	0	112.5	L7 L10 S86 T87 L93 G94	L7-L90 HydrophobicContact CD1-CD1 4.06Å; L10-L90 HydrophobicContact CB-CD2 3.87Å; L10-L90 HydrophobicContact CD1-CD2 4.26Å; S86-L90 PolarHBondContact O-N 3.15Å; T87-L90 PolarHBondContact O-N 3.47Å; L90-L93 PolarHBondContact O-N 3.14Å; L90-G94 PolarHBondContact O-N 2.89Å
91	I	89.9	Confident	87.7	Confident	117 Å²	117	48.8 Å²	48.8	60%	0.6	25%	0.252	S	S	*	.	H	α-helix	trans	-63.5	-45.4	174.8	-67.9	166.7	0	0	0	111.7	T87 T89 L93 G94 H95	T87-I91 HydrophobicContact CG2-CD1 3.82Å; T87-I91 HydrophobicContact CG2-CG1 4.47Å; T87-I91 WeakPolarHBondContact O-CG1 3.2Å; T87-I91 PolarHBondContact O-N 2.91Å; T89-I91 PolarHBondContact O-N 3.03Å; I91-L93 VanDerWaalsContact C-N 3.32Å; I91-L93 PolarHBondContact O-N 3.45Å; I91-G94 PolarHBondContact O-N 3.18Å; I91-H95 PolarHBondContact O-N 2.91Å
92	Y	86.3	Confident	87.2	Confident	10 Å²	10	53.8 Å²	53.8	4%	0.039	28%	0.277	C	S	.	.	H	α-helix	trans	-60.8	-41.2	176.3	169.3	-114.5	0	0	0	111.9	P88 T89 H95 V96 Y173	P88-Y92 PolarHBondContact O-N 3.46Å; P88-Y92 VanDerWaalsContact O-N 3.14Å; T89-Y92 WeakPolarHBondContact O-CB 3.4Å; T89-Y92 PolarHBondContact O-N 3.04Å; Y92-H95 WeakPolarHBondContact O-CB 2.97Å; Y92-H95 PolarHBondContact O-N 3.03Å; Y92-V96 HydrophobicContact CD2-CG2 4.22Å; Y92-V96 HydrophobicContact CE1-CG2 4.34Å; Y92-V96 HydrophobicContact CE2-CG2 3.76Å; Y92-V96 WeakPolarHBondContact O-CG2 3.31Å; Y92-V96 PolarHBondContact O-N 3.18Å; Y92-Y173 HydrophobicContact CE1-CD2 4.11Å; Y92-Y173 HydrophobicContact CE2-CD2 4.33Å; Y92-Y173 HydrophobicContact CE2-CG 4.43Å; Y92-Y173 AromaticContact CZ-CD2 3.95Å
93	L	82.4	Confident	87	Confident	18 Å²	18	55 Å²	55	9%	0.094	28%	0.283	C	S	.	.	H	α-helix	trans	-68.1	-43	176.8	-57.1	177.1	0	0	0	112.5	L10 A14 T89 L90 I91 H95 V96 L97	L10-L93 WeakPolarHBondContact O-CD1 3.33Å; A14-L93 VanDerWaalsContact CA-CD2 3.47Å; A14-L93 HydrophobicContact CB-CD1 3.26Å; A14-L93 HydrophobicContact CB-CD2 3.74Å; A14-L93 HydrophobicContact CB-CG 4.01Å; T89-L93 HydrophobicContact CG2-CD1 4.44Å; T89-L93 WeakPolarHBondContact O-CG 3.12Å; T89-L93 PolarHBondContact O-N 3.43Å; L90-L93 PolarHBondContact O-N 3.14Å; I91-L93 VanDerWaalsContact C-N 3.32Å; I91-L93 PolarHBondContact O-N 3.45Å; L93-H95 PolarHBondContact O-N 2.98Å; L93-V96 PolarHBondContact O-N 3.23Å; L93-V96 VanDerWaalsContact O-N 3.16Å; L93-L97 WeakPolarHBondContact O-CB 3.22Å; L93-L97 VanDerWaalsContact O-CG 3.31Å; L93-L97 WeakPolarHBondContact O-CG 3.26Å; L93-L97 PolarHBondContact O-N 3Å
94	G	85.4	Confident	86.7	Confident	40 Å²	40	55.6 Å²	55.6	41%	0.412	28%	0.283	S	S	.	.	H	α-helix	trans	-55.3	-42.2	173.1	0	0	0	0	0	111.5	L90 I91 H98	L90-G94 PolarHBondContact O-N 2.89Å; I91-G94 PolarHBondContact O-N 3.18Å; G94-H98 WeakPolarHBondContact O-CB 3.35Å; G94-H98 PolarHBondContact O-N 3.22Å
95	H	86.1	Confident	86.6	Confident	58 Å²	58	57 Å²	57	27%	0.269	29%	0.29	S	S	.	.	H	α-helix	trans	-65.4	-44	174.8	-179.9	-113.1	0	0	0	113.1	I91 Y92 L93 I99 T172	I91-H95 PolarHBondContact O-N 2.91Å; Y92-H95 WeakPolarHBondContact O-CB 2.97Å; Y92-H95 PolarHBondContact O-N 3.03Å; L93-H95 PolarHBondContact O-N 2.98Å; H95-I99 WeakPolarHBondContact CE1-CD1 3.48Å; H95-I99 WeakPolarHBondContact O-CG1 3.25Å; H95-I99 PolarHBondContact O-N 3.24Å; H95-T172 VanDerWaalsContact CE1-CG2 3.42Å; H95-T172 WeakPolarHBondContact CE1-CG2 3.47Å; H95-T172 PolarHBondContact CE1-OG1 3.38Å; H95-T172 PolarHBondContact ND1-OG1 2.8Å; H95-T172 VanDerWaalsContact ND1-OG1 3.12Å
96	V	83.9	Confident	86.4	Confident	16 Å²	16	62.2 Å²	62.2	10%	0.097	31%	0.309	C	S	.	.	H	α-helix	trans	-63.4	-52.4	176.2	170.7	0	0	0	0	111.4	Y92 L93 H98 I99 V100 L169	Y92-V96 HydrophobicContact CD2-CG2 4.22Å; Y92-V96 HydrophobicContact CE1-CG2 4.34Å; Y92-V96 HydrophobicContact CE2-CG2 3.76Å; Y92-V96 WeakPolarHBondContact O-CG2 3.31Å; Y92-V96 PolarHBondContact O-N 3.18Å; L93-V96 PolarHBondContact O-N 3.23Å; L93-V96 VanDerWaalsContact O-N 3.16Å; V96-H98 VanDerWaalsContact C-N 3.28Å; V96-H98 PolarHBondContact O-N 3.38Å; V96-I99 PolarHBondContact O-N 2.8Å; V96-I99 VanDerWaalsContact O-N 3.1Å; V96-V100 HydrophobicContact CG1-CG2 4.5Å; V96-V100 WeakPolarHBondContact O-CG2 3.36Å; V96-V100 PolarHBondContact O-N 3.27Å; V96-L169 HydrophobicContact CG2-CD2 3.99Å
97	L	82.5	Confident	86.4	Confident	78 Å²	78	65.7 Å²	65.7	41%	0.408	32%	0.323	S	S	.	.	H	α-helix	trans	-61.6	-35.5	179.2	-70.1	165.9	0	0	0	112.1	L93 R101	L93-L97 WeakPolarHBondContact O-CB 3.22Å; L93-L97 VanDerWaalsContact O-CG 3.31Å; L93-L97 WeakPolarHBondContact O-CG 3.26Å; L93-L97 PolarHBondContact O-N 3Å; L97-R101 WeakPolarHBondContact O-CG 3.49Å; L97-R101 PolarHBondContact O-N 3.38Å; L97-R101 VanDerWaalsContact O-N 3.12Å
98	H	84.1	Confident	86.4	Confident	116 Å²	116	68.5 Å²	68.5	54%	0.537	33%	0.333	S	S	.	.	H	α-helix	trans	-66.2	-44.5	172.5	177.3	-94.6	0	0	0	111.7	G94 V96 M102	G94-H98 WeakPolarHBondContact O-CB 3.35Å; G94-H98 PolarHBondContact O-N 3.22Å; V96-H98 VanDerWaalsContact C-N 3.28Å; V96-H98 PolarHBondContact O-N 3.38Å; H98-M102 WeakPolarHBondContact O-CB 3.25Å; H98-M102 WeakPolarHBondContact O-CG 3.3Å; H98-M102 PolarHBondContact O-N 3.34Å
99	I	84.8	Confident	86.3	Confident	37 Å²	37	74.7 Å²	74.7	19%	0.19	36%	0.358	C	S	.	.	H	α-helix	trans	-61.2	-47.5	175.6	-75.5	169.4	0	0	0	111.1	H95 V96 R101 M102 E103 L169	H95-I99 WeakPolarHBondContact CE1-CD1 3.48Å; H95-I99 WeakPolarHBondContact O-CG1 3.25Å; H95-I99 PolarHBondContact O-N 3.24Å; V96-I99 PolarHBondContact O-N 2.8Å; V96-I99 VanDerWaalsContact O-N 3.1Å; I99-R101 PolarHBondContact O-N 2.88Å; I99-M102 CarbonylContact O-C 3.57Å; I99-M102 PolarHBondContact O-N 3.49Å; I99-M102 VanDerWaalsContact O-N 3.15Å; I99-E103 HydrophobicContact CG2-CG 4.25Å; I99-E103 VanDerWaalsContact O-CG 3.28Å; I99-E103 WeakPolarHBondContact O-CG 3.35Å; I99-E103 PolarHBondContact O-N 3.44Å; I99-L169 HydrophobicContact CD1-CD2 3.68Å; I99-L169 HydrophobicContact CD1-CG 4.29Å
100	V	82.2	Confident	86.5	Confident	59 Å²	59	77.5 Å²	77.5	36%	0.358	37%	0.369	S	S	.	.	H	α-helix	trans	-58.1	-51.5	179.8	172.8	0	0	0	0	110.9	V96 M102 E103 E104	V96-V100 HydrophobicContact CG1-CG2 4.5Å; V96-V100 WeakPolarHBondContact O-CG2 3.36Å; V96-V100 PolarHBondContact O-N 3.27Å; V100-M102 VanDerWaalsContact C-N 3.27Å; V100-M102 PolarHBondContact O-N 3.01Å; V100-E103 WeakPolarHBondContact O-CB 3.32Å; V100-E103 PolarHBondContact O-N 3.25Å; V100-E104 WeakPolarHBondContact O-CG 3Å; V100-E104 PolarHBondContact O-N 2.81Å
101	R	86.1	Confident	86.7	Confident	149 Å²	149	80.1 Å²	80.1	56%	0.562	38%	0.38	S	S	*	.	H	α-helix	trans	-61.3	-32.1	176.6	-74.3	-174.6	175.5	113.9	-4.3	113.8	L97 I99 E104 K105	L97-R101 WeakPolarHBondContact O-CG 3.49Å; L97-R101 PolarHBondContact O-N 3.38Å; L97-R101 VanDerWaalsContact O-N 3.12Å; I99-R101 PolarHBondContact O-N 2.88Å; R101-E104 WeakPolarHBondContact CA-OE2 3.46Å; R101-K105 WeakPolarHBondContact O-CB 3.29Å; R101-K105 VanDerWaalsContact O-CG 3.3Å; R101-K105 WeakPolarHBondContact O-CG 3.41Å; R101-K105 PolarHBondContact O-N 3.34Å; R101-K105 VanDerWaalsContact O-N 3.13Å
102	M	85.3	Confident	86.6	Confident	107 Å²	107	79.6 Å²	79.6	53%	0.527	38%	0.375	S	S	.	.	H	α-helix	trans	-77.1	-25.1	175.7	-73.3	-64.7	-68.5	0	0	112.9	H98 I99 V100 R106	H98-M102 WeakPolarHBondContact O-CB 3.25Å; H98-M102 WeakPolarHBondContact O-CG 3.3Å; H98-M102 PolarHBondContact O-N 3.34Å; I99-M102 CarbonylContact O-C 3.57Å; I99-M102 PolarHBondContact O-N 3.49Å; I99-M102 VanDerWaalsContact O-N 3.15Å; V100-M102 VanDerWaalsContact C-N 3.27Å; V100-M102 PolarHBondContact O-N 3.01Å; M102-R106 WeakPolarHBondContact O-CB 3.44Å; M102-R106 PolarHBondContact O-N 2.94Å
103	E	85.7	Confident	86.7	Confident	27 Å²	27	85 Å²	85	13%	0.126	40%	0.404	C	S	.	.	H	α-helix	trans	-77.2	-38.9	170.8	-65.8	-119.9	121.5	0	0	111.9	I99 V100 R106 K107	I99-E103 HydrophobicContact CG2-CG 4.25Å; I99-E103 VanDerWaalsContact O-CG 3.28Å; I99-E103 WeakPolarHBondContact O-CG 3.35Å; I99-E103 PolarHBondContact O-N 3.44Å; V100-E103 WeakPolarHBondContact O-CB 3.32Å; V100-E103 PolarHBondContact O-N 3.25Å; E103-R106 WeakPolarHBondContact O-CB 3.4Å; E103-R106 PolarHBondContact O-N 3.48Å; E103-R106 IonicContact OE1-CZ 3.55Å; E103-R106 IonicContact OE1-NH1 2.81Å; E103-R106 PolarHBondContact OE1-NH1 3.03Å; E103-R106 IonicContact OE1-NH2 3.18Å; E103-R106 PolarHBondContact OE1-NH2 3.32Å; E103-R106 IonicContact OE2-NH2 3.67Å; E103-K107 WeakPolarHBondContact O-CG 3.48Å; E103-K107 PolarHBondContact O-N 2.83Å
104	E	86.8	Confident	86.8	Confident	87 Å²	87	90 Å²	90	41%	0.407	43%	0.425	S	S	.	.	H	α-helix	trans	-59.1	-55.2	173.3	-71	164.4	163.4	0	0	110.8	V100 R101 R106 K107 E108	V100-E104 WeakPolarHBondContact O-CG 3Å; V100-E104 PolarHBondContact O-N 2.81Å; R101-E104 WeakPolarHBondContact CA-OE2 3.46Å; E104-R106 PolarHBondContact O-N 3.46Å; E104-K107 PolarHBondContact O-N 2.89Å; E104-E108 WeakPolarHBondContact O-CG 3.46Å; E104-E108 PolarHBondContact O-N 3.33Å
105	K	91.1	Very high	86.8	Confident	120 Å²	120	94.9 Å²	94.9	52%	0.522	44%	0.435	S	S	.	.	H	α-helix	trans	-61.1	-11.8	174.6	-70.1	177.4	179.1	-175.6	0	115.1	R101 E108 K109	R101-K105 WeakPolarHBondContact O-CB 3.29Å; R101-K105 VanDerWaalsContact O-CG 3.3Å; R101-K105 WeakPolarHBondContact O-CG 3.41Å; R101-K105 PolarHBondContact O-N 3.34Å; R101-K105 VanDerWaalsContact O-N 3.13Å; K105-E108 WeakPolarHBondContact CA-OE2 3.35Å; K105-K109 WeakPolarHBondContact O-CD 3.34Å; K105-K109 WeakPolarHBondContact O-CG 3.31Å
106	R	89.1	Confident	86.5	Confident	112 Å²	112	98.2 Å²	98.2	42%	0.423	45%	0.449	S	S	.	.	H	α-helix	trans	-87.7	-43.2	171.3	-168.6	178.9	71.7	-126.8	-0.7	111.2	M102 E103 E104 K109 E110	M102-R106 WeakPolarHBondContact O-CB 3.44Å; M102-R106 PolarHBondContact O-N 2.94Å; E103-R106 WeakPolarHBondContact O-CB 3.4Å; E103-R106 PolarHBondContact O-N 3.48Å; E103-R106 IonicContact OE1-CZ 3.55Å; E103-R106 IonicContact OE1-NH1 2.81Å; E103-R106 PolarHBondContact OE1-NH1 3.03Å; E103-R106 IonicContact OE1-NH2 3.18Å; E103-R106 PolarHBondContact OE1-NH2 3.32Å; E103-R106 IonicContact OE2-NH2 3.67Å; E104-R106 PolarHBondContact O-N 3.46Å; R106-K109 PolarHBondContact O-N 3.32Å; R106-E110 PolarHBondContact O-N 3.29Å
107	K	89.1	Confident	85.8	Confident	79 Å²	79	99 Å²	99	34%	0.343	46%	0.46	S	S	.	.	H	α-helix	trans	-61.6	-48.4	176.4	-64.2	160.3	-165.6	161.4	0	111.2	E103 E104 K109 E110 E111	E103-K107 WeakPolarHBondContact O-CG 3.48Å; E103-K107 PolarHBondContact O-N 2.83Å; E104-K107 PolarHBondContact O-N 2.89Å; K107-K109 VanDerWaalsContact C-N 3.26Å; K107-K109 PolarHBondContact O-N 2.84Å; K107-E110 WeakPolarHBondContact O-CB 3.23Å; K107-E110 PolarHBondContact O-N 3.14Å; K107-E111 WeakPolarHBondContact O-CG 3.3Å; K107-E111 PolarHBondContact O-N 2.91Å
108	E	90.8	Very high	84.7	Confident	115 Å²	115	99.6 Å²	99.6	54%	0.537	47%	0.471	S	S	.	.	H	α-helix	trans	-49.1	-47.2	176.4	-69.4	165.7	-178.2	0	0	112	E104 K105 E111 E112	E104-E108 WeakPolarHBondContact O-CG 3.46Å; E104-E108 PolarHBondContact O-N 3.33Å; K105-E108 WeakPolarHBondContact CA-OE2 3.35Å; E108-E111 PolarHBondContact O-N 3.33Å; E108-E112 PolarHBondContact O-N 3.44Å
109	K	89.2	Confident	83.6	Confident	138 Å²	138	100.1 Å²	100.1	60%	0.6	48%	0.476	S	S	*	.	H	α-helix	trans	-71.6	-34.6	179.7	-68.1	179.6	-178.2	-175.7	0	113.2	K105 R106 K107 L113	K105-K109 WeakPolarHBondContact O-CD 3.34Å; K105-K109 WeakPolarHBondContact O-CG 3.31Å; R106-K109 PolarHBondContact O-N 3.32Å; K107-K109 VanDerWaalsContact C-N 3.26Å; K107-K109 PolarHBondContact O-N 2.84Å; K109-L113 WeakPolarHBondContact O-CB 3.27Å; K109-L113 WeakPolarHBondContact O-CD1 3.21Å; K109-L113 VanDerWaalsContact O-CG 3.27Å; K109-L113 WeakPolarHBondContact O-CG 3.31Å; K109-L113 PolarHBondContact O-N 3.43Å
110	E	89.5	Confident	82.1	Confident	93 Å²	93	106.3 Å²	106.3	44%	0.435	50%	0.502	S	S	.	.	H	α-helix	trans	-68	-38.5	175.5	-160.4	-171.1	123.3	0	0	111.2	R106 K107 L113 K114	R106-E110 PolarHBondContact O-N 3.29Å; K107-E110 WeakPolarHBondContact O-CB 3.23Å; K107-E110 PolarHBondContact O-N 3.14Å; E110-L113 PolarHBondContact O-N 3.21Å; E110-K114 WeakPolarHBondContact O-CB 3.2Å; E110-K114 VanDerWaalsContact O-CG 3.32Å; E110-K114 WeakPolarHBondContact O-CG 3.43Å; E110-K114 PolarHBondContact O-N 3.42Å; E110-K114 WeakPolarHBondContact OE1-CE 3.31Å; E110-K114 IonicContact OE1-NZ 2.73Å; E110-K114 PolarHBondContact OE1-NZ 2.85Å
111	E	89.9	Confident	80.8	Confident	106 Å²	106	110.3 Å²	110.3	50%	0.495	52%	0.521	S	S	.	.	H	α-helix	trans	-69.5	-39.6	174.4	-70.9	176.1	-149	0	0	112.5	K107 E108 K114 K115	K107-E111 WeakPolarHBondContact O-CG 3.3Å; K107-E111 PolarHBondContact O-N 2.91Å; E108-E111 PolarHBondContact O-N 3.33Å; E111-K114 PolarHBondContact O-N 2.87Å; E111-K115 WeakPolarHBondContact O-CB 3.44Å; E111-K115 VanDerWaalsContact O-CG 3.32Å; E111-K115 WeakPolarHBondContact O-CG 3.36Å; E111-K115 PolarHBondContact O-N 2.91Å
112	E	88.3	Confident	79.4	Confident	106 Å²	106	108.2 Å²	108.2	50%	0.495	53%	0.529	S	S	.	.	H	α-helix	trans	-59.2	-45.1	169.1	-84.7	-155.7	-176.3	0	0	112.4	E108 K115 K116	E108-E112 PolarHBondContact O-N 3.44Å; E112-K115 PolarHBondContact O-N 2.94Å; E112-K116 WeakPolarHBondContact O-CB 3.47Å; E112-K116 VanDerWaalsContact O-CG 3.31Å; E112-K116 WeakPolarHBondContact O-CG 3.2Å; E112-K116 PolarHBondContact O-N 2.73Å; E112-K116 IonicContact OE2-NZ 2.64Å; E112-K116 PolarHBondContact OE2-NZ 3.09Å
113	L	87.6	Confident	77.7	Confident	125 Å²	125	107.3 Å²	107.3	65%	0.654	53%	0.533	S	S	*	.	H	α-helix	trans	-64.1	-41.1	179.6	-77.6	165.6	0	0	0	111.3	K109 E110 K116 G117	K109-L113 WeakPolarHBondContact O-CB 3.27Å; K109-L113 WeakPolarHBondContact O-CD1 3.21Å; K109-L113 VanDerWaalsContact O-CG 3.27Å; K109-L113 WeakPolarHBondContact O-CG 3.31Å; K109-L113 PolarHBondContact O-N 3.43Å; E110-L113 PolarHBondContact O-N 3.21Å; L113-K116 PolarHBondContact O-N 2.88Å; L113-G117 PolarHBondContact O-N 2.86Å
114	K	86.3	Confident	76	Confident	123 Å²	123	116.5 Å²	116.5	54%	0.535	57%	0.569	S	S	.	*	H	α-helix	trans	-60.5	-48.7	173.4	-76.4	164	171.9	170	0	111.7	E110 E111 K116 G117 S118	E110-K114 WeakPolarHBondContact O-CB 3.2Å; E110-K114 VanDerWaalsContact O-CG 3.32Å; E110-K114 WeakPolarHBondContact O-CG 3.43Å; E110-K114 PolarHBondContact O-N 3.42Å; E110-K114 WeakPolarHBondContact OE1-CE 3.31Å; E110-K114 IonicContact OE1-NZ 2.73Å; E110-K114 PolarHBondContact OE1-NZ 2.85Å; E111-K114 PolarHBondContact O-N 2.87Å; K114-K116 VanDerWaalsContact C-N 3.33Å; K114-K116 PolarHBondContact O-N 2.91Å; K114-G117 PolarHBondContact O-N 3.36Å; K114-G117 VanDerWaalsContact O-N 3.14Å; K114-S118 PolarHBondContact O-N 3.02Å; K114-S118 VanDerWaalsContact O-N 3.12Å; K114-S118 PolarHBondContact O-OG 3.48Å
115	K	84.9	Confident	74.1	Confident	141 Å²	141	118.2 Å²	118.2	61%	0.613	59%	0.587	S	S	*	*	H	α-helix	trans	-59.4	-40.4	176.1	-72.4	168.2	-177.7	169.8	0	112.5	E111 E112 I119	E111-K115 WeakPolarHBondContact O-CB 3.44Å; E111-K115 VanDerWaalsContact O-CG 3.32Å; E111-K115 WeakPolarHBondContact O-CG 3.36Å; E111-K115 PolarHBondContact O-N 2.91Å; E112-K115 PolarHBondContact O-N 2.94Å; K115-I119 WeakPolarHBondContact O-CG1 3.12Å
116	K	79.4	Confident	72.1	Confident	128 Å²	128	116.4 Å²	116.4	56%	0.557	60%	0.603	S	S	*	*	H	α-helix	trans	-72.2	-26	177.1	-72.3	163.8	-178.3	168	0	113.1	E112 L113 K114	E112-K116 WeakPolarHBondContact O-CB 3.47Å; E112-K116 VanDerWaalsContact O-CG 3.31Å; E112-K116 WeakPolarHBondContact O-CG 3.2Å; E112-K116 PolarHBondContact O-N 2.73Å; E112-K116 IonicContact OE2-NZ 2.64Å; E112-K116 PolarHBondContact OE2-NZ 3.09Å; L113-K116 PolarHBondContact O-N 2.88Å; K114-K116 VanDerWaalsContact C-N 3.33Å; K114-K116 PolarHBondContact O-N 2.91Å
117	G	68.4	Low	69.7	Low	33 Å²	33	116.3 Å²	116.3	34%	0.34	63%	0.626	S	S	.	*	H	α-helix	trans	-68.6	-58.1	172	0	0	0	0	0	112.4	L113 K114 I119 K120	L113-G117 PolarHBondContact O-N 2.86Å; K114-G117 PolarHBondContact O-N 3.36Å; K114-G117 VanDerWaalsContact O-N 3.14Å; G117-I119 PolarHBondContact O-N 2.87Å; G117-I119 VanDerWaalsContact O-N 3.07Å; G117-K120 WeakPolarHBondContact O-CB 3.46Å; G117-K120 PolarHBondContact O-N 3.04Å
118	S	60.5	Low	67.6	Low	90 Å²	90	117.5 Å²	117.5	63%	0.629	65%	0.651	S	S	*	*	H	α-helix	trans	-61.6	-21.4	-173.2	-55.8	0	0	0	0	115.2	K114 K120	K114-S118 PolarHBondContact O-N 3.02Å; K114-S118 VanDerWaalsContact O-N 3.12Å; K114-S118 PolarHBondContact O-OG 3.48Å; S118-K120 VanDerWaalsContact C-N 3.32Å
119	I	60.4	Low	65.2	Low	128 Å²	128	117.1 Å²	117.1	66%	0.656	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-29.5	173.3	-68.5	170	0	0	0	111.4	K115 G117	K115-I119 WeakPolarHBondContact O-CG1 3.12Å; G117-I119 PolarHBondContact O-N 2.87Å; G117-I119 VanDerWaalsContact O-N 3.07Å
120	K	54.2	Low	63	Low	166 Å²	166	116.8 Å²	116.8	72%	0.722	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-34.7	-171.9	-137.9	177.2	-175.9	-173.9	0	113.1	G117 S118 S122 S123	G117-K120 WeakPolarHBondContact O-CB 3.46Å; G117-K120 PolarHBondContact O-N 3.04Å; S118-K120 VanDerWaalsContact C-N 3.32Å; K120-S122 PolarHBondContact O-N 3.28Å; K120-S123 PolarHBondContact O-N 2.8Å
121	D	54.6	Low	60.3	Low	144 Å²	144	116 Å²	116	77%	0.77	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-15.3	178.6	-56.8	-33.3	0	0	0	112.9
122	S	55.6	Low	58	Low	104 Å²	104	117.2 Å²	117.2	73%	0.727	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-10.6	177.8	-159.7	0	0	0	0	113.5	K120 Y124	K120-S122 PolarHBondContact O-N 3.28Å; S122-Y124 PolarHBondContact O-N 2.7Å
123	S	50.6	Low	55.4	Low	88 Å²	88	115.7 Å²	115.7	62%	0.615	73%	0.732	S	S	*	*			trans	-98.9	41.4	-167.2	-170.2	0	0	0	0	114.9	K120	K120-S123 PolarHBondContact O-N 2.8Å
124	Y	49.9	Very low	53.1	Low	221 Å²	221	116.3 Å²	116.3	87%	0.867	75%	0.746	S	S	*	*			trans	-132.7	84.7	167.5	-88.8	-76.8	0	0	0	111.4	S122	S122-Y124 PolarHBondContact O-N 2.7Å
125	P	46.4	Very low	50.6	Low	123 Å²	123	114.3 Å²	114.3	80%	0.799	76%	0.761	S	S	*	*			trans	-68.4	130.3	169.1	29.1	-32.9	0	0	0	109.9
126	G	49.4	Very low	48.3	Very low	82 Å²	82	112.7 Å²	112.7	85%	0.845	77%	0.774	S	S	*	*			trans	-68.2	165.2	-160	0	0	0	0	0	117.9
127	A	38.5	Very low	46	Very low	110 Å²	110	110.7 Å²	110.7	91%	0.909	79%	0.789	S	S	*	*			trans	-130.7	138.8	156.7	0	0	0	0	0	108
128	A	44.4	Very low	44.3	Very low	104 Å²	104	112.6 Å²	112.6	86%	0.86	81%	0.809	S	S	*	*			trans	-128.8	132.5	-176.7	0	0	0	0	0	110.8
129	A	42.1	Very low	43.6	Very low	107 Å²	107	112 Å²	112	88%	0.884	82%	0.818	S	S	*	*			trans	-165.2	152.8	158.4	0	0	0	0	0	112.4
130	S	41.5	Very low	42.5	Very low	131 Å²	131	113.4 Å²	113.4	92%	0.916	83%	0.826	S	S	*	*			trans	-52.8	150.9	173.8	-175.7	0	0	0	0	115.2
131	G	34	Very low	42.2	Very low	75 Å²	75	112.3 Å²	112.3	77%	0.773	83%	0.828	S	S	*	*			trans	-176.9	110.4	166	0	0	0	0	0	113.2
132	S	40.9	Very low	41.7	Very low	133 Å²	133	112.4 Å²	112.4	93%	0.93	83%	0.827	S	S	*	*			trans	-89.8	139.1	166.8	-176.7	0	0	0	0	109.7
133	G	33.3	Very low	41	Very low	74 Å²	74	116.1 Å²	116.1	76%	0.763	83%	0.83	S	S	*	*			trans	179.5	112.1	178	0	0	0	0	0	114.2
134	S	40.7	Very low	40.2	Very low	137 Å²	137	118.3 Å²	118.3	96%	0.958	84%	0.835	S	S	*	*			trans	-76.2	134.7	168.5	-54.2	0	0	0	0	110.4
135	G	32.5	Very low	39.9	Very low	82 Å²	82	113.1 Å²	113.1	85%	0.845	83%	0.828	S	S	*	*			trans	-164.1	139.9	175.3	0	0	0	0	0	112.2
136	A	36.7	Very low	39.6	Very low	107 Å²	107	114.7 Å²	114.7	88%	0.884	83%	0.829	S	S	*	*			trans	-129.1	153.1	-178.5	0	0	0	0	0	111.4
137	G	31.7	Very low	39	Very low	85 Å²	85	120.1 Å²	120.1	88%	0.876	83%	0.83	S	S	*	*			trans	80.5	158	-173.2	0	0	0	0	0	112.8
138	G	33.4	Very low	38.7	Very low	74 Å²	74	124.1 Å²	124.1	76%	0.763	83%	0.827	S	S	*	*			cis	-153.9	147.4	-6.2	0	0	0	0	0	109.2
139	G	44.7	Very low	38.4	Very low	78 Å²	78	129 Å²	129	80%	0.804	82%	0.823	S	S	*	*			trans	-68.1	148.2	-166.7	0	0	0	0	0	114.7
140	N	37.1	Very low	37.9	Very low	157 Å²	157	127 Å²	127	84%	0.84	81%	0.812	S	S	*	*			trans	-134	147.5	165.3	-103.1	-48.3	0	0	0	111	I142	N140-I142 PolarHBondContact O-N 3.31Å
141	N	48.8	Very low	37.7	Very low	143 Å²	143	130 Å²	130	77%	0.765	81%	0.809	S	S	*	*			trans	-86.9	97.2	-165.8	-80.7	-102.2	0	0	0	112.6
142	I	44.5	Very low	37.9	Very low	145 Å²	145	132.6 Å²	132.6	74%	0.744	80%	0.801	S	S	*	*			trans	-96.9	120.4	146.9	-79.3	63.6	0	0	0	106.6	N140 D144	N140-I142 PolarHBondContact O-N 3.31Å; I142-D144 PolarHBondContact O-N 3.02Å
143	K	39.8	Very low	37.9	Very low	183 Å²	183	136 Å²	136	80%	0.796	80%	0.799	S	S	*	*			trans	-81.4	96.3	172.7	-70.2	174.4	-178.8	171.4	0	108.1	P145	K143-P145 WeakPolarHBondContact O-CD 2.85Å
144	D	33.7	Very low	38.5	Very low	134 Å²	134	140 Å²	140	72%	0.717	80%	0.802	S	S	*	*			trans	-52	125.1	164.3	-73.1	-42.5	0	0	0	108.8	I142 L146	I142-D144 PolarHBondContact O-N 3.02Å; D144-L146 PolarHBondContact O-N 3.03Å
145	P	44.6	Very low	38.8	Very low	112 Å²	112	137.9 Å²	137.9	73%	0.727	79%	0.785	S	S	*	*			trans	-73.2	77.5	169.6	30.9	-32.8	0	0	0	107.8	K143 F147	K143-P145 WeakPolarHBondContact O-CD 2.85Å; P145-F147 PolarHBondContact O-N 3.44Å
146	L	38.3	Very low	39.5	Very low	156 Å²	156	136.7 Å²	136.7	82%	0.817	76%	0.759	S	S	*	*			trans	-36.2	107.8	175.9	174.6	72.3	0	0	0	108.6	D144 K148	D144-L146 PolarHBondContact O-N 3.03Å; L146-K148 VanDerWaalsContact C-N 3.31Å; L146-K148 PolarHBondContact O-N 3.16Å
147	F	38.5	Very low	40	Very low	196 Å²	196	138.3 Å²	138.3	86%	0.86	74%	0.742	S	S	*	*			trans	-64.7	97	-171	-126.5	-95.8	0	0	0	108.1	P145 R149	P145-F147 PolarHBondContact O-N 3.44Å; F147-R149 PolarHBondContact O-N 3.28Å
148	K	32.1	Very low	40.6	Very low	193 Å²	193	136.5 Å²	136.5	84%	0.839	71%	0.712	S	S	*	*			trans	-61.3	101	-166.5	-168.9	172.7	-171.9	171.7	0	107.1	L146 G150	L146-K148 VanDerWaalsContact C-N 3.31Å; L146-K148 PolarHBondContact O-N 3.16Å; K148-G150 WeakPolarHBondContact O-CA 3.21Å; K148-G150 PolarHBondContact O-N 3.08Å
149	R	37.9	Very low	41.3	Very low	208 Å²	208	142 Å²	142	79%	0.785	72%	0.718	S	S	*	*			trans	-67.6	77.5	-167.6	-165.9	172.6	-174.2	164.2	5.7	110.5	F147 K151 E152	F147-R149 PolarHBondContact O-N 3.28Å; R149-K151 VanDerWaalsContact C-N 3.3Å; R149-K151 PolarHBondContact O-N 3.24Å; R149-E152 IonicContact CZ-OE2 3.25Å; R149-E152 VanDerWaalsContact CZ-OE2 3.25Å; R149-E152 IonicContact NE-OE2 2.78Å; R149-E152 PolarHBondContact NE-OE2 3.34Å; R149-E152 IonicContact NH2-OE2 2.85Å; R149-E152 PolarHBondContact NH2-OE2 3.46Å
150	G	30.8	Very low	41.2	Very low	64 Å²	64	147.9 Å²	147.9	66%	0.66	72%	0.716	S	S	*	*			trans	-79.9	73.1	-158.3	0	0	0	0	0	112.2	K148 E152	K148-G150 WeakPolarHBondContact O-CA 3.21Å; K148-G150 PolarHBondContact O-N 3.08Å; G150-E152 PolarHBondContact O-N 2.81Å
151	K	36.7	Very low	41.7	Very low	195 Å²	195	142.5 Å²	142.5	85%	0.848	70%	0.698	S	S	*	*			trans	42	66	171.9	-63.7	-176.8	178.4	-178.8	0	111.6	R149 K153	R149-K151 VanDerWaalsContact C-N 3.3Å; R149-K151 PolarHBondContact O-N 3.24Å; K151-K153 PolarHBondContact O-N 3.42Å
152	E	38.6	Very low	41.3	Very low	128 Å²	128	144.9 Å²	144.9	60%	0.598	70%	0.696	S	S	*	*			trans	-46.6	115.2	172.4	-68.4	177.2	84.1	0	0	108.7	R149 G150 L154	R149-E152 IonicContact CZ-OE2 3.25Å; R149-E152 VanDerWaalsContact CZ-OE2 3.25Å; R149-E152 IonicContact NE-OE2 2.78Å; R149-E152 PolarHBondContact NE-OE2 3.34Å; R149-E152 IonicContact NH2-OE2 2.85Å; R149-E152 PolarHBondContact NH2-OE2 3.46Å; G150-E152 PolarHBondContact O-N 2.81Å; E152-L154 VanDerWaalsContact C-N 3.31Å; E152-L154 PolarHBondContact O-N 2.85Å
153	K	41.7	Very low	41.5	Very low	205 Å²	205	142.7 Å²	142.7	89%	0.891	69%	0.685	S	S	*	*			trans	-69.8	97.2	173.7	-71	-175.6	-179.9	179.7	0	106.3	K151	K151-K153 PolarHBondContact O-N 3.42Å
154	L	45.7	Very low	41.8	Very low	157 Å²	157	141.3 Å²	141.3	82%	0.822	67%	0.674	S	S	*	*			trans	-40.3	131.9	-179	-75.7	161	0	0	0	110.7	E152 I156	E152-L154 VanDerWaalsContact C-N 3.31Å; E152-L154 PolarHBondContact O-N 2.85Å; L154-I156 PolarHBondContact O-N 2.93Å
155	P	46.7	Very low	42.7	Very low	93 Å²	93	139.1 Å²	139.1	60%	0.604	66%	0.661	S	S	*	*			trans	-52.5	140.2	-177.8	-27.4	34.8	0	0	0	111.9	R157	P155-R157 PolarHBondContact O-N 2.84Å
156	I	48.2	Very low	43.5	Very low	57 Å²	57	135.2 Å²	135.2	29%	0.292	64%	0.641	S	S	.	*	S	Bend	trans	-76.8	11.3	-174.4	-134.2	165.4	0	0	0	113.3	L154 R164	L154-I156 PolarHBondContact O-N 2.93Å; I156-R164 PolarHBondContact O-N 3.39Å
157	R	46.1	Very low	45	Very low	141 Å²	141	130.7 Å²	130.7	53%	0.532	63%	0.632	S	S	.	*	B	Isolated β-bridge	trans	-134.3	118.3	-172.8	-177.5	-178.5	-171.4	-130.8	8.9	108.3	P155	P155-R157 PolarHBondContact O-N 2.84Å
158	D	44.1	Very low	46.7	Very low	48 Å²	48	124 Å²	124	26%	0.257	61%	0.613	S	S	.	*			trans	-73	155.3	170.5	-66.5	-18.8	0	0	0	110.1	R160 G161 R164	D158-R160 PolarHBondContact O-N 3.31Å; D158-G161 PolarHBondContact O-N 3.4Å; D158-G161 VanDerWaalsContact O-N 3.14Å; D158-R164 WeakPolarHBondContact OD1-CD 3.34Å; D158-R164 IonicContact OD1-CZ 2.73Å; D158-R164 VanDerWaalsContact OD1-CZ 3.29Å; D158-R164 IonicContact OD1-NE 3.79Å; D158-R164 PolarHBondContact OD1-NE 3.47Å; D158-R164 IonicContact OD1-NH1 3.37Å; D158-R164 PolarHBondContact OD1-NH1 3.24Å; D158-R164 WeakPolarHBondContact OD2-CD 3.29Å; D158-R164 IonicContact OD2-CZ 3.19Å; D158-R164 IonicContact OD2-NE 2.68Å; D158-R164 PolarHBondContact OD2-NE 3.09Å; D158-R164 IonicContact OD2-NH1 2.63Å; D158-R164 PolarHBondContact OD2-NH1 3.39Å; D158-R164 IonicContact OD2-NH2 3.04Å
159	E	47.8	Very low	49	Very low	190 Å²	190	115.4 Å²	115.4	89%	0.888	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.6	-11.1	173.8	-63.3	-59.7	107.8	0	0	115.9
160	R	43.3	Very low	51	Low	200 Å²	200	107.6 Å²	107.6	76%	0.755	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	21.8	-177.1	-78.9	163.7	-90	-142.1	-9.4	113.3	D158 R162	D158-R160 PolarHBondContact O-N 3.31Å; R160-R162 PolarHBondContact O-N 3.45Å
161	G	47.8	Very low	53.6	Low	44 Å²	44	112.7 Å²	112.7	45%	0.454	55%	0.549	S	S	.	.	S	Bend	trans	69.1	-21.1	175.6	0	0	0	0	0	116	D158 I163	D158-G161 PolarHBondContact O-N 3.4Å; D158-G161 VanDerWaalsContact O-N 3.14Å; G161-I163 PolarHBondContact O-N 2.82Å
162	R	39.8	Very low	56	Low	194 Å²	194	105.3 Å²	105.3	73%	0.732	52%	0.52	S	S	*	.			trans	-68.1	114.5	179	-66.8	-165.5	-75.7	-151.8	-1.3	110.7	R160 R164	R160-R162 PolarHBondContact O-N 3.45Å; R162-R164 PolarHBondContact O-N 2.84Å
163	I	48.8	Very low	58.2	Low	98 Å²	98	99.7 Å²	99.7	50%	0.503	49%	0.494	S	S	.	.	B	Isolated β-bridge	trans	-57.6	116.9	168.1	-54.5	170.8	0	0	0	107.5	G161 M165	G161-I163 PolarHBondContact O-N 2.82Å; I163-M165 PolarHBondContact O-N 2.88Å
164	R	46.7	Very low	60.5	Low	154 Å²	154	92.8 Å²	92.8	58%	0.581	47%	0.468	S	S	*	.			trans	-71.7	118.4	168.6	-88.2	179.5	156.7	157.3	-10.3	106.9	I156 D158 R162 G166	I156-R164 PolarHBondContact O-N 3.39Å; D158-R164 WeakPolarHBondContact OD1-CD 3.34Å; D158-R164 IonicContact OD1-CZ 2.73Å; D158-R164 VanDerWaalsContact OD1-CZ 3.29Å; D158-R164 IonicContact OD1-NE 3.79Å; D158-R164 PolarHBondContact OD1-NE 3.47Å; D158-R164 IonicContact OD1-NH1 3.37Å; D158-R164 PolarHBondContact OD1-NH1 3.24Å; D158-R164 WeakPolarHBondContact OD2-CD 3.29Å; D158-R164 IonicContact OD2-CZ 3.19Å; D158-R164 IonicContact OD2-NE 2.68Å; D158-R164 PolarHBondContact OD2-NE 3.09Å; D158-R164 IonicContact OD2-NH1 2.63Å; D158-R164 PolarHBondContact OD2-NH1 3.39Å; D158-R164 IonicContact OD2-NH2 3.04Å; R162-R164 PolarHBondContact O-N 2.84Å; R164-G166 PolarHBondContact O-N 3.37Å
165	M	52.9	Low	62.6	Low	89 Å²	89	89.7 Å²	89.7	44%	0.438	45%	0.448	S	S	.	.			trans	-66	64.4	166.7	-78.4	-76.4	-168.3	0	0	110.1	H17 I163	H17-M165 HydrophobicContact CB-CE 4.28Å; H17-M165 VanDerWaalsContact O-CE 3.27Å; H17-M165 WeakPolarHBondContact O-CE 3.38Å; I163-M165 PolarHBondContact O-N 2.88Å
166	G	60.3	Low	64.7	Low	30 Å²	30	86 Å²	86	31%	0.309	42%	0.424	S	S	.	.			trans	-90.3	129.2	-169	0	0	0	0	0	111.9	R164 A168 L169	R164-G166 PolarHBondContact O-N 3.37Å; G166-A168 PolarHBondContact O-N 3.43Å; G166-L169 PolarHBondContact O-N 2.94Å
167	G	69.5	Low	66.7	Low	60 Å²	60	83.4 Å²	83.4	62%	0.619	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	-94.5	164.2	0	0	0	0	0	115	L169 L170 R171	G167-L169 PolarHBondContact O-N 2.94Å; G167-L170 PolarHBondContact O-N 3.06Å; G167-R171 WeakPolarHBondContact O-CB 3.41Å; G167-R171 PolarHBondContact O-N 3.32Å
168	A	75.4	Confident	68.8	Low	56 Å²	56	80 Å²	80	46%	0.463	40%	0.402	S	S	.	.	H	α-helix	trans	-53.9	-50.2	-176.3	0	0	0	0	0	113.8	G166 R171 T172	G166-A168 PolarHBondContact O-N 3.43Å; A168-R171 PolarHBondContact O-N 2.91Å; A168-T172 PolarHBondContact O-N 2.86Å; A168-T172 PolarHBondContact O-OG1 2.56Å
169	L	79.7	Confident	71.2	Confident	13 Å²	13	82.8 Å²	82.8	7%	0.068	41%	0.412	C	S	.	.	H	α-helix	trans	-62.1	-48.1	-178.2	-75.6	174	0	0	0	111.5	V96 I99 G166 G167 R171 T172 Y173	V96-L169 HydrophobicContact CG2-CD2 3.99Å; I99-L169 HydrophobicContact CD1-CD2 3.68Å; I99-L169 HydrophobicContact CD1-CG 4.29Å; G166-L169 PolarHBondContact O-N 2.94Å; G167-L169 PolarHBondContact O-N 2.94Å; L169-R171 VanDerWaalsContact C-N 3.3Å; L169-R171 PolarHBondContact O-N 3.05Å; L169-T172 PolarHBondContact O-N 2.89Å; L169-T172 PolarHBondContact O-OG1 2.87Å; L169-Y173 WeakPolarHBondContact O-CB 3.33Å; L169-Y173 PolarHBondContact O-N 3.35Å
170	L	79.8	Confident	73.4	Confident	43 Å²	43	74.6 Å²	74.6	23%	0.225	37%	0.373	C	S	.	.	H	α-helix	trans	-61.1	-38.6	176.1	-177.4	65.6	0	0	0	111.6	G167 Y173 V174	G167-L170 PolarHBondContact O-N 3.06Å; L170-Y173 HydrophobicContact CD1-CD1 4.25Å; L170-Y173 PolarHBondContact O-N 3.42Å; L170-V174 HydrophobicContact CD1-CG2 4.43Å; L170-V174 WeakPolarHBondContact O-CB 3.27Å; L170-V174 VanDerWaalsContact O-CG2 3.31Å; L170-V174 WeakPolarHBondContact O-CG2 3.42Å; L170-V174 PolarHBondContact O-N 3.34Å
171	R	85.4	Confident	75.8	Confident	172 Å²	172	65.9 Å²	65.9	65%	0.649	34%	0.342	S	S	*	.	H	α-helix	trans	-66.1	-44.5	177.3	-170.8	179.5	-175.5	-157.6	-0.7	111.9	G167 A168 L169 Y173 V174 F175	G167-R171 WeakPolarHBondContact O-CB 3.41Å; G167-R171 PolarHBondContact O-N 3.32Å; A168-R171 PolarHBondContact O-N 2.91Å; L169-R171 VanDerWaalsContact C-N 3.3Å; L169-R171 PolarHBondContact O-N 3.05Å; R171-Y173 VanDerWaalsContact C-N 3.33Å; R171-V174 PolarHBondContact O-N 3.45Å; R171-F175 HydrophobicContact CG-CD2 3.96Å; R171-F175 HydrophobicContact CG-CE2 3.71Å; R171-F175 VanDerWaalsContact O-CD2 3.25Å; R171-F175 WeakPolarHBondContact O-CD2 3.21Å; R171-F175 PolarHBondContact O-N 2.92Å
172	T	88	Confident	78.1	Confident	39 Å²	39	68.9 Å²	68.9	24%	0.239	35%	0.347	C	S	.	.	H	α-helix	trans	-66.5	-34.9	176.1	47.3	0	0	0	0	112.8	H95 A168 L169 N176	H95-T172 VanDerWaalsContact CE1-CG2 3.42Å; H95-T172 WeakPolarHBondContact CE1-CG2 3.47Å; H95-T172 PolarHBondContact CE1-OG1 3.38Å; H95-T172 PolarHBondContact ND1-OG1 2.8Å; H95-T172 VanDerWaalsContact ND1-OG1 3.12Å; A168-T172 PolarHBondContact O-N 2.86Å; A168-T172 PolarHBondContact O-OG1 2.56Å; L169-T172 PolarHBondContact O-N 2.89Å; L169-T172 PolarHBondContact O-OG1 2.87Å; T172-N176 WeakPolarHBondContact O-CB 3.48Å; T172-N176 PolarHBondContact O-N 3.37Å
173	Y	85.5	Confident	80.8	Confident	11 Å²	11	62.6 Å²	62.6	4%	0.043	33%	0.326	C	S	.	.	H	α-helix	trans	-67.4	-45.3	174.5	175.9	-123.7	0	0	0	112.1	Y92 L169 L170 R171 F175 N176 I177 E245 L249	Y92-Y173 HydrophobicContact CE1-CD2 4.11Å; Y92-Y173 HydrophobicContact CE2-CD2 4.33Å; Y92-Y173 HydrophobicContact CE2-CG 4.43Å; Y92-Y173 AromaticContact CZ-CD2 3.95Å; L169-Y173 WeakPolarHBondContact O-CB 3.33Å; L169-Y173 PolarHBondContact O-N 3.35Å; L170-Y173 HydrophobicContact CD1-CD1 4.25Å; L170-Y173 PolarHBondContact O-N 3.42Å; R171-Y173 VanDerWaalsContact C-N 3.33Å; Y173-F175 PolarHBondContact O-N 3.35Å; Y173-N176 WeakPolarHBondContact O-CB 3.5Å; Y173-N176 PolarHBondContact O-N 2.88Å; Y173-I177 HydrophobicContact CD1-CD1 4.38Å; Y173-I177 HydrophobicContact CD2-CD1 4.29Å; Y173-I177 HydrophobicContact CD2-CG1 4.48Å; Y173-I177 HydrophobicContact CE1-CD1 4.08Å; Y173-I177 HydrophobicContact CE2-CD1 3.97Å; Y173-I177 HydrophobicContact CE2-CG1 4.35Å; Y173-I177 HydrophobicContact CG-CD1 4.5Å; Y173-I177 WeakPolarHBondContact O-CG1 3.31Å; Y173-I177 PolarHBondContact O-N 3.21Å; Y173-E245 PolarHBondContact OH-OE1 3.4Å; Y173-L249 HydrophobicContact CD1-CD1 4.17Å; Y173-L249 HydrophobicContact CE1-CD1 3.45Å; Y173-L249 VanDerWaalsContact CE1-CD1 3.45Å; Y173-L249 HydrophobicContact CE1-CD2 3.99Å; Y173-L249 HydrophobicContact CE1-CG 4.36Å
174	V	88.1	Confident	83	Confident	59 Å²	59	58 Å²	58	36%	0.358	30%	0.302	S	S	.	.	H	α-helix	trans	-62.3	-42.4	174.9	168.3	0	0	0	0	111.5	L170 R171 I177 I178	L170-V174 HydrophobicContact CD1-CG2 4.43Å; L170-V174 WeakPolarHBondContact O-CB 3.27Å; L170-V174 VanDerWaalsContact O-CG2 3.31Å; L170-V174 WeakPolarHBondContact O-CG2 3.42Å; L170-V174 PolarHBondContact O-N 3.34Å; R171-V174 PolarHBondContact O-N 3.45Å; V174-I177 PolarHBondContact O-N 2.77Å; V174-I178 HydrophobicContact CG1-CD1 3.75Å; V174-I178 HydrophobicContact CG1-CG1 4.5Å; V174-I178 WeakPolarHBondContact O-CD1 3.34Å; V174-I178 VanDerWaalsContact O-CG1 3.26Å; V174-I178 WeakPolarHBondContact O-CG1 3.32Å; V174-I178 PolarHBondContact O-N 2.66Å
175	F	90.3	Very high	85.4	Confident	93 Å²	93	53.5 Å²	53.5	41%	0.408	29%	0.292	S	S	.	.	H	α-helix	trans	-62.3	-41.9	172.7	-79.1	-53.8	0	0	0	112.5	R171 Y173 I177 I178 F179	R171-F175 HydrophobicContact CG-CD2 3.96Å; R171-F175 HydrophobicContact CG-CE2 3.71Å; R171-F175 VanDerWaalsContact O-CD2 3.25Å; R171-F175 WeakPolarHBondContact O-CD2 3.21Å; R171-F175 PolarHBondContact O-N 2.92Å; Y173-F175 PolarHBondContact O-N 3.35Å; F175-I177 PolarHBondContact O-N 2.93Å; F175-I178 PolarHBondContact O-N 3.2Å; F175-F179 HydrophobicContact CB-CD2 4.45Å; F175-F179 HydrophobicContact CB-CE2 4.49Å; F175-F179 VanDerWaalsContact O-CD2 3.22Å; F175-F179 WeakPolarHBondContact O-CD2 3.28Å; F175-F179 PolarHBondContact O-N 2.9Å
176	N	90.6	Very high	87.5	Confident	16 Å²	16	51.3 Å²	51.3	9%	0.086	29%	0.291	C	S	.	.	H	α-helix	trans	-53.8	-51.2	175	150.6	-90.5	0	0	0	111.8	P88 T89 T172 Y173 F179 K180	P88-N176 PolarHBondContact O-ND2 3.34Å; T89-N176 VanDerWaalsContact CA-ND2 3.26Å; T89-N176 WeakPolarHBondContact CA-ND2 3.46Å; T89-N176 PolarHBondContact N-ND2 3.46Å; T172-N176 WeakPolarHBondContact O-CB 3.48Å; T172-N176 PolarHBondContact O-N 3.37Å; Y173-N176 WeakPolarHBondContact O-CB 3.5Å; Y173-N176 PolarHBondContact O-N 2.88Å; N176-F179 PolarHBondContact O-N 3.32Å; N176-K180 VanDerWaalsContact O-CB 3.31Å; N176-K180 WeakPolarHBondContact O-CB 3.41Å; N176-K180 PolarHBondContact O-N 2.72Å
177	I	89.9	Confident	89.2	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-69.2	-37.2	-178.6	-46.8	159.3	0	0	0	110.6	Y173 V174 F175 K180 T181 N242 E245 I246 L249	Y173-I177 HydrophobicContact CD1-CD1 4.38Å; Y173-I177 HydrophobicContact CD2-CD1 4.29Å; Y173-I177 HydrophobicContact CD2-CG1 4.48Å; Y173-I177 HydrophobicContact CE1-CD1 4.08Å; Y173-I177 HydrophobicContact CE2-CD1 3.97Å; Y173-I177 HydrophobicContact CE2-CG1 4.35Å; Y173-I177 HydrophobicContact CG-CD1 4.5Å; Y173-I177 WeakPolarHBondContact O-CG1 3.31Å; Y173-I177 PolarHBondContact O-N 3.21Å; V174-I177 PolarHBondContact O-N 2.77Å; F175-I177 PolarHBondContact O-N 2.93Å; I177-K180 PolarHBondContact O-N 3.27Å; I177-T181 WeakPolarHBondContact O-CB 3.34Å; I177-T181 PolarHBondContact O-N 2.74Å; I177-T181 PolarHBondContact O-OG1 3.19Å; I177-N242 HydrophobicContact CG2-CB 3.97Å; I177-E245 HydrophobicContact CD1-CG 4.12Å; I177-I246 HydrophobicContact CB-CD1 4.3Å; I177-I246 HydrophobicContact CB-CG1 4.16Å; I177-I246 HydrophobicContact CG2-CD1 3.75Å; I177-I246 HydrophobicContact CG2-CG1 3.7Å; I177-L249 HydrophobicContact CD1-CD1 3.82Å
178	I	92	Very high	90.5	Very high	69 Å²	69	50 Å²	50	35%	0.354	26%	0.261	S	S	.	.	H	α-helix	trans	-59.5	-51.7	175	-70.7	166.3	0	0	0	111.1	V174 F175 K180 T181 L182	V174-I178 HydrophobicContact CG1-CD1 3.75Å; V174-I178 HydrophobicContact CG1-CG1 4.5Å; V174-I178 WeakPolarHBondContact O-CD1 3.34Å; V174-I178 VanDerWaalsContact O-CG1 3.26Å; V174-I178 WeakPolarHBondContact O-CG1 3.32Å; V174-I178 PolarHBondContact O-N 2.66Å; F175-I178 PolarHBondContact O-N 3.2Å; I178-K180 VanDerWaalsContact C-N 3.32Å; I178-K180 PolarHBondContact O-N 2.97Å; I178-T181 PolarHBondContact O-N 3.14Å; I178-L182 HydrophobicContact CG2-CD1 3.92Å; I178-L182 HydrophobicContact CG2-CG 4.45Å; I178-L182 WeakPolarHBondContact O-CB 3.36Å; I178-L182 WeakPolarHBondContact O-CG 3.31Å; I178-L182 PolarHBondContact O-N 3Å
179	F	94.4	Very high	91.5	Very high	106 Å²	106	50.4 Å²	50.4	47%	0.465	26%	0.258	S	S	.	.	H	α-helix	trans	-62.7	-39.8	177.6	-79.1	-65.9	0	0	0	111.9	P88 F175 N176 L182 F183	P88-F179 HydrophobicContact CB-CB 4.18Å; P88-F179 HydrophobicContact CG-CB 3.87Å; F175-F179 HydrophobicContact CB-CD2 4.45Å; F175-F179 HydrophobicContact CB-CE2 4.49Å; F175-F179 VanDerWaalsContact O-CD2 3.22Å; F175-F179 WeakPolarHBondContact O-CD2 3.28Å; F175-F179 PolarHBondContact O-N 2.9Å; N176-F179 PolarHBondContact O-N 3.32Å; F179-L182 PolarHBondContact O-N 2.97Å; F179-F183 HydrophobicContact CB-CE2 4.22Å; F179-F183 WeakPolarHBondContact O-CD2 3.33Å; F179-F183 WeakPolarHBondContact O-CG 3.45Å; F179-F183 PolarHBondContact O-N 3.14Å
180	K	92.2	Very high	92.3	Very high	18 Å²	18	50.9 Å²	50.9	8%	0.078	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-46.1	176	-169.1	-173.4	174.9	-160	0	112	V85 N176 I177 I178 F183 E184 N242	V85-K180 HydrophobicContact CG1-CD 4.34Å; V85-K180 HydrophobicContact CG1-CG 3.87Å; N176-K180 VanDerWaalsContact O-CB 3.31Å; N176-K180 WeakPolarHBondContact O-CB 3.41Å; N176-K180 PolarHBondContact O-N 2.72Å; I177-K180 PolarHBondContact O-N 3.27Å; I178-K180 VanDerWaalsContact C-N 3.32Å; I178-K180 PolarHBondContact O-N 2.97Å; K180-F183 PolarHBondContact O-N 3.32Å; K180-E184 WeakPolarHBondContact O-CB 3.15Å; K180-E184 PolarHBondContact O-N 2.9Å; K180-N242 WeakPolarHBondContact CE-OD1 3.35Å; K180-N242 PolarHBondContact NZ-OD1 3.07Å
181	T	93.6	Very high	93	Very high	18 Å²	18	49 Å²	49	11%	0.11	26%	0.256	C	S	.	.	H	α-helix	trans	-62	-44.1	175.3	-70	0	0	0	0	111.5	I177 I178 E184 V185 L239 M243	I177-T181 WeakPolarHBondContact O-CB 3.34Å; I177-T181 PolarHBondContact O-N 2.74Å; I177-T181 PolarHBondContact O-OG1 3.19Å; I178-T181 PolarHBondContact O-N 3.14Å; T181-E184 PolarHBondContact O-N 3.11Å; T181-V185 WeakPolarHBondContact O-CB 3.17Å; T181-V185 VanDerWaalsContact O-CG2 3.3Å; T181-V185 WeakPolarHBondContact O-CG2 3.38Å; T181-V185 PolarHBondContact O-N 3.41Å; T181-L239 HydrophobicContact CG2-CD1 3.84Å; T181-M243 HydrophobicContact CG2-SD 4.02Å
182	L	96.2	Very high	93.4	Very high	106 Å²	106	46.3 Å²	46.3	56%	0.555	25%	0.247	S	C	*	.	H	α-helix	trans	-63.1	-42.3	177.4	-72.1	171.7	0	0	0	112.4	I178 F179 G186	I178-L182 HydrophobicContact CG2-CD1 3.92Å; I178-L182 HydrophobicContact CG2-CG 4.45Å; I178-L182 WeakPolarHBondContact O-CB 3.36Å; I178-L182 WeakPolarHBondContact O-CG 3.31Å; I178-L182 PolarHBondContact O-N 3Å; F179-L182 PolarHBondContact O-N 2.97Å; L182-G186 PolarHBondContact O-N 2.97Å
183	F	96.4	Very high	93.8	Very high	63 Å²	63	52.1 Å²	52.1	28%	0.276	27%	0.269	S	S	.	.	H	α-helix	trans	-67.8	-46.8	174.8	-66.1	-46.5	0	0	0	111.7	F84 V85 P88 F179 K180 V185 G186 F187	F84-F183 HydrophobicContact CB-CB 4.4Å; F84-F183 HydrophobicContact CB-CD1 4.4Å; F84-F183 HydrophobicContact CB-CD2 4.38Å; F84-F183 HydrophobicContact CB-CG 4.17Å; F84-F183 HydrophobicContact CD1-CD1 4.25Å; F84-F183 AromaticContact CD1-CE1 3.94Å; F84-F183 HydrophobicContact CD1-CE1 3.94Å; F84-F183 HydrophobicContact CD1-CE2 4.43Å; F84-F183 HydrophobicContact CD1-CZ 4.05Å; F84-F183 WeakPolarHBondContact O-CD2 3.48Å; V85-F183 HydrophobicContact CG2-CB 4.23Å; P88-F183 HydrophobicContact CG-CD2 3.9Å; P88-F183 HydrophobicContact CG-CE2 3.82Å; F179-F183 HydrophobicContact CB-CE2 4.22Å; F179-F183 WeakPolarHBondContact O-CD2 3.33Å; F179-F183 WeakPolarHBondContact O-CG 3.45Å; F179-F183 PolarHBondContact O-N 3.14Å; K180-F183 PolarHBondContact O-N 3.32Å; F183-V185 VanDerWaalsContact C-N 3.33Å; F183-V185 PolarHBondContact O-N 2.93Å; F183-G186 PolarHBondContact O-N 2.99Å; F183-G186 VanDerWaalsContact O-N 3.09Å; F183-F187 VanDerWaalsContact O-CD2 3.31Å; F183-F187 WeakPolarHBondContact O-CD2 3.41Å; F183-F187 PolarHBondContact O-N 3.37Å
184	E	95.6	Very high	94.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-59.5	-42.7	179.4	-163.6	86.7	-89.1	0	0	111.5	R33 Q81 V85 K180 T181 I188 S238 L239	R33-E184 IonicContact CZ-OE1 3.36Å; R33-E184 IonicContact CZ-OE2 2.69Å; R33-E184 IonicContact NH1-OE1 3.8Å; R33-E184 PolarHBondContact NH1-OE1 3.12Å; R33-E184 IonicContact NH1-OE2 3.87Å; R33-E184 VanDerWaalsContact NH2-CD 3.3Å; R33-E184 IonicContact NH2-OE1 2.99Å; R33-E184 PolarHBondContact NH2-OE1 3Å; R33-E184 IonicContact NH2-OE2 3.17Å; R33-E184 PolarHBondContact NH2-OE2 3.15Å; Q81-E184 PolarHBondContact NE2-OE1 3.42Å; V85-E184 HydrophobicContact CG2-CB 4.34Å; K180-E184 WeakPolarHBondContact O-CB 3.15Å; K180-E184 PolarHBondContact O-N 2.9Å; T181-E184 PolarHBondContact O-N 3.11Å; E184-I188 HydrophobicContact CG-CD1 4.31Å; E184-I188 WeakPolarHBondContact O-CD1 3.08Å; E184-I188 VanDerWaalsContact O-CG1 3.23Å; E184-I188 WeakPolarHBondContact O-CG1 3.46Å; E184-I188 PolarHBondContact O-N 3.07Å; E184-S238 WeakPolarHBondContact OE2-CB 3.12Å; E184-S238 PolarHBondContact OE2-OG 3.37Å; E184-L239 HydrophobicContact CG-CB 4.13Å
185	V	97.3	Very high	94.2	Very high	61 Å²	61	54.4 Å²	54.4	37%	0.37	28%	0.277	S	S	.	.	H	α-helix	trans	-63.7	-45.9	171.7	172.5	0	0	0	0	111.4	T181 F183 F187 I188 V189 L239	T181-V185 WeakPolarHBondContact O-CB 3.17Å; T181-V185 VanDerWaalsContact O-CG2 3.3Å; T181-V185 WeakPolarHBondContact O-CG2 3.38Å; T181-V185 PolarHBondContact O-N 3.41Å; F183-V185 VanDerWaalsContact C-N 3.33Å; F183-V185 PolarHBondContact O-N 2.93Å; V185-F187 VanDerWaalsContact C-N 3.33Å; V185-F187 PolarHBondContact O-N 3.49Å; V185-I188 PolarHBondContact O-N 3.34Å; V185-V189 HydrophobicContact CG1-CG2 4.11Å; V185-V189 WeakPolarHBondContact O-CB 3.28Å; V185-V189 WeakPolarHBondContact O-CG2 3.43Å; V185-V189 PolarHBondContact O-N 3.03Å; V185-L239 HydrophobicContact CG2-CD1 3.64Å; V185-L239 HydrophobicContact CG2-CD2 3.75Å; V185-L239 HydrophobicContact CG2-CG 4.37Å
186	G	97.4	Very high	94.3	Very high	42 Å²	42	50.9 Å²	50.9	43%	0.433	27%	0.268	S	S	.	.	H	α-helix	trans	-59.5	-40.2	-179.8	0	0	0	0	0	113.3	L182 F183 G190	L182-G186 PolarHBondContact O-N 2.97Å; F183-G186 PolarHBondContact O-N 2.99Å; F183-G186 VanDerWaalsContact O-N 3.09Å; G186-G190 PolarHBondContact O-N 3.47Å
187	F	96.8	Very high	94.1	Very high	29 Å²	29	55.4 Å²	55.4	13%	0.127	29%	0.287	C	S	.	.	H	α-helix	trans	-73.8	-37.2	175.2	-81.8	-84.3	0	0	0	112.7	F77 L80 Q81 F84 F183 V185 G190 Q191	F77-F187 HydrophobicContact CD1-CD1 4.25Å; F77-F187 HydrophobicContact CE1-CB 4.3Å; F77-F187 AromaticContact CE1-CD1 3.69Å; F77-F187 HydrophobicContact CE1-CD1 3.69Å; F77-F187 WeakPolarHBondContact CE1-O 3.38Å; F77-F187 HydrophobicContact CE2-CD1 4.03Å; F77-F187 HydrophobicContact CE2-CE1 4.36Å; F77-F187 HydrophobicContact CZ-CB 4.34Å; F77-F187 AromaticContact CZ-CD1 3.57Å; F77-F187 HydrophobicContact CZ-CD1 3.57Å; F77-F187 HydrophobicContact CZ-CE1 4.34Å; F77-F187 HydrophobicContact CZ-CG 4.39Å; F77-F187 VanDerWaalsContact CZ-O 3.31Å; F77-F187 WeakPolarHBondContact CZ-O 3.42Å; L80-F187 HydrophobicContact CB-CE1 3.93Å; L80-F187 HydrophobicContact CB-CZ 4.05Å; Q81-F187 HydrophobicContact CB-CB 4.08Å; Q81-F187 HydrophobicContact CB-CD1 3.56Å; Q81-F187 HydrophobicContact CB-CD2 4.17Å; Q81-F187 HydrophobicContact CB-CE1 4.02Å; Q81-F187 HydrophobicContact CB-CG 3.66Å; Q81-F187 HydrophobicContact CG-CB 3.64Å; Q81-F187 HydrophobicContact CG-CD1 4.11Å; Q81-F187 HydrophobicContact CG-CD2 4.12Å; Q81-F187 HydrophobicContact CG-CG 3.69Å; F84-F187 HydrophobicContact CB-CE2 3.63Å; F84-F187 HydrophobicContact CB-CZ 4.21Å; F84-F187 AromaticContact CD2-CE2 3.94Å; F84-F187 HydrophobicContact CD2-CE2 3.94Å; F84-F187 AromaticContact CD2-CZ 3.69Å; F84-F187 HydrophobicContact CD2-CZ 3.69Å; F84-F187 HydrophobicContact CE2-CZ 4.44Å; F84-F187 AromaticContact CG-CE2 3.97Å; F84-F187 HydrophobicContact CG-CE2 3.97Å; F84-F187 HydrophobicContact CG-CZ 4.21Å; F183-F187 VanDerWaalsContact O-CD2 3.31Å; F183-F187 WeakPolarHBondContact O-CD2 3.41Å; F183-F187 PolarHBondContact O-N 3.37Å; V185-F187 VanDerWaalsContact C-N 3.33Å; V185-F187 PolarHBondContact O-N 3.49Å; F187-G190 PolarHBondContact O-N 3.46Å; F187-Q191 WeakPolarHBondContact O-CB 3.45Å; F187-Q191 PolarHBondContact O-N 3.44Å
188	I	96	Very high	94.1	Very high	33 Å²	33	62.3 Å²	62.3	17%	0.169	32%	0.319	C	S	.	.	H	α-helix	trans	-61.1	-48.1	172.8	-71.5	164.4	0	0	0	111	E184 V185 Q191 Y192 L232 A235 L239	E184-I188 HydrophobicContact CG-CD1 4.31Å; E184-I188 WeakPolarHBondContact O-CD1 3.08Å; E184-I188 VanDerWaalsContact O-CG1 3.23Å; E184-I188 WeakPolarHBondContact O-CG1 3.46Å; E184-I188 PolarHBondContact O-N 3.07Å; V185-I188 PolarHBondContact O-N 3.34Å; I188-Q191 PolarHBondContact O-N 3.11Å; I188-Y192 PolarHBondContact O-N 3.02Å; I188-Y192 VanDerWaalsContact O-N 3.11Å; I188-L232 HydrophobicContact CG1-CD1 4.24Å; I188-L232 HydrophobicContact CG2-CD1 3.88Å; I188-A235 HydrophobicContact CD1-CB 3.86Å; I188-A235 HydrophobicContact CG1-CB 3.76Å; I188-L239 HydrophobicContact CD1-CD2 4.04Å
189	V	96.8	Very high	94.1	Very high	66 Å²	66	60.1 Å²	60.1	40%	0.4	31%	0.308	S	S	.	.	H	α-helix	trans	-68.1	-39.5	179.4	172.8	0	0	0	0	111.1	V185 Y192 F193	V185-V189 HydrophobicContact CG1-CG2 4.11Å; V185-V189 WeakPolarHBondContact O-CB 3.28Å; V185-V189 WeakPolarHBondContact O-CG2 3.43Å; V185-V189 PolarHBondContact O-N 3.03Å; V189-Y192 PolarHBondContact O-N 3.45Å; V189-F193 HydrophobicContact CG1-CD2 3.64Å; V189-F193 HydrophobicContact CG1-CE2 3.56Å; V189-F193 VanDerWaalsContact O-CD2 3.3Å; V189-F193 WeakPolarHBondContact O-CD2 3.17Å; V189-F193 PolarHBondContact O-N 3.31Å
190	G	95.8	Very high	93.9	Very high	22 Å²	22	62.3 Å²	62.3	23%	0.227	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-44	174.4	0	0	0	0	0	112.9	G186 F187 Y192 F193 L194	G186-G190 PolarHBondContact O-N 3.47Å; F187-G190 PolarHBondContact O-N 3.46Å; G190-Y192 VanDerWaalsContact C-N 3.33Å; G190-Y192 PolarHBondContact O-N 3.41Å; G190-F193 PolarHBondContact O-N 2.94Å; G190-L194 WeakPolarHBondContact O-CB 3.32Å; G190-L194 WeakPolarHBondContact O-CG 3.19Å; G190-L194 PolarHBondContact O-N 3.27Å
191	Q	94.8	Very high	94	Very high	5 Å²	5	65.1 Å²	65.1	2%	0.023	34%	0.337	C	S	.	.	H	α-helix	trans	-61.2	-44.1	176.2	-165.3	-178	-75.9	0	0	111	F77 F187 I188 F193 L194 Y195 G196	F77-Q191 HydrophobicContact CE1-CB 3.73Å; F77-Q191 HydrophobicContact CE1-CG 4.26Å; F77-Q191 HydrophobicContact CZ-CB 4.07Å; F187-Q191 WeakPolarHBondContact O-CB 3.45Å; F187-Q191 PolarHBondContact O-N 3.44Å; I188-Q191 PolarHBondContact O-N 3.11Å; Q191-F193 PolarHBondContact O-N 2.95Å; Q191-L194 PolarHBondContact O-N 2.93Å; Q191-Y195 HydrophobicContact CG-CD2 3.9Å; Q191-Y195 HydrophobicContact CG-CE2 4.42Å; Q191-Y195 PolarHBondContact O-N 3.2Å; Q191-G196 PolarHBondContact O-N 2.83Å
192	Y	94.9	Very high	94.1	Very high	114 Å²	114	66.3 Å²	66.3	45%	0.447	34%	0.344	S	S	.	.	H	α-helix	trans	-61.6	-41.9	177.7	175.2	-109	0	0	0	112.9	I188 V189 G190 G196 F197	I188-Y192 PolarHBondContact O-N 3.02Å; I188-Y192 VanDerWaalsContact O-N 3.11Å; V189-Y192 PolarHBondContact O-N 3.45Å; G190-Y192 VanDerWaalsContact C-N 3.33Å; G190-Y192 PolarHBondContact O-N 3.41Å; Y192-G196 WeakPolarHBondContact O-CA 3.15Å; Y192-G196 PolarHBondContact O-N 2.9Å; Y192-F197 HydrophobicContact CD2-CD1 4.17Å; Y192-F197 AromaticContact CD2-CD2 3.99Å; Y192-F197 HydrophobicContact CD2-CD2 3.99Å; Y192-F197 AromaticContact CD2-CE1 3.67Å; Y192-F197 HydrophobicContact CD2-CE1 3.67Å; Y192-F197 AromaticContact CD2-CE2 3.47Å; Y192-F197 HydrophobicContact CD2-CE2 3.47Å; Y192-F197 VanDerWaalsContact CD2-CE2 3.47Å; Y192-F197 HydrophobicContact CD2-CG 4.32Å; Y192-F197 AromaticContact CD2-CZ 3.3Å; Y192-F197 HydrophobicContact CD2-CZ 3.3Å; Y192-F197 AromaticContact CE2-CD2 3.92Å; Y192-F197 HydrophobicContact CE2-CD2 3.92Å; Y192-F197 HydrophobicContact CE2-CE1 4.45Å; Y192-F197 AromaticContact CE2-CE2 3.4Å; Y192-F197 HydrophobicContact CE2-CE2 3.4Å; Y192-F197 VanDerWaalsContact CE2-CE2 3.4Å; Y192-F197 AromaticContact CE2-CZ 3.72Å; Y192-F197 HydrophobicContact CE2-CZ 3.72Å; Y192-F197 HydrophobicContact CG-CE1 4.39Å; Y192-F197 HydrophobicContact CG-CZ 4.13Å
193	F	95.2	Very high	94.1	Very high	162 Å²	162	64.1 Å²	64.1	71%	0.711	33%	0.329	S	S	*	.	H	α-helix	trans	-78.5	-26	178.2	-76.2	-59.2	0	0	0	114.6	V189 G190 Q191	V189-F193 HydrophobicContact CG1-CD2 3.64Å; V189-F193 HydrophobicContact CG1-CE2 3.56Å; V189-F193 VanDerWaalsContact O-CD2 3.3Å; V189-F193 WeakPolarHBondContact O-CD2 3.17Å; V189-F193 PolarHBondContact O-N 3.31Å; G190-F193 PolarHBondContact O-N 2.94Å; Q191-F193 PolarHBondContact O-N 2.95Å
194	L	92.4	Very high	94.1	Very high	88 Å²	88	66.8 Å²	66.8	46%	0.461	34%	0.342	S	S	.	.	H	α-helix	trans	-82.9	-39.7	177.8	-77.6	164.9	0	0	0	113.2	F77 G190 Q191	F77-L194 HydrophobicContact CD2-CD1 4.06Å; F77-L194 HydrophobicContact CE2-CD1 3.74Å; G190-L194 WeakPolarHBondContact O-CB 3.32Å; G190-L194 WeakPolarHBondContact O-CG 3.19Å; G190-L194 PolarHBondContact O-N 3.27Å; Q191-L194 PolarHBondContact O-N 2.93Å
195	Y	89.9	Confident	94.2	Very high	29 Å²	29	66.8 Å²	66.8	11%	0.114	34%	0.342	C	S	.	.	H	α-helix	trans	-134.1	-13.6	-170.2	-38.7	-78.7	0	0	0	114.5	I72 H74 F77 Q191	I72-Y195 WeakPolarHBondContact CG2-OH 3.31Å; I72-Y195 PolarHBondContact O-OH 2.89Å; H74-Y195 AromaticContact CD2-CD2 3.86Å; H74-Y195 AromaticContact CD2-CE2 3.94Å; H74-Y195 AromaticContact CE1-CD1 3.51Å; H74-Y195 AromaticContact CE1-CE1 3.76Å; H74-Y195 AromaticContact CE1-CG 3.8Å; H74-Y195 AromaticContact NE2-CD1 3.46Å; H74-Y195 WeakPolarHBondContact NE2-CD1 3.33Å; H74-Y195 AromaticContact NE2-CD2 3.55Å; H74-Y195 AromaticContact NE2-CE1 3.89Å; H74-Y195 AromaticContact NE2-CE2 3.97Å; H74-Y195 AromaticContact NE2-CG 3.24Å; F77-Y195 HydrophobicContact CD2-CE2 4.48Å; F77-Y195 HydrophobicContact CG-CE2 4.33Å; Q191-Y195 HydrophobicContact CG-CD2 3.9Å; Q191-Y195 HydrophobicContact CG-CE2 4.42Å; Q191-Y195 PolarHBondContact O-N 3.2Å
196	G	91.3	Very high	94.1	Very high	20 Å²	20	67.4 Å²	67.4	21%	0.206	35%	0.349	C	S	.	.			trans	75	-143.2	-173.3	0	0	0	0	0	113.4	Q191 Y192	Q191-G196 PolarHBondContact O-N 2.83Å; Y192-G196 WeakPolarHBondContact O-CA 3.15Å; Y192-G196 PolarHBondContact O-N 2.9Å
197	F	87.1	Confident	94.1	Very high	110 Å²	110	69.5 Å²	69.5	48%	0.482	34%	0.344	S	S	.	.	S	Bend	trans	-117.1	-10.8	179.4	-61	-49.3	0	0	0	113.9	Y192 L232	Y192-F197 HydrophobicContact CD2-CD1 4.17Å; Y192-F197 AromaticContact CD2-CD2 3.99Å; Y192-F197 HydrophobicContact CD2-CD2 3.99Å; Y192-F197 AromaticContact CD2-CE1 3.67Å; Y192-F197 HydrophobicContact CD2-CE1 3.67Å; Y192-F197 AromaticContact CD2-CE2 3.47Å; Y192-F197 HydrophobicContact CD2-CE2 3.47Å; Y192-F197 VanDerWaalsContact CD2-CE2 3.47Å; Y192-F197 HydrophobicContact CD2-CG 4.32Å; Y192-F197 AromaticContact CD2-CZ 3.3Å; Y192-F197 HydrophobicContact CD2-CZ 3.3Å; Y192-F197 AromaticContact CE2-CD2 3.92Å; Y192-F197 HydrophobicContact CE2-CD2 3.92Å; Y192-F197 HydrophobicContact CE2-CE1 4.45Å; Y192-F197 AromaticContact CE2-CE2 3.4Å; Y192-F197 HydrophobicContact CE2-CE2 3.4Å; Y192-F197 VanDerWaalsContact CE2-CE2 3.4Å; Y192-F197 AromaticContact CE2-CZ 3.72Å; Y192-F197 HydrophobicContact CE2-CZ 3.72Å; Y192-F197 HydrophobicContact CG-CE1 4.39Å; Y192-F197 HydrophobicContact CG-CZ 4.13Å; F197-L232 HydrophobicContact CD1-CD2 3.51Å; F197-L232 HydrophobicContact CE1-CD2 3.53Å
198	E	90.5	Very high	94	Very high	147 Å²	147	72.9 Å²	72.9	69%	0.687	37%	0.372	S	S	*	.	S	Bend	trans	-144.2	126.7	-174.4	-179	-176.5	172.7	0	0	108.9	T225	E198-T225 HydrophobicContact CB-CG2 4.43Å; E198-T225 HydrophobicContact CG-CG2 4.31Å
199	L	90.8	Very high	94	Very high	23 Å²	23	74.1 Å²	74.1	12%	0.12	38%	0.382	C	S	.	.			trans	-89.8	111	-179.9	-173.4	56.3	0	0	0	109.7	F70 I218 P221 K224 T225	F70-L199 HydrophobicContact CE1-CD1 3.83Å; F70-L199 HydrophobicContact CE1-CD2 4.28Å; F70-L199 HydrophobicContact CZ-CD1 4Å; F70-L199 HydrophobicContact CZ-CD2 4.33Å; L199-I218 HydrophobicContact CD2-CG2 3.9Å; L199-I218 HydrophobicContact CG-CG2 4.26Å; L199-P221 WeakPolarHBondContact O-CB 3.16Å; L199-K224 HydrophobicContact CD2-CB 4.01Å; L199-K224 HydrophobicContact CD2-CD 4.38Å; L199-T225 WeakPolarHBondContact CB-OG1 3.3Å; L199-T225 PolarHBondContact N-OG1 3.31Å
200	K	91.9	Very high	94.1	Very high	152 Å²	152	71.8 Å²	71.8	66%	0.661	37%	0.368	S	S	*	.			trans	-64.3	145.1	179.4	-69.3	-173.6	177.4	-176.5	0	111.5	V202	K200-V202 VanDerWaalsContact C-N 3.27Å; K200-V202 PolarHBondContact O-N 2.85Å
201	P	93.7	Very high	94	Very high	77 Å²	77	74.6 Å²	74.6	50%	0.5	38%	0.382	S	S	.	.	S	Bend	trans	-72.2	-17.8	179.4	29.7	-36.4	0	0	0	114.1	F217 I218 P221	P201-F217 WeakPolarHBondContact O-CA 3.09Å; P201-I218 PolarHBondContact O-N 3.2Å; P201-P221 HydrophobicContact CB-CB 4.41Å; P201-P221 HydrophobicContact CB-CG 3.87Å
202	V	95.4	Very high	94	Very high	43 Å²	43	80.1 Å²	80.1	26%	0.261	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	135.7	-179.3	-174.7	0	0	0	0	110.1	K200 D215 C216 F217	K200-V202 VanDerWaalsContact C-N 3.27Å; K200-V202 PolarHBondContact O-N 2.85Å; V202-D215 HydrophobicContact CG1-CB 4.06Å; V202-C216 CarbonylContact C-O 3.57Å; V202-C216 WeakPolarHBondContact CA-O 3.5Å; V202-F217 HydrophobicContact CG2-CD1 3.87Å; V202-F217 HydrophobicContact CG2-CE1 3.78Å
203	Y	95.4	Very high	94.1	Very high	61 Å²	61	78.7 Å²	78.7	24%	0.239	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	122	173.4	178.4	-90.4	0	0	0	110	K68 A69 C205 C216	K68-Y203 WeakPolarHBondContact CD-OH 3.5Å; K68-Y203 VanDerWaalsContact CG-OH 3.28Å; K68-Y203 WeakPolarHBondContact CG-OH 3.49Å; K68-Y203 PolarHBondContact O-OH 2.71Å; A69-Y203 HydrophobicContact CB-CD1 4.08Å; A69-Y203 HydrophobicContact CB-CD2 3.91Å; A69-Y203 HydrophobicContact CB-CE1 4.01Å; A69-Y203 HydrophobicContact CB-CE2 3.83Å; A69-Y203 HydrophobicContact CB-CG 4.03Å; Y203-C205 HydrophobicContact CD1-CB 3.99Å; Y203-C205 HydrophobicContact CE1-CB 3.84Å; Y203-C216 PolarHBondContact N-O 2.57Å; Y203-C216 PolarHBondContact O-N 3.18Å
204	H	97	Very high	94.2	Very high	118 Å²	118	71 Å²	71	55%	0.546	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	121.4	178.5	-54.6	-68.8	0	0	0	110.3	T213 V214 D215	H204-T213 HydrophobicContact CB-CG2 3.91Å; H204-V214 WeakPolarHBondContact CA-O 3.46Å; H204-D215 IonicContact CE1-OD1 3.91Å; H204-D215 PolarHBondContact CE1-OD1 2.91Å; H204-D215 IonicContact CG-OD1 2.77Å; H204-D215 IonicContact ND1-OD1 3.78Å; H204-D215 PolarHBondContact ND1-OD1 2.77Å
205	C	97.1	Very high	94.5	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128.4	-170.6	-176.2	0	0	0	0	113.3	C65 Y203 T213 V214	C65-C205 WeakPolarHBondContact CA-SG 3.44Å; C65-C205 HydrophobicContact CB-CB 3.7Å; C65-C205 WeakPolarHBondContact CB-SG 2.95Å; C65-C205 WeakPolarHBondContact SG-CB 3.18Å; C65-C205 CovalentContact SG-SG 2.02Å; C65-C205 PolarHBondContact SG-SG 3.43Å; Y203-C205 HydrophobicContact CD1-CB 3.99Å; Y203-C205 HydrophobicContact CE1-CB 3.84Å; C205-T213 CarbonylContact O-C 3.58Å; C205-T213 VanDerWaalsContact O-CA 3.3Å; C205-T213 WeakPolarHBondContact O-CA 3.45Å; C205-V214 HydrophobicContact CB-CG2 4.08Å; C205-V214 PolarHBondContact N-O 3.05Å; C205-V214 PolarHBondContact O-N 2.97Å
206	S	96.7	Very high	94.8	Very high	75 Å²	75	68.3 Å²	68.3	52%	0.524	37%	0.366	S	S	.	.			trans	-128.6	38.2	-178.3	54.7	0	0	0	0	112.8
207	R	96.3	Very high	95	Very high	85 Å²	85	71.8 Å²	71.8	32%	0.321	38%	0.375	S	S	.	.			trans	-99	136.5	-178.3	-172.6	173.3	177.1	-174.3	4.5	110.2	V64 D67 K68 C210	V64-R207 HydrophobicContact CB-CG 4.24Å; V64-R207 HydrophobicContact CG2-CB 4.19Å; V64-R207 HydrophobicContact CG2-CG 4.14Å; V64-R207 WeakPolarHBondContact O-CD 3.33Å; V64-R207 PolarHBondContact O-NH1 3.1Å; D67-R207 IonicContact OD2-CZ 3.41Å; D67-R207 IonicContact OD2-NH1 2.77Å; D67-R207 PolarHBondContact OD2-NH1 2.92Å; D67-R207 IonicContact OD2-NH2 3.49Å; D67-R207 PolarHBondContact OD2-NH2 2.91Å; K68-R207 HydrophobicContact CD-CB 4.29Å; R207-C210 WeakPolarHBondContact O-CB 3.13Å; R207-C210 PolarHBondContact O-N 3.06Å; R207-C210 PolarHBondContact O-SG 3.46Å
208	S	95.4	Very high	95.3	Very high	101 Å²	101	67.3 Å²	67.3	71%	0.706	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	132.2	172	52.1	0	0	0	0	110.8
209	P	96.5	Very high	95.4	Very high	58 Å²	58	61.2 Å²	61.2	38%	0.377	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	cis	-93.9	10.3	18.8	37.4	-38	0	0	0	116.3	Q58 P59	Q58-P209 HydrophobicContact CG-CB 4.48Å; Q58-P209 HydrophobicContact CG-CG 4.49Å; Q58-P209 WeakPolarHBondContact CG-O 3.27Å; P59-P209 WeakPolarHBondContact O-CG 3.39Å
210	C	97.1	Very high	95.5	Very high	17 Å²	17	65 Å²	65	12%	0.115	34%	0.342	C	S	.	.			trans	-58.5	134.6	-177.7	-53.2	0	0	0	0	112.3	C61 C65 R207 H212 V214	C61-C210 VanDerWaalsContact CA-SG 3.51Å; C61-C210 HydrophobicContact CB-CB 4.06Å; C61-C210 WeakPolarHBondContact CB-SG 3.3Å; C61-C210 WeakPolarHBondContact SG-CB 3.33Å; C61-C210 CovalentContact SG-SG 2.03Å; C61-C210 PolarHBondContact SG-SG 3.14Å; C65-C210 PolarHBondContact SG-SG 3.22Å; R207-C210 WeakPolarHBondContact O-CB 3.13Å; R207-C210 PolarHBondContact O-N 3.06Å; R207-C210 PolarHBondContact O-SG 3.46Å; C210-H212 PolarHBondContact O-N 2.82Å; C210-V214 HydrophobicContact CB-CG2 4.47Å
211	P	95	Very high	95.6	Very high	81 Å²	81	59 Å²	59	53%	0.526	32%	0.319	S	S	.	.	S	Bend	trans	-78.9	-18.8	-170.8	30.4	-35.7	0	0	0	114.4	Q58	Q58-P211 HydrophobicContact CB-CG 4.47Å
212	H	95	Very high	95.6	Very high	121 Å²	121	60.3 Å²	60.3	56%	0.56	33%	0.326	S	S	*	.	S	Bend	trans	-155.9	-174.4	175.3	51.7	-94.3	0	0	0	108.5	C210 V214	C210-H212 PolarHBondContact O-N 2.82Å; H212-V214 PolarHBondContact O-N 3.18Å; H212-V214 VanDerWaalsContact O-N 3.11Å
213	T	96.8	Very high	95.4	Very high	84 Å²	84	60.8 Å²	60.8	52%	0.515	33%	0.325	S	S	.	.			trans	-69.5	104.4	170.6	-54.9	0	0	0	0	109.5	H204 C205	H204-T213 HydrophobicContact CB-CG2 3.91Å; C205-T213 CarbonylContact O-C 3.58Å; C205-T213 VanDerWaalsContact O-CA 3.3Å; C205-T213 WeakPolarHBondContact O-CA 3.45Å
214	V	97.3	Very high	95.3	Very high	2 Å²	2	58.1 Å²	58.1	1%	0.012	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	150.8	179	-59.6	0	0	0	0	111.2	C54 T56 H204 C205 C210 H212	C54-V214 HydrophobicContact CB-CG2 4.43Å; T56-V214 HydrophobicContact CG2-CG1 4.4Å; H204-V214 WeakPolarHBondContact CA-O 3.46Å; C205-V214 HydrophobicContact CB-CG2 4.08Å; C205-V214 PolarHBondContact N-O 3.05Å; C205-V214 PolarHBondContact O-N 2.97Å; C210-V214 HydrophobicContact CB-CG2 4.47Å; H212-V214 PolarHBondContact O-N 3.18Å; H212-V214 VanDerWaalsContact O-N 3.11Å
215	D	97.4	Very high	95.1	Very high	60 Å²	60	53.2 Å²	53.2	32%	0.321	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	123.8	172.9	-69.7	-6.6	0	0	0	109.5	N55 V202 H204	N55-D215 PolarHBondContact N-O 2.87Å; V202-D215 HydrophobicContact CG1-CB 4.06Å; H204-D215 IonicContact CE1-OD1 3.91Å; H204-D215 PolarHBondContact CE1-OD1 2.91Å; H204-D215 IonicContact CG-OD1 2.77Å; H204-D215 IonicContact ND1-OD1 3.78Å; H204-D215 PolarHBondContact ND1-OD1 2.77Å
216	C	96.8	Very high	95	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	136.2	175.4	-53.7	0	0	0	0	111	F52 T53 C54 V202 Y203	F52-C216 HydrophobicContact CE1-CB 3.93Å; F52-C216 HydrophobicContact CE2-CB 3.94Å; F52-C216 HydrophobicContact CZ-CB 3.43Å; F52-C216 VanDerWaalsContact CZ-CB 3.43Å; T53-C216 CarbonylContact O-C 3.53Å; T53-C216 WeakPolarHBondContact O-CA 3.33Å; C54-C216 HydrophobicContact CB-CB 4.07Å; C54-C216 WeakPolarHBondContact CB-SG 3.41Å; C54-C216 WeakPolarHBondContact SG-CB 3.45Å; C54-C216 CovalentContact SG-SG 2.04Å; C54-C216 PolarHBondContact SG-SG 3.17Å; V202-C216 CarbonylContact C-O 3.57Å; V202-C216 WeakPolarHBondContact CA-O 3.5Å; Y203-C216 PolarHBondContact N-O 2.57Å; Y203-C216 PolarHBondContact O-N 3.18Å
217	F	95.9	Very high	94.8	Very high	92 Å²	92	57.6 Å²	57.6	40%	0.404	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	133.1	-175.5	-58.9	-81.8	0	0	0	110.6	F52 T53 N55 P201 V202	F52-F217 WeakPolarHBondContact CA-O 3.25Å; T53-F217 PolarHBondContact N-O 3.13Å; T53-F217 PolarHBondContact O-N 3.27Å; N55-F217 HydrophobicContact CB-CE2 4.48Å; P201-F217 WeakPolarHBondContact O-CA 3.09Å; V202-F217 HydrophobicContact CG2-CD1 3.87Å; V202-F217 HydrophobicContact CG2-CE1 3.78Å
218	I	94.3	Very high	94.6	Very high	17 Å²	17	53.8 Å²	53.8	9%	0.087	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-92.7	123.6	179	-64.1	68	0	0	0	108.2	F52 F70 L199 P201 P221	F52-I218 HydrophobicContact CD2-CG1 4.43Å; F52-I218 HydrophobicContact CE2-CD1 4.39Å; F52-I218 HydrophobicContact CE2-CG1 4.38Å; F70-I218 HydrophobicContact CE2-CG1 4.11Å; F70-I218 HydrophobicContact CZ-CG1 3.85Å; F70-I218 HydrophobicContact CZ-CG2 4.04Å; L199-I218 HydrophobicContact CD2-CG2 3.9Å; L199-I218 HydrophobicContact CG-CG2 4.26Å; P201-I218 PolarHBondContact O-N 3.2Å; I218-P221 HydrophobicContact CG2-CB 4.48Å; I218-P221 WeakPolarHBondContact O-CD 3.06Å
219	S	92.6	Very high	94.5	Very high	18 Å²	18	53 Å²	53	13%	0.126	28%	0.28	C	S	.	.	S	Bend	trans	-59.3	137	170.4	170.8	0	0	0	0	111.7	D47 D51 K224	D47-S219 PolarHBondContact OD1-OG 3.41Å; D47-S219 PolarHBondContact OD2-OG 3.16Å; D51-S219 VanDerWaalsContact CB-CB 3.48Å; S219-K224 VanDerWaalsContact O-CD 3.3Å; S219-K224 WeakPolarHBondContact O-CD 3.36Å; S219-K224 WeakPolarHBondContact O-CE 3.4Å; S219-K224 PolarHBondContact O-NZ 3.4Å
220	R	92.4	Very high	94.3	Very high	103 Å²	103	53.4 Å²	53.4	39%	0.389	28%	0.276	S	S	.	.	S	Bend	trans	51.3	49.1	171.3	-62	166.1	-174.7	-93	5.8	115.3	D47 T222 E223 K224	D47-R220 VanDerWaalsContact OD2-CD 3.24Å; D47-R220 WeakPolarHBondContact OD2-CD 2.94Å; D47-R220 IonicContact OD2-CZ 2.66Å; D47-R220 IonicContact OD2-NE 3.14Å; D47-R220 PolarHBondContact OD2-NE 3.35Å; D47-R220 IonicContact OD2-NH2 2.74Å; R220-T222 PolarHBondContact O-N 2.85Å; R220-E223 HydrophobicContact CB-CB 4.03Å; R220-E223 VanDerWaalsContact CD-OE2 3.23Å; R220-E223 WeakPolarHBondContact CD-OE2 3.39Å; R220-E223 VanDerWaalsContact CG-OE2 3.29Å; R220-E223 WeakPolarHBondContact CG-OE2 3.43Å; R220-E223 IonicContact CZ-OE2 3.58Å; R220-E223 IonicContact NE-OE2 3.87Å; R220-E223 IonicContact NH1-OE1 2.7Å; R220-E223 IonicContact NH1-OE2 3.72Å; R220-E223 PolarHBondContact NH1-OE2 3.04Å; R220-E223 PolarHBondContact O-N 3.47Å; R220-K224 HydrophobicContact CB-CD 4.35Å; R220-K224 HydrophobicContact CB-CG 4.49Å; R220-K224 WeakPolarHBondContact O-CB 3.3Å; R220-K224 VanDerWaalsContact O-CG 3.29Å; R220-K224 WeakPolarHBondContact O-CG 3.02Å; R220-K224 PolarHBondContact O-N 3.01Å
221	P	93.8	Very high	94.1	Very high	25 Å²	25	52.7 Å²	52.7	16%	0.162	27%	0.271	C	S	.	.	H	α-helix	trans	-68.8	-34.9	-170.3	28.2	-31.7	0	0	0	112.5	L199 P201 I218 T225	L199-P221 WeakPolarHBondContact O-CB 3.16Å; P201-P221 HydrophobicContact CB-CB 4.41Å; P201-P221 HydrophobicContact CB-CG 3.87Å; I218-P221 HydrophobicContact CG2-CB 4.48Å; I218-P221 WeakPolarHBondContact O-CD 3.06Å; P221-T225 VanDerWaalsContact O-CB 3.23Å; P221-T225 WeakPolarHBondContact O-CB 3.38Å; P221-T225 PolarHBondContact O-N 3.3Å; P221-T225 PolarHBondContact O-OG1 3.22Å
222	T	93.1	Very high	94	Very high	106 Å²	106	50.3 Å²	50.3	65%	0.65	25%	0.254	S	S	*	.	H	α-helix	trans	-68.6	-46.5	175.5	46.1	0	0	0	0	112.2	R220 T225 I226	R220-T222 PolarHBondContact O-N 2.85Å; T222-T225 WeakPolarHBondContact O-CB 3.4Å; T222-T225 PolarHBondContact O-N 3.29Å; T222-I226 WeakPolarHBondContact O-CG1 3.28Å; T222-I226 PolarHBondContact O-N 3.02Å
223	E	92.6	Very high	94	Very high	52 Å²	52	48.3 Å²	48.3	24%	0.243	25%	0.25	C	C	.	.	H	α-helix	trans	-60.6	-52	177.2	-165	179.1	173.9	0	0	110.7	V44 R220 T225 I226 F227	V44-E223 HydrophobicContact CG1-CB 4.5Å; V44-E223 HydrophobicContact CG1-CG 3.92Å; R220-E223 HydrophobicContact CB-CB 4.03Å; R220-E223 VanDerWaalsContact CD-OE2 3.23Å; R220-E223 WeakPolarHBondContact CD-OE2 3.39Å; R220-E223 VanDerWaalsContact CG-OE2 3.29Å; R220-E223 WeakPolarHBondContact CG-OE2 3.43Å; R220-E223 IonicContact CZ-OE2 3.58Å; R220-E223 IonicContact NE-OE2 3.87Å; R220-E223 IonicContact NH1-OE1 2.7Å; R220-E223 IonicContact NH1-OE2 3.72Å; R220-E223 PolarHBondContact NH1-OE2 3.04Å; R220-E223 PolarHBondContact O-N 3.47Å; E223-T225 VanDerWaalsContact C-N 3.28Å; E223-T225 PolarHBondContact O-N 3.08Å; E223-I226 WeakPolarHBondContact O-CB 3.38Å; E223-I226 PolarHBondContact O-N 3Å; E223-I226 VanDerWaalsContact O-N 3.08Å; E223-F227 HydrophobicContact CG-CE2 4.19Å; E223-F227 VanDerWaalsContact O-CD2 3.29Å; E223-F227 WeakPolarHBondContact O-CD2 3.32Å; E223-F227 PolarHBondContact O-N 3.37Å
224	K	92.8	Very high	93.8	Very high	5 Å²	5	44.7 Å²	44.7	2%	0.022	23%	0.228	C	C	.	.	H	α-helix	trans	-56.7	-41.9	174.8	-70.1	167.8	-176.8	159.1	0	110.9	V44 W45 D47 L199 S219 R220 F227 I228	V44-K224 HydrophobicContact CG1-CG 3.83Å; V44-K224 WeakPolarHBondContact O-CE 3.14Å; V44-K224 PolarHBondContact O-NZ 2.91Å; W45-K224 HydrophobicContact CD2-CG 4.4Å; W45-K224 HydrophobicContact CZ2-CB 4.03Å; W45-K224 HydrophobicContact CZ2-CG 3.9Å; D47-K224 IonicContact OD1-NZ 3.18Å; D47-K224 PolarHBondContact OD1-NZ 3.41Å; L199-K224 HydrophobicContact CD2-CB 4.01Å; L199-K224 HydrophobicContact CD2-CD 4.38Å; S219-K224 VanDerWaalsContact O-CD 3.3Å; S219-K224 WeakPolarHBondContact O-CD 3.36Å; S219-K224 WeakPolarHBondContact O-CE 3.4Å; S219-K224 PolarHBondContact O-NZ 3.4Å; R220-K224 HydrophobicContact CB-CD 4.35Å; R220-K224 HydrophobicContact CB-CG 4.49Å; R220-K224 WeakPolarHBondContact O-CB 3.3Å; R220-K224 VanDerWaalsContact O-CG 3.29Å; R220-K224 WeakPolarHBondContact O-CG 3.02Å; R220-K224 PolarHBondContact O-N 3.01Å; K224-F227 PolarHBondContact O-N 3.25Å; K224-I228 WeakPolarHBondContact O-CB 3.19Å; K224-I228 VanDerWaalsContact O-CD1 3.32Å; K224-I228 WeakPolarHBondContact O-CD1 3.4Å; K224-I228 WeakPolarHBondContact O-CG1 3.29Å; K224-I228 PolarHBondContact O-N 2.82Å
225	T	93.4	Very high	93.6	Very high	16 Å²	16	44.7 Å²	44.7	10%	0.098	23%	0.228	C	C	.	.	H	α-helix	trans	-62.1	-41	175.1	-64.3	0	0	0	0	113.3	E198 L199 P221 T222 E223 F227 I228 I229	E198-T225 HydrophobicContact CB-CG2 4.43Å; E198-T225 HydrophobicContact CG-CG2 4.31Å; L199-T225 WeakPolarHBondContact CB-OG1 3.3Å; L199-T225 PolarHBondContact N-OG1 3.31Å; P221-T225 VanDerWaalsContact O-CB 3.23Å; P221-T225 WeakPolarHBondContact O-CB 3.38Å; P221-T225 PolarHBondContact O-N 3.3Å; P221-T225 PolarHBondContact O-OG1 3.22Å; T222-T225 WeakPolarHBondContact O-CB 3.4Å; T222-T225 PolarHBondContact O-N 3.29Å; E223-T225 VanDerWaalsContact C-N 3.28Å; E223-T225 PolarHBondContact O-N 3.08Å; T225-F227 PolarHBondContact O-N 3.38Å; T225-I228 PolarHBondContact O-N 2.73Å; T225-I229 HydrophobicContact CG2-CD1 3.71Å; T225-I229 HydrophobicContact CG2-CG1 4.27Å; T225-I229 WeakPolarHBondContact O-CG1 3.35Å; T225-I229 PolarHBondContact O-N 2.79Å
226	I	93.5	Very high	93.4	Very high	114 Å²	114	44 Å²	44	59%	0.585	23%	0.228	S	C	*	.	H	α-helix	trans	-59.3	-47.1	176.6	-70.5	161.4	0	0	0	110.5	T222 E223 I229 F230	T222-I226 WeakPolarHBondContact O-CG1 3.28Å; T222-I226 PolarHBondContact O-N 3.02Å; E223-I226 WeakPolarHBondContact O-CB 3.38Å; E223-I226 PolarHBondContact O-N 3Å; E223-I226 VanDerWaalsContact O-N 3.08Å; I226-I229 PolarHBondContact O-N 3.1Å; I226-F230 VanDerWaalsContact O-CB 3.24Å; I226-F230 WeakPolarHBondContact O-CB 3.48Å; I226-F230 PolarHBondContact O-N 3.14Å
227	F	92.6	Very high	93.2	Very high	53 Å²	53	46.2 Å²	46.2	23%	0.232	24%	0.241	C	C	.	.	H	α-helix	trans	-66.7	-36.6	176.4	-74	-75.9	0	0	0	112.9	V36 A40 V44 W45 W78 E223 K224 T225 F230 M231	V36-F227 HydrophobicContact CG1-CD1 3.87Å; V36-F227 HydrophobicContact CG1-CE1 4.04Å; A40-F227 HydrophobicContact CB-CD1 3.9Å; A40-F227 HydrophobicContact CB-CE1 3.63Å; A40-F227 HydrophobicContact CB-CE2 4.35Å; A40-F227 HydrophobicContact CB-CG 4.37Å; A40-F227 HydrophobicContact CB-CZ 3.88Å; V44-F227 HydrophobicContact CB-CE2 4.48Å; V44-F227 HydrophobicContact CG1-CD2 4.06Å; V44-F227 HydrophobicContact CG1-CE2 4.22Å; V44-F227 HydrophobicContact CG2-CD2 4.19Å; V44-F227 HydrophobicContact CG2-CE2 3.61Å; V44-F227 HydrophobicContact CG2-CZ 4.15Å; W45-F227 HydrophobicContact CH2-CB 3.67Å; W45-F227 HydrophobicContact CH2-CD2 4.47Å; W45-F227 HydrophobicContact CH2-CG 4.24Å; W45-F227 HydrophobicContact CZ3-CB 4.35Å; W45-F227 HydrophobicContact CZ3-CG 4.49Å; W78-F227 HydrophobicContact CH2-CB 4.46Å; E223-F227 HydrophobicContact CG-CE2 4.19Å; E223-F227 VanDerWaalsContact O-CD2 3.29Å; E223-F227 WeakPolarHBondContact O-CD2 3.32Å; E223-F227 PolarHBondContact O-N 3.37Å; K224-F227 PolarHBondContact O-N 3.25Å; T225-F227 PolarHBondContact O-N 3.38Å; F227-F230 PolarHBondContact O-N 2.83Å; F227-M231 WeakPolarHBondContact O-CB 3.44Å; F227-M231 VanDerWaalsContact O-CG 3.3Å; F227-M231 WeakPolarHBondContact O-CG 3.37Å; F227-M231 PolarHBondContact O-N 3.48Å
228	I	92.8	Very high	93	Very high	4 Å²	4	42 Å²	42	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-47.6	174.9	-71.7	160.9	0	0	0	111.5	H74 W78 K224 T225 L232	H74-I228 VanDerWaalsContact NE2-CD1 3.32Å; H74-I228 WeakPolarHBondContact NE2-CD1 3.33Å; W78-I228 HydrophobicContact CH2-CG1 4.01Å; W78-I228 HydrophobicContact CZ2-CB 4.43Å; W78-I228 HydrophobicContact CZ2-CG1 3.83Å; K224-I228 WeakPolarHBondContact O-CB 3.19Å; K224-I228 VanDerWaalsContact O-CD1 3.32Å; K224-I228 WeakPolarHBondContact O-CD1 3.4Å; K224-I228 WeakPolarHBondContact O-CG1 3.29Å; K224-I228 PolarHBondContact O-N 2.82Å; T225-I228 PolarHBondContact O-N 2.73Å; I228-L232 WeakPolarHBondContact O-CB 3.34Å; I228-L232 PolarHBondContact O-N 3.08Å
229	I	93.4	Very high	92.9	Very high	84 Å²	84	43 Å²	43	43%	0.431	23%	0.228	S	C	.	.	H	α-helix	trans	-65.3	-44.3	177.2	-67.7	169.8	0	0	0	110.4	T225 I226 L232 V233	T225-I229 HydrophobicContact CG2-CD1 3.71Å; T225-I229 HydrophobicContact CG2-CG1 4.27Å; T225-I229 WeakPolarHBondContact O-CG1 3.35Å; T225-I229 PolarHBondContact O-N 2.79Å; I226-I229 PolarHBondContact O-N 3.1Å; I229-L232 WeakPolarHBondContact O-CB 3.25Å; I229-L232 PolarHBondContact O-N 3.22Å; I229-V233 WeakPolarHBondContact O-CG2 2.97Å; I229-V233 PolarHBondContact O-N 2.86Å
230	F	92.4	Very high	92.9	Very high	67 Å²	67	47.2 Å²	47.2	29%	0.294	25%	0.249	S	C	.	.	H	α-helix	trans	-58.8	-49.5	177.1	172.7	-83.6	0	0	0	111.9	F32 V36 I226 F227 L232 V233 V234	F32-F230 AromaticContact CD1-CZ 3.97Å; F32-F230 HydrophobicContact CD1-CZ 3.97Å; F32-F230 HydrophobicContact CE1-CE1 4.2Å; F32-F230 AromaticContact CE1-CE2 3.79Å; F32-F230 HydrophobicContact CE1-CE2 3.79Å; F32-F230 AromaticContact CE1-CZ 3.26Å; F32-F230 HydrophobicContact CE1-CZ 3.26Å; F32-F230 HydrophobicContact CE2-CZ 4.23Å; F32-F230 AromaticContact CZ-CE2 3.83Å; F32-F230 HydrophobicContact CZ-CE2 3.83Å; F32-F230 AromaticContact CZ-CZ 3.43Å; F32-F230 HydrophobicContact CZ-CZ 3.43Å; F32-F230 VanDerWaalsContact CZ-CZ 3.43Å; V36-F230 HydrophobicContact CB-CE1 4.02Å; V36-F230 HydrophobicContact CG1-CD1 4.18Å; V36-F230 HydrophobicContact CG1-CE1 3.78Å; V36-F230 HydrophobicContact CG2-CE1 3.68Å; V36-F230 HydrophobicContact CG2-CZ 3.78Å; I226-F230 VanDerWaalsContact O-CB 3.24Å; I226-F230 WeakPolarHBondContact O-CB 3.48Å; I226-F230 PolarHBondContact O-N 3.14Å; F227-F230 PolarHBondContact O-N 2.83Å; F230-L232 VanDerWaalsContact C-N 3.3Å; F230-L232 PolarHBondContact O-N 3.28Å; F230-V233 PolarHBondContact O-N 2.94Å; F230-V233 VanDerWaalsContact O-N 3.1Å; F230-V234 HydrophobicContact CD1-CG2 4.36Å; F230-V234 HydrophobicContact CE1-CG2 4.03Å; F230-V234 HydrophobicContact CZ-CG2 4.27Å; F230-V234 WeakPolarHBondContact O-CG2 3.23Å; F230-V234 PolarHBondContact O-N 2.86Å
231	M	92.1	Very high	92.8	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-63.6	-36.1	178.6	-73.9	-65.5	-71.5	0	0	111.7	R33 V36 L37 W78 F227 V234 A235	R33-M231 HydrophobicContact CB-CE 4.18Å; R33-M231 HydrophobicContact CG-CE 3.99Å; R33-M231 HydrophobicContact CG-SD 4.23Å; V36-M231 HydrophobicContact CG1-SD 4.48Å; L37-M231 HydrophobicContact CD1-CE 3.44Å; L37-M231 VanDerWaalsContact CD1-CE 3.44Å; L37-M231 HydrophobicContact CD1-SD 4.18Å; W78-M231 HydrophobicContact CB-CE 4.01Å; W78-M231 HydrophobicContact CD2-CB 4.47Å; W78-M231 HydrophobicContact CD2-CE 4.02Å; W78-M231 HydrophobicContact CD2-CG 4.15Å; W78-M231 HydrophobicContact CE3-CE 4.43Å; W78-M231 HydrophobicContact CE3-CG 4.3Å; W78-M231 HydrophobicContact CG-CE 3.81Å; W78-M231 HydrophobicContact CH2-CG 4.26Å; W78-M231 HydrophobicContact CZ2-CB 4.07Å; W78-M231 HydrophobicContact CZ2-CG 4.11Å; W78-M231 HydrophobicContact CZ3-CG 4.35Å; F227-M231 WeakPolarHBondContact O-CB 3.44Å; F227-M231 VanDerWaalsContact O-CG 3.3Å; F227-M231 WeakPolarHBondContact O-CG 3.37Å; F227-M231 PolarHBondContact O-N 3.48Å; M231-V234 PolarHBondContact O-N 3.31Å; M231-A235 WeakPolarHBondContact O-CB 3.3Å; M231-A235 PolarHBondContact O-N 3.32Å
232	L	93.4	Very high	92.6	Very high	32 Å²	32	42.3 Å²	42.3	17%	0.168	23%	0.229	C	C	.	.	H	α-helix	trans	-64.8	-37.1	172.2	176.7	63.1	0	0	0	112.9	I188 F197 I228 I229 F230 A235 S236	I188-L232 HydrophobicContact CG1-CD1 4.24Å; I188-L232 HydrophobicContact CG2-CD1 3.88Å; F197-L232 HydrophobicContact CD1-CD2 3.51Å; F197-L232 HydrophobicContact CE1-CD2 3.53Å; I228-L232 WeakPolarHBondContact O-CB 3.34Å; I228-L232 PolarHBondContact O-N 3.08Å; I229-L232 WeakPolarHBondContact O-CB 3.25Å; I229-L232 PolarHBondContact O-N 3.22Å; F230-L232 VanDerWaalsContact C-N 3.3Å; F230-L232 PolarHBondContact O-N 3.28Å; L232-A235 WeakPolarHBondContact O-CB 3.41Å; L232-A235 PolarHBondContact O-N 3.03Å; L232-S236 PolarHBondContact O-N 2.84Å; L232-S236 PolarHBondContact O-OG 3.31Å
233	V	94	Very high	92.4	Very high	78 Å²	78	41.8 Å²	41.8	47%	0.473	22%	0.22	S	C	.	.	H	α-helix	trans	-67.1	-44.5	173.4	171.8	0	0	0	0	110.6	I229 F230 A235 S236 V237	I229-V233 WeakPolarHBondContact O-CG2 2.97Å; I229-V233 PolarHBondContact O-N 2.86Å; F230-V233 PolarHBondContact O-N 2.94Å; F230-V233 VanDerWaalsContact O-N 3.1Å; V233-A235 PolarHBondContact O-N 3.28Å; V233-S236 PolarHBondContact O-N 3.38Å; V233-S236 PolarHBondContact O-OG 3.34Å; V233-S236 VanDerWaalsContact O-OG 3.08Å; V233-V237 HydrophobicContact CG1-CG2 4.34Å; V233-V237 WeakPolarHBondContact O-CG2 3.36Å; V233-V237 PolarHBondContact O-N 2.96Å
234	V	92.8	Very high	92.3	Very high	9 Å²	9	44.4 Å²	44.4	6%	0.055	24%	0.235	C	C	.	.	H	α-helix	trans	-67.8	-23.4	175.5	-174.4	0	0	0	0	111.9	L29 F32 R33 F230 M231 S238	L29-V234 HydrophobicContact CB-CG1 4.18Å; L29-V234 HydrophobicContact CD2-CG1 3.98Å; F32-V234 HydrophobicContact CD1-CG1 4.48Å; F32-V234 HydrophobicContact CD1-CG2 4.01Å; F32-V234 HydrophobicContact CE1-CG2 4.14Å; R33-V234 HydrophobicContact CG-CB 4.43Å; R33-V234 HydrophobicContact CG-CG1 3.63Å; R33-V234 PolarHBondContact NH2-O 3.24Å; F230-V234 HydrophobicContact CD1-CG2 4.36Å; F230-V234 HydrophobicContact CE1-CG2 4.03Å; F230-V234 HydrophobicContact CZ-CG2 4.27Å; F230-V234 WeakPolarHBondContact O-CG2 3.23Å; F230-V234 PolarHBondContact O-N 2.86Å; M231-V234 PolarHBondContact O-N 3.31Å; V234-S238 WeakPolarHBondContact O-CB 3.47Å; V234-S238 PolarHBondContact O-N 3.1Å
235	A	92.9	Very high	92	Very high	2 Å²	2	44.9 Å²	44.9	2%	0.017	24%	0.237	C	C	.	.	H	α-helix	trans	-72.9	-50.7	169.3	0	0	0	0	0	112.4	I188 M231 L232 V233 S238 L239	I188-A235 HydrophobicContact CD1-CB 3.86Å; I188-A235 HydrophobicContact CG1-CB 3.76Å; M231-A235 WeakPolarHBondContact O-CB 3.3Å; M231-A235 PolarHBondContact O-N 3.32Å; L232-A235 WeakPolarHBondContact O-CB 3.41Å; L232-A235 PolarHBondContact O-N 3.03Å; V233-A235 PolarHBondContact O-N 3.28Å; A235-S238 PolarHBondContact O-N 3.38Å; A235-L239 PolarHBondContact O-N 3.48Å
236	S	93.9	Very high	91.7	Very high	45 Å²	45	46.9 Å²	46.9	32%	0.315	25%	0.247	S	C	.	.	H	α-helix	trans	-66.9	-37.1	-178.9	62.4	0	0	0	0	113.1	L232 V233 L239 L240	L232-S236 PolarHBondContact O-N 2.84Å; L232-S236 PolarHBondContact O-OG 3.31Å; V233-S236 PolarHBondContact O-N 3.38Å; V233-S236 PolarHBondContact O-OG 3.34Å; V233-S236 VanDerWaalsContact O-OG 3.08Å; S236-L239 WeakPolarHBondContact O-CB 3.43Å; S236-L239 PolarHBondContact O-N 2.03Å; S236-L240 WeakPolarHBondContact O-CB 3.12Å; S236-L240 VanDerWaalsContact O-CG 3.31Å; S236-L240 WeakPolarHBondContact O-CG 3.07Å; S236-L240 PolarHBondContact O-N 3.39Å
237	V	93	Very high	91.4	Very high	47 Å²	47	48.3 Å²	48.3	29%	0.285	25%	0.246	S	C	.	.	H	α-helix	trans	-65.9	-40.9	174.2	176.7	0	0	0	0	111.4	L29 V233 L240 L241	L29-V237 HydrophobicContact CD1-CB 4.49Å; L29-V237 HydrophobicContact CD1-CG1 3.84Å; L29-V237 HydrophobicContact CD2-CG1 4.36Å; V233-V237 HydrophobicContact CG1-CG2 4.34Å; V233-V237 WeakPolarHBondContact O-CG2 3.36Å; V233-V237 PolarHBondContact O-N 2.96Å; V237-L240 PolarHBondContact O-N 2.02Å; V237-L241 HydrophobicContact CG1-CD1 4.08Å; V237-L241 WeakPolarHBondContact O-CD1 3.48Å; V237-L241 VanDerWaalsContact O-CG 3.32Å; V237-L241 WeakPolarHBondContact O-CG 3.5Å; V237-L241 PolarHBondContact O-N 3.21Å
238	S	91.1	Very high	91.1	Very high	4 Å²	4	49.6 Å²	49.6	3%	0.028	25%	0.253	C	S	.	.	H	α-helix	trans	-60.4	-46.5	171.8	171.4	0	0	0	0	111.5	E184 V234 A235 L240 L241 N242	E184-S238 WeakPolarHBondContact OE2-CB 3.12Å; E184-S238 PolarHBondContact OE2-OG 3.37Å; V234-S238 WeakPolarHBondContact O-CB 3.47Å; V234-S238 PolarHBondContact O-N 3.1Å; A235-S238 PolarHBondContact O-N 3.38Å; S238-L240 PolarHBondContact O-N 3.15Å; S238-L241 PolarHBondContact O-N 2.98Å; S238-N242 PolarHBondContact O-N 2.88Å; S238-N242 PolarHBondContact O-ND2 2.91Å; S238-N242 PolarHBondContact OG-ND2 2.87Å
239	L	92.6	Very high	90.6	Very high	36 Å²	36	51.2 Å²	51.2	19%	0.188	26%	0.261	C	S	.	.	H	α-helix	trans	-57.4	-47.3	177.1	178.1	59.2	0	0	0	111.8	T181 E184 V185 I188 A235 S236 L241 N242 M243	T181-L239 HydrophobicContact CG2-CD1 3.84Å; E184-L239 HydrophobicContact CG-CB 4.13Å; V185-L239 HydrophobicContact CG2-CD1 3.64Å; V185-L239 HydrophobicContact CG2-CD2 3.75Å; V185-L239 HydrophobicContact CG2-CG 4.37Å; I188-L239 HydrophobicContact CD1-CD2 4.04Å; A235-L239 PolarHBondContact O-N 3.48Å; S236-L239 WeakPolarHBondContact O-CB 3.43Å; S236-L239 PolarHBondContact O-N 2.03Å; L239-L241 VanDerWaalsContact C-N 3.34Å; L239-L241 PolarHBondContact O-N 3.13Å; L239-N242 PolarHBondContact O-N 2.85Å; L239-M243 HydrophobicContact CD1-CG 4.38Å; L239-M243 WeakPolarHBondContact O-CB 3.32Å; L239-M243 WeakPolarHBondContact O-CG 3.15Å; L239-M243 PolarHBondContact O-N 3.42Å
240	L	92.4	Very high	90.1	Very high	108 Å²	108	49.1 Å²	49.1	57%	0.565	26%	0.26	S	S	*	.	H	α-helix	trans	-60.4	-41.3	176.5	-72.8	169.6	0	0	0	112	S236 V237 S238 M243 L244	S236-L240 WeakPolarHBondContact O-CB 3.12Å; S236-L240 VanDerWaalsContact O-CG 3.31Å; S236-L240 WeakPolarHBondContact O-CG 3.07Å; S236-L240 PolarHBondContact O-N 3.39Å; V237-L240 PolarHBondContact O-N 2.02Å; S238-L240 PolarHBondContact O-N 3.15Å; L240-M243 PolarHBondContact O-N 2.88Å; L240-L244 WeakPolarHBondContact O-CB 3.24Å; L240-L244 VanDerWaalsContact O-CG 3.27Å; L240-L244 WeakPolarHBondContact O-CG 3.35Å; L240-L244 PolarHBondContact O-N 3.22Å
241	L	89.8	Confident	89.6	Confident	23 Å²	23	52.6 Å²	52.6	12%	0.12	27%	0.272	C	S	.	.	H	α-helix	trans	-66.5	-42.7	176.5	-71.9	162.9	0	0	0	112.6	W25 L26 L29 V237 S238 L239 M243 L244 E245	W25-L241 HydrophobicContact CB-CD1 3.61Å; W25-L241 HydrophobicContact CB-CD2 4.29Å; W25-L241 HydrophobicContact CE3-CD1 4.31Å; W25-L241 HydrophobicContact CG-CD1 4.29Å; L26-L241 HydrophobicContact CD2-CB 3.92Å; L26-L241 HydrophobicContact CD2-CD1 4.19Å; L29-L241 HydrophobicContact CD1-CD1 3.43Å; L29-L241 VanDerWaalsContact CD1-CD1 3.43Å; V237-L241 HydrophobicContact CG1-CD1 4.08Å; V237-L241 WeakPolarHBondContact O-CD1 3.48Å; V237-L241 VanDerWaalsContact O-CG 3.32Å; V237-L241 WeakPolarHBondContact O-CG 3.5Å; V237-L241 PolarHBondContact O-N 3.21Å; S238-L241 PolarHBondContact O-N 2.98Å; L239-L241 VanDerWaalsContact C-N 3.34Å; L239-L241 PolarHBondContact O-N 3.13Å; L241-M243 VanDerWaalsContact C-N 3.29Å; L241-M243 PolarHBondContact O-N 3.47Å; L241-L244 PolarHBondContact O-N 3.49Å; L241-E245 WeakPolarHBondContact O-CB 3.44Å; L241-E245 PolarHBondContact O-N 3.43Å
242	N	89.5	Confident	89	Confident	1 Å²	1	58 Å²	58	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-60.7	-40.5	174.5	-58.3	-40.5	0	0	0	110.7	L26 I177 K180 S238 L239 E245 I246	L26-N242 WeakPolarHBondContact CD1-OD1 3.33Å; I177-N242 HydrophobicContact CG2-CB 3.97Å; K180-N242 WeakPolarHBondContact CE-OD1 3.35Å; K180-N242 PolarHBondContact NZ-OD1 3.07Å; S238-N242 PolarHBondContact O-N 2.88Å; S238-N242 PolarHBondContact O-ND2 2.91Å; S238-N242 PolarHBondContact OG-ND2 2.87Å; L239-N242 PolarHBondContact O-N 2.85Å; N242-E245 PolarHBondContact O-N 2.84Å; N242-I246 WeakPolarHBondContact O-CG1 3.41Å; N242-I246 PolarHBondContact O-N 3.17Å
243	M	90.3	Very high	88.3	Confident	95 Å²	95	62.1 Å²	62.1	47%	0.468	31%	0.311	S	S	.	.	H	α-helix	trans	-68.3	-40.5	176	-74.5	-60.9	-63.7	0	0	113.2	T181 L239 L240 L241 E245 I246 Y247	T181-M243 HydrophobicContact CG2-SD 4.02Å; L239-M243 HydrophobicContact CD1-CG 4.38Å; L239-M243 WeakPolarHBondContact O-CB 3.32Å; L239-M243 WeakPolarHBondContact O-CG 3.15Å; L239-M243 PolarHBondContact O-N 3.42Å; L240-M243 PolarHBondContact O-N 2.88Å; L241-M243 VanDerWaalsContact C-N 3.29Å; L241-M243 PolarHBondContact O-N 3.47Å; M243-E245 VanDerWaalsContact C-N 3.33Å; M243-I246 PolarHBondContact O-N 3.31Å; M243-I246 HydrophobicContact SD-CD1 4.46Å; M243-Y247 WeakPolarHBondContact O-CB 3.3Å; M243-Y247 PolarHBondContact O-N 3.43Å
244	L	90.1	Very high	87.4	Confident	107 Å²	107	63.5 Å²	63.5	56%	0.56	32%	0.316	S	S	*	.	H	α-helix	trans	-65	-36.4	174.3	-75.1	168.6	0	0	0	111.9	L240 L241 Y247 H248	L240-L244 WeakPolarHBondContact O-CB 3.24Å; L240-L244 VanDerWaalsContact O-CG 3.27Å; L240-L244 WeakPolarHBondContact O-CG 3.35Å; L240-L244 PolarHBondContact O-N 3.22Å; L241-L244 PolarHBondContact O-N 3.49Å; L244-Y247 PolarHBondContact O-N 2.97Å; L244-H248 VanDerWaalsContact O-CB 3.29Å; L244-H248 WeakPolarHBondContact O-CB 3.31Å; L244-H248 PolarHBondContact O-N 3.47Å
245	E	86.9	Confident	86.7	Confident	15 Å²	15	69.6 Å²	69.6	7%	0.07	34%	0.342	C	S	.	.	H	α-helix	trans	-66.2	-46.2	174.6	-169.9	156.4	-127.4	0	0	111.2	T19 Y173 I177 L241 N242 M243 Y247 H248 L249	T19-E245 VanDerWaalsContact CB-OE1 3.31Å; T19-E245 WeakPolarHBondContact CB-OE1 2.71Å; T19-E245 HydrophobicContact CG2-CG 4.41Å; T19-E245 VanDerWaalsContact CG2-OE1 3.27Å; T19-E245 WeakPolarHBondContact CG2-OE1 3.4Å; T19-E245 PolarHBondContact OG1-OE1 3.39Å; Y173-E245 PolarHBondContact OH-OE1 3.4Å; I177-E245 HydrophobicContact CD1-CG 4.12Å; L241-E245 WeakPolarHBondContact O-CB 3.44Å; L241-E245 PolarHBondContact O-N 3.43Å; N242-E245 PolarHBondContact O-N 2.84Å; M243-E245 VanDerWaalsContact C-N 3.33Å; E245-Y247 PolarHBondContact O-N 3.42Å; E245-H248 PolarHBondContact O-N 3.46Å; E245-L249 HydrophobicContact CG-CD1 4.04Å; E245-L249 WeakPolarHBondContact O-CB 3.28Å; E245-L249 WeakPolarHBondContact O-CD1 3.33Å; E245-L249 WeakPolarHBondContact O-CG 3.37Å; E245-L249 PolarHBondContact O-N 2.84Å
246	I	85.9	Confident	85.7	Confident	58 Å²	58	74.9 Å²	74.9	30%	0.297	37%	0.366	S	S	.	.	H	α-helix	trans	-56.3	-48.6	170.8	-70.6	169.2	0	0	0	111.1	I177 N242 M243 H248 L249 G250	I177-I246 HydrophobicContact CB-CD1 4.3Å; I177-I246 HydrophobicContact CB-CG1 4.16Å; I177-I246 HydrophobicContact CG2-CD1 3.75Å; I177-I246 HydrophobicContact CG2-CG1 3.7Å; N242-I246 WeakPolarHBondContact O-CG1 3.41Å; N242-I246 PolarHBondContact O-N 3.17Å; M243-I246 PolarHBondContact O-N 3.31Å; M243-I246 HydrophobicContact SD-CD1 4.46Å; I246-H248 PolarHBondContact O-N 3.5Å; I246-L249 PolarHBondContact O-N 2.9Å; I246-G250 PolarHBondContact O-N 2.9Å
247	Y	87.8	Confident	84.6	Confident	144 Å²	144	74.6 Å²	74.6	57%	0.565	37%	0.37	S	S	*	.	H	α-helix	trans	-60.8	-46.9	-178.1	179.4	-104	0	0	0	112	M243 L244 E245 L249 G250 W251	M243-Y247 WeakPolarHBondContact O-CB 3.3Å; M243-Y247 PolarHBondContact O-N 3.43Å; L244-Y247 PolarHBondContact O-N 2.97Å; E245-Y247 PolarHBondContact O-N 3.42Å; Y247-L249 PolarHBondContact O-N 2.98Å; Y247-G250 PolarHBondContact O-N 3.19Å; Y247-W251 HydrophobicContact CE2-CE3 4.18Å; Y247-W251 AromaticContact CZ-CE3 3.87Å; Y247-W251 VanDerWaalsContact O-CB 3.25Å; Y247-W251 WeakPolarHBondContact O-CB 3.39Å; Y247-W251 PolarHBondContact O-N 3.44Å; Y247-W251 WeakPolarHBondContact OH-CZ3 3.47Å
248	H	85.1	Confident	83.3	Confident	81 Å²	81	77.9 Å²	77.9	38%	0.375	38%	0.384	S	S	.	.	H	α-helix	trans	-65	-36.5	178.4	169.6	-129.7	0	0	0	113	L244 E245 I246 K252	L244-H248 VanDerWaalsContact O-CB 3.29Å; L244-H248 WeakPolarHBondContact O-CB 3.31Å; L244-H248 PolarHBondContact O-N 3.47Å; E245-H248 PolarHBondContact O-N 3.46Å; I246-H248 PolarHBondContact O-N 3.5Å; H248-K252 PolarHBondContact CE1-NZ 2.85Å; H248-K252 VanDerWaalsContact NE2-CE 3.28Å; H248-K252 WeakPolarHBondContact NE2-CE 3.46Å; H248-K252 PolarHBondContact NE2-NZ 3.42Å; H248-K252 PolarHBondContact O-N 2.98Å
249	L	82.6	Confident	81.9	Confident	37 Å²	37	81.6 Å²	81.6	19%	0.194	41%	0.406	C	S	.	.	H	α-helix	trans	-68.4	-46.3	173.3	-68.3	164.3	0	0	0	111.6	Y173 I177 E245 I246 Y247 K252 K253	Y173-L249 HydrophobicContact CD1-CD1 4.17Å; Y173-L249 HydrophobicContact CE1-CD1 3.45Å; Y173-L249 VanDerWaalsContact CE1-CD1 3.45Å; Y173-L249 HydrophobicContact CE1-CD2 3.99Å; Y173-L249 HydrophobicContact CE1-CG 4.36Å; I177-L249 HydrophobicContact CD1-CD1 3.82Å; E245-L249 HydrophobicContact CG-CD1 4.04Å; E245-L249 WeakPolarHBondContact O-CB 3.28Å; E245-L249 WeakPolarHBondContact O-CD1 3.33Å; E245-L249 WeakPolarHBondContact O-CG 3.37Å; E245-L249 PolarHBondContact O-N 2.84Å; I246-L249 PolarHBondContact O-N 2.9Å; Y247-L249 PolarHBondContact O-N 2.98Å; L249-K252 PolarHBondContact O-N 3.21Å; L249-K253 PolarHBondContact O-N 2.93Å; L249-K253 VanDerWaalsContact O-N 3.14Å
250	G	83	Confident	80.1	Confident	40 Å²	40	83.7 Å²	83.7	41%	0.412	42%	0.424	S	S	.	.	H	α-helix	trans	-61.2	-48.6	177.5	0	0	0	0	0	112.2	I246 Y247 K252 K253 L254	I246-G250 PolarHBondContact O-N 2.9Å; Y247-G250 PolarHBondContact O-N 3.19Å; G250-K252 VanDerWaalsContact C-N 3.34Å; G250-K252 PolarHBondContact O-N 3.01Å; G250-K253 CarbonylContact O-C 3.52Å; G250-K253 WeakPolarHBondContact O-CA 3.23Å; G250-K253 PolarHBondContact O-N 3.11Å; G250-L254 PolarHBondContact O-N 2.69Å
251	W	82.6	Confident	78.1	Confident	141 Å²	141	87.9 Å²	87.9	53%	0.534	43%	0.432	S	S	.	.	H	α-helix	trans	-59.5	-41.5	178.2	-169	-94.3	0	0	0	112.4	Y247 K253 L254 K255	Y247-W251 HydrophobicContact CE2-CE3 4.18Å; Y247-W251 AromaticContact CZ-CE3 3.87Å; Y247-W251 VanDerWaalsContact O-CB 3.25Å; Y247-W251 WeakPolarHBondContact O-CB 3.39Å; Y247-W251 PolarHBondContact O-N 3.44Å; Y247-W251 WeakPolarHBondContact OH-CZ3 3.47Å; W251-K253 VanDerWaalsContact C-N 3.31Å; W251-K253 PolarHBondContact O-N 2.84Å; W251-L254 PolarHBondContact O-N 2.91Å; W251-K255 WeakPolarHBondContact O-CB 3.44Å; W251-K255 PolarHBondContact O-N 2.98Å
252	K	80.3	Confident	76.2	Confident	115 Å²	115	96 Å²	96	50%	0.5	46%	0.463	S	S	.	.	H	α-helix	trans	-62.6	-36.8	173.8	-83.7	175.9	168.1	169	0	112.4	H248 L249 G250 Q256	H248-K252 PolarHBondContact CE1-NZ 2.85Å; H248-K252 VanDerWaalsContact NE2-CE 3.28Å; H248-K252 WeakPolarHBondContact NE2-CE 3.46Å; H248-K252 PolarHBondContact NE2-NZ 3.42Å; H248-K252 PolarHBondContact O-N 2.98Å; L249-K252 PolarHBondContact O-N 3.21Å; G250-K252 VanDerWaalsContact C-N 3.34Å; G250-K252 PolarHBondContact O-N 3.01Å; K252-Q256 WeakPolarHBondContact O-CB 3.37Å; K252-Q256 WeakPolarHBondContact O-CG 3.29Å; K252-Q256 PolarHBondContact O-N 2.92Å; K252-Q256 VanDerWaalsContact O-N 3.15Å
253	K	78.7	Confident	74.2	Confident	118 Å²	118	100.9 Å²	100.9	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-74.1	-39.6	175.5	-72.6	-69.7	168.2	-156.5	0	113.1	L249 G250 W251 Q256 G257	L249-K253 PolarHBondContact O-N 2.93Å; L249-K253 VanDerWaalsContact O-N 3.14Å; G250-K253 CarbonylContact O-C 3.52Å; G250-K253 WeakPolarHBondContact O-CA 3.23Å; G250-K253 PolarHBondContact O-N 3.11Å; W251-K253 VanDerWaalsContact C-N 3.31Å; W251-K253 PolarHBondContact O-N 2.84Å; K253-Q256 PolarHBondContact O-N 3.42Å; K253-G257 PolarHBondContact O-N 2.93Å
254	L	73.8	Confident	72.2	Confident	108 Å²	108	103.3 Å²	103.3	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-60.9	-49.7	175.7	-162.7	75.4	0	0	0	110.8	G250 W251 Q256 G257 M258	G250-L254 PolarHBondContact O-N 2.69Å; W251-L254 PolarHBondContact O-N 2.91Å; L254-Q256 PolarHBondContact O-N 2.82Å; L254-G257 PolarHBondContact O-N 3.38Å; L254-G257 VanDerWaalsContact O-N 3.12Å; L254-M258 HydrophobicContact CG-SD 4.42Å; L254-M258 WeakPolarHBondContact O-CG 3.37Å; L254-M258 PolarHBondContact O-N 2.93Å
255	K	79.2	Confident	70	Confident	137 Å²	137	106.6 Å²	106.6	60%	0.596	52%	0.523	S	S	*	.	H	α-helix	trans	-62.2	-40.3	177.2	-169.8	168.4	-176.9	172.4	0	112.4	W251 M258 T259	W251-K255 WeakPolarHBondContact O-CB 3.44Å; W251-K255 PolarHBondContact O-N 2.98Å; K255-M258 PolarHBondContact O-N 3.31Å; K255-T259 PolarHBondContact O-N 3.23Å; K255-T259 PolarHBondContact O-OG1 3.45Å
256	Q	72.2	Confident	67.9	Low	112 Å²	112	113 Å²	113	52%	0.523	56%	0.555	S	S	.	*	H	α-helix	trans	-60.7	-42.2	172.5	-78.6	174.1	-5.9	0	0	112.2	K252 K253 L254 S260	K252-Q256 WeakPolarHBondContact O-CB 3.37Å; K252-Q256 WeakPolarHBondContact O-CG 3.29Å; K252-Q256 PolarHBondContact O-N 2.92Å; K252-Q256 VanDerWaalsContact O-N 3.15Å; K253-Q256 PolarHBondContact O-N 3.42Å; L254-Q256 PolarHBondContact O-N 2.82Å; Q256-S260 VanDerWaalsContact O-CB 3.25Å; Q256-S260 WeakPolarHBondContact O-CB 3.29Å; Q256-S260 PolarHBondContact O-N 3.27Å
257	G	69.4	Low	65.8	Low	39 Å²	39	115.1 Å²	115.1	40%	0.402	57%	0.573	S	S	.	*	H	α-helix	trans	-63.9	-43.8	176.2	0	0	0	0	0	113.2	K253 L254 S260 R261	K253-G257 PolarHBondContact O-N 2.93Å; L254-G257 PolarHBondContact O-N 3.38Å; L254-G257 VanDerWaalsContact O-N 3.12Å; G257-S260 PolarHBondContact O-N 3.47Å; G257-R261 WeakPolarHBondContact O-CG 3.47Å; G257-R261 PolarHBondContact O-N 2.04Å
258	M	65.1	Low	63.8	Low	116 Å²	116	114.6 Å²	114.6	57%	0.571	58%	0.584	S	S	*	*	H	α-helix	trans	-65	-47.8	178	-67.7	173.4	73.6	0	0	112	L254 K255 S260 R261 Y262	L254-M258 HydrophobicContact CG-SD 4.42Å; L254-M258 WeakPolarHBondContact O-CG 3.37Å; L254-M258 PolarHBondContact O-N 2.93Å; K255-M258 PolarHBondContact O-N 3.31Å; M258-S260 VanDerWaalsContact C-N 3.32Å; M258-S260 PolarHBondContact O-N 2.97Å; M258-R261 PolarHBondContact O-N 3.36Å; M258-R261 VanDerWaalsContact O-N 3.17Å; M258-Y262 PolarHBondContact O-N 3.28Å; M258-Y262 VanDerWaalsContact O-N 3.13Å
259	T	62.6	Low	61.6	Low	83 Å²	83	116.2 Å²	116.2	51%	0.509	60%	0.6	S	S	.	*	H	α-helix	trans	-62.6	-38.9	175.8	-58	0	0	0	0	111.7	K255 R261 Y262 S263	K255-T259 PolarHBondContact O-N 3.23Å; K255-T259 PolarHBondContact O-OG1 3.45Å; T259-R261 VanDerWaalsContact C-N 3.27Å; T259-R261 PolarHBondContact O-N 3.21Å; T259-Y262 PolarHBondContact O-N 2.9Å; T259-S263 PolarHBondContact O-N 3.34Å; T259-S263 PolarHBondContact O-OG 3.31Å
260	S	55.9	Low	60.1	Low	80 Å²	80	118.4 Å²	118.4	56%	0.559	62%	0.623	S	S	*	*	H	α-helix	trans	-68.6	-21.4	176.7	-171.3	0	0	0	0	114.1	Q256 G257 M258	Q256-S260 VanDerWaalsContact O-CB 3.25Å; Q256-S260 WeakPolarHBondContact O-CB 3.29Å; Q256-S260 PolarHBondContact O-N 3.27Å; G257-S260 PolarHBondContact O-N 3.47Å; M258-S260 VanDerWaalsContact C-N 3.32Å; M258-S260 PolarHBondContact O-N 2.97Å
261	R	49.9	Very low	58.1	Low	195 Å²	195	122.8 Å²	122.8	74%	0.736	64%	0.642	S	S	*	*	H	α-helix	trans	-78	-43.3	171	-78.2	-73	-176.8	166.4	-0	111.3	G257 M258 T259 S263 L264	G257-R261 WeakPolarHBondContact O-CG 3.47Å; G257-R261 PolarHBondContact O-N 2.04Å; M258-R261 PolarHBondContact O-N 3.36Å; M258-R261 VanDerWaalsContact O-N 3.17Å; T259-R261 VanDerWaalsContact C-N 3.27Å; T259-R261 PolarHBondContact O-N 3.21Å; R261-S263 VanDerWaalsContact C-N 3.26Å; R261-S263 PolarHBondContact O-N 3.4Å; R261-L264 PolarHBondContact O-N 2.99Å
262	Y	50.1	Low	55.9	Low	195 Å²	195	121 Å²	121	77%	0.765	65%	0.647	S	S	*	*	H	α-helix	trans	-58.3	-33.2	175.9	-98.8	-84.6	0	0	0	113.7	M258 T259 L264	M258-Y262 PolarHBondContact O-N 3.28Å; M258-Y262 VanDerWaalsContact O-N 3.13Å; T259-Y262 PolarHBondContact O-N 2.9Å; Y262-L264 PolarHBondContact O-N 2.83Å
263	S	46	Very low	54	Low	102 Å²	102	121.1 Å²	121.1	71%	0.713	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-2	174.8	-59.8	0	0	0	0	115.1	T259 R261	T259-S263 PolarHBondContact O-N 3.34Å; T259-S263 PolarHBondContact O-OG 3.31Å; R261-S263 VanDerWaalsContact C-N 3.26Å; R261-S263 PolarHBondContact O-N 3.4Å
264	L	49.3	Very low	51.9	Low	146 Å²	146	121.3 Å²	121.3	76%	0.764	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	2.3	179.1	-131.8	160.4	0	0	0	112.5	R261 Y262	R261-L264 PolarHBondContact O-N 2.99Å; Y262-L264 PolarHBondContact O-N 2.83Å
265	E	42.8	Very low	50.4	Low	176 Å²	176	122.7 Å²	122.7	82%	0.822	68%	0.682	S	S	*	*	S	Bend	trans	-131.6	42.7	-177.4	-154.3	174.8	155.8	0	0	111.9
266	M	42.5	Very low	48.3	Very low	150 Å²	150	122 Å²	122	74%	0.739	69%	0.69	S	S	*	*			trans	-125.3	108.3	163.5	-162.4	179.4	81.9	0	0	108.4	V268	M266-V268 PolarHBondContact O-N 3.12Å
267	P	42	Very low	46.7	Very low	103 Å²	103	121.3 Å²	121.3	67%	0.669	70%	0.703	S	S	*	*			trans	-66.5	122.2	177.9	27	-32.5	0	0	0	109	T269	P267-T269 PolarHBondContact O-N 3.17Å
268	V	46.4	Very low	45	Very low	132 Å²	132	124.3 Å²	124.3	80%	0.8	72%	0.724	S	S	*	*			trans	-75.5	79	167.3	-176.8	0	0	0	0	107.5	M266 A270	M266-V268 PolarHBondContact O-N 3.12Å; V268-A270 PolarHBondContact O-N 3.28Å
269	T	40	Very low	43.7	Very low	115 Å²	115	128.1 Å²	128.1	71%	0.706	74%	0.74	S	S	*	*			trans	-60	107.6	159	27.6	0	0	0	0	107.2	P267 V271	P267-T269 PolarHBondContact O-N 3.17Å; T269-V271 PolarHBondContact O-N 3.29Å
270	A	49.2	Very low	42.3	Very low	83 Å²	83	129.9 Å²	129.9	69%	0.686	76%	0.756	S	S	*	*			trans	-65.7	93	-178	0	0	0	0	0	110.6	V268 T272	V268-A270 PolarHBondContact O-N 3.28Å; A270-T272 VanDerWaalsContact C-N 3.28Å; A270-T272 PolarHBondContact O-N 3Å
271	V	41.7	Very low	41.1	Very low	132 Å²	132	135.6 Å²	135.6	80%	0.8	77%	0.771	S	S	*	*			trans	-71.7	89.3	166.6	-177.2	0	0	0	0	107.7	T269 P273	T269-V271 PolarHBondContact O-N 3.29Å; V271-P273 WeakPolarHBondContact O-CD 3.24Å
272	T	36.3	Very low	40.5	Very low	105 Å²	105	132 Å²	132	64%	0.644	77%	0.773	S	S	*	*			trans	-61.2	119.6	166.8	47.8	0	0	0	0	108.9	A270 V274	A270-T272 VanDerWaalsContact C-N 3.28Å; A270-T272 PolarHBondContact O-N 3Å; T272-V274 PolarHBondContact O-N 2.71Å
273	P	40.6	Very low	39.8	Very low	116 Å²	116	129.5 Å²	129.5	75%	0.753	78%	0.777	S	S	*	*			trans	-70.6	101.2	173.8	28.8	-32.5	0	0	0	108.9	V271 V275	V271-P273 WeakPolarHBondContact O-CD 3.24Å; P273-V275 PolarHBondContact O-N 3.36Å
274	V	35.7	Very low	39.4	Very low	122 Å²	122	130 Å²	130	74%	0.739	78%	0.78	S	S	*	*			trans	-66.4	117.3	169.6	177.2	0	0	0	0	107.7	T272 V276	T272-V274 PolarHBondContact O-N 2.71Å; V274-V276 HydrophobicContact CG1-CG2 4.3Å; V274-V276 PolarHBondContact O-N 2.84Å; V274-V276 VanDerWaalsContact O-N 3.15Å
275	V	40.3	Very low	38.8	Very low	137 Å²	137	131 Å²	131	83%	0.83	79%	0.786	S	S	*	*			trans	-72.8	107.2	178.4	-178.1	0	0	0	0	108.9	P273	P273-V275 PolarHBondContact O-N 3.36Å
276	V	36.4	Very low	38.9	Very low	124 Å²	124	128 Å²	128	75%	0.752	78%	0.782	S	S	*	*			trans	-109.6	115.6	164.5	-176.6	0	0	0	0	107.3	V274	V274-V276 HydrophobicContact CG1-CG2 4.3Å; V274-V276 PolarHBondContact O-N 2.84Å; V274-V276 VanDerWaalsContact O-N 3.15Å
277	A	38.8	Very low	39	Very low	97 Å²	97	126.6 Å²	126.6	80%	0.802	78%	0.784	S	S	*	*			trans	-76.9	131.5	178.2	0	0	0	0	0	110.7
278	A	34.3	Very low	39.4	Very low	101 Å²	101	128 Å²	128	84%	0.835	79%	0.793	S	S	*	*			trans	-141	135.4	166.4	0	0	0	0	0	108.6
279	E	36.5	Very low	39	Very low	196 Å²	196	126.3 Å²	126.3	92%	0.916	79%	0.793	S	S	*	*			trans	-112	131.6	-163.9	-175	-176.1	134.2	0	0	112.1
280	S	33.9	Very low	39.3	Very low	121 Å²	121	126.9 Å²	126.9	85%	0.846	80%	0.798	S	S	*	*			trans	-162.9	155.8	158.1	45.8	0	0	0	0	112.3
281	K	30.4	Very low	39.8	Very low	200 Å²	200	128.7 Å²	128.7	87%	0.87	80%	0.803	S	S	*	*			trans	-82.4	153.8	-170	-96	173.3	173.5	168.9	0	114
282	P	36.6	Very low	39.5	Very low	119 Å²	119	131.1 Å²	131.1	77%	0.773	81%	0.808	S	S	*	*			trans	-81.2	154.5	173.8	34.6	-35.5	0	0	0	113.1
283	V	35.2	Very low	39.8	Very low	143 Å²	143	132.3 Å²	132.3	87%	0.867	82%	0.815	S	S	*	*			trans	-135.4	138.2	167.6	178.6	0	0	0	0	108.7
284	S	37.8	Very low	39.5	Very low	111 Å²	111	133.4 Å²	133.4	78%	0.776	82%	0.819	S	S	*	*			trans	-104.2	153.4	-174.1	-52.7	0	0	0	0	112.6
285	L	37.3	Very low	39.5	Very low	167 Å²	167	133.5 Å²	133.5	87%	0.874	82%	0.82	S	S	*	*			trans	-130.7	142.4	172.6	-77.9	169.7	0	0	0	112
286	P	44.4	Very low	39.5	Very low	115 Å²	115	131.6 Å²	131.6	75%	0.747	82%	0.819	S	S	*	*			trans	-97.8	174.6	-175.7	39.3	-36.9	0	0	0	114.4
287	P	45.8	Very low	39.5	Very low	120 Å²	120	131 Å²	131	78%	0.779	83%	0.827	S	S	*	*			trans	-103.6	-156.1	-175	47.3	-39.6	0	0	0	112.1
288	P	50.8	Low	39.1	Very low	131 Å²	131	129.7 Å²	129.7	85%	0.851	82%	0.823	S	S	*	*				-117.4	177.6	-125.1	25.5	-0.5	0	0	0	116.1
289	A	36.1	Very low	40.1	Very low	97 Å²	97	131.1 Å²	131.1	80%	0.802	82%	0.824	S	S	*	*			trans	-143.1	160.7	177.5	0	0	0	0	0	113.9
290	P	46.7	Very low	41.2	Very low	127 Å²	127	127 Å²	127	83%	0.825	81%	0.814	S	S	*	*			trans	-115.2	-149	-169.4	47.9	-35.7	0	0	0	113.4
291	P	59.8	Low	42.4	Very low	121 Å²	121	126.5 Å²	126.5	79%	0.786	81%	0.808	S	S	*	*				-119.5	175.7	-126.2	31.9	-8.8	0	0	0	116.8
292	M	35.9	Very low	42.7	Very low	184 Å²	184	123.5 Å²	123.5	91%	0.906	81%	0.806	S	S	*	*			trans	-143.7	168.3	173.8	-89.6	-166.8	69.3	0	0	114.4
293	V	41.7	Very low	43	Very low	129 Å²	129	123.6 Å²	123.6	78%	0.782	80%	0.804	S	S	*	*			trans	-143.5	154.2	-167.5	176.6	0	0	0	0	110.3
294	V	36.2	Very low	43.7	Very low	140 Å²	140	123.1 Å²	123.1	85%	0.848	80%	0.804	S	S	*	*			trans	163.4	172	148.6	148.8	0	0	0	0	110.6
295	T	35.3	Very low	43.8	Very low	124 Å²	124	124.5 Å²	124.5	76%	0.761	80%	0.803	S	S	*	*				-153.6	167.6	-74.9	-63.7	0	0	0	0	107.8
296	A	40	Very low	43.7	Very low	97 Å²	97	121.7 Å²	121.7	80%	0.802	79%	0.793	S	S	*	*			trans	-106.3	171.5	-165.5	0	0	0	0	0	117.4
297	A	35.3	Very low	43.3	Very low	111 Å²	111	127.4 Å²	127.4	92%	0.917	80%	0.799	S	S	*	*			trans	-154.6	162.6	169.1	0	0	0	0	0	113.6
298	G	31	Very low	42.8	Very low	70 Å²	70	128.2 Å²	128.2	72%	0.722	80%	0.802	S	S	*	*			trans	-161.1	-147.9	177.6	0	0	0	0	0	110.4
299	P	56.3	Low	42.1	Very low	131 Å²	131	128.6 Å²	128.6	85%	0.851	80%	0.802	S	S	*	*			cis	-130.3	-109.2	-12.2	23.7	3.6	0	0	0	117.4
300	P	58.7	Low	41.9	Very low	109 Å²	109	129.9 Å²	129.9	71%	0.708	80%	0.8	S	S	*	*				-123.4	-155.8	-121.1	45.4	-27	0	0	0	114.4
301	P	58.6	Low	42.1	Very low	111 Å²	111	129 Å²	129	72%	0.721	79%	0.794	S	S	*	*			cis	-128.2	-174.8	-6.4	36.7	-13.7	0	0	0	114.5
302	V	37.3	Very low	40.8	Very low	137 Å²	137	129.9 Å²	129.9	83%	0.83	79%	0.792	S	S	*	*				-169.4	162.2	80.1	164.9	0	0	0	0	110.4
303	V	43	Very low	40.8	Very low	120 Å²	120	128.8 Å²	128.8	73%	0.727	79%	0.789	S	S	*	*			trans	-123.8	164	-171.7	-139.7	0	0	0	0	112.6
304	P	49.8	Very low	40.4	Very low	133 Å²	133	127.1 Å²	127.1	86%	0.864	79%	0.788	S	S	*	*				-143	-173.5	92.9	36.4	-17.8	0	0	0	115.7
305	N	39.5	Very low	41.1	Very low	141 Å²	141	126.5 Å²	126.5	75%	0.754	79%	0.787	S	S	*	*			trans	-124.9	148.6	-152.5	-162.4	10.5	0	0	0	112
306	T	35.8	Very low	41.2	Very low	108 Å²	108	126.6 Å²	126.6	66%	0.663	79%	0.787	S	S	*	*				172.7	154	89.1	38.5	0	0	0	0	113.7
307	R	35.8	Very low	40.8	Very low	234 Å²	234	127.6 Å²	127.6	88%	0.883	78%	0.783	S	S	*	*			trans	61.3	128.1	162.6	-65.7	172.2	174.7	166.1	-2.1	116.4
308	T	34.6	Very low	41.3	Very low	138 Å²	138	129.7 Å²	129.7	85%	0.847	78%	0.776	S	S	*	*			cis	-160.5	177.9	49.7	-54.5	0	0	0	0	111.2
309	V	36.8	Very low	42.1	Very low	138 Å²	138	132 Å²	132	84%	0.836	78%	0.778	S	S	*	*			trans	-89.7	150.7	-168.3	-172.7	0	0	0	0	114.1
310	T	31.7	Very low	42.1	Very low	124 Å²	124	130.5 Å²	130.5	76%	0.761	77%	0.769	S	S	*	*			trans	-86.1	-179.3	176	21.2	0	0	0	0	113.8
311	P	50.3	Low	41.4	Very low	109 Å²	109	135.7 Å²	135.7	71%	0.708	78%	0.776	S	S	*	*			cis	-116.4	-145.1	-13.1	16.5	11	0	0	0	109.8
312	L	34.2	Very low	40.9	Very low	140 Å²	140	140.7 Å²	140.7	73%	0.733	78%	0.782	S	S	*	*			cis	-150.4	162.4	10.8	-93.3	177.1	0	0	0	111.3
313	L	35.3	Very low	40.8	Very low	161 Å²	161	139 Å²	139	84%	0.843	78%	0.782	S	S	*	*			trans	42.1	122.2	148.4	-69.1	164.4	0	0	0	121.7
314	A	32.6	Very low	40.8	Very low	93 Å²	93	138.1 Å²	138.1	77%	0.769	79%	0.787	S	S	*	*			trans	-139.1	139	160.9	0	0	0	0	0	111.3
315	P	51.9	Low	40.1	Very low	127 Å²	127	136.6 Å²	136.6	83%	0.825	79%	0.786	S	S	*	*			trans	-111.5	146.6	176.9	38.3	-30.6	0	0	0	113.8
316	V	35.9	Very low	40.1	Very low	127 Å²	127	134.3 Å²	134.3	77%	0.77	79%	0.787	S	S	*	*			trans	-148.2	121.2	-176	-165.8	0	0	0	0	114
317	T	33.4	Very low	40.6	Very low	118 Å²	118	135.5 Å²	135.5	72%	0.724	80%	0.796	S	S	*	*			trans	34.2	140.1	156.3	62.8	0	0	0	0	123
318	M	44	Very low	40.7	Very low	154 Å²	154	136.3 Å²	136.3	76%	0.759	80%	0.799	S	S	*	*			cis	71.1	136.3	49.5	-66	-72.6	-83.3	0	0	114.2
319	P	48.3	Very low	40.7	Very low	119 Å²	119	134.4 Å²	134.4	77%	0.773	80%	0.797	S	S	*	*				-149.3	171.4	78.2	41.4	-23.3	0	0	0	118.2
320	P	56.9	Low	40.8	Very low	100 Å²	100	139.2 Å²	139.2	65%	0.649	80%	0.801	S	S	*	*			trans	-112.2	-175.9	175.2	42.2	-33.5	0	0	0	114.7
321	Y	43	Very low	42.2	Very low	218 Å²	218	138.6 Å²	138.6	86%	0.855	80%	0.798	S	S	*	*			trans	-127.2	155.4	174.2	-93.7	-105.2	0	0	0	113.9
322	Y	48.9	Very low	42.7	Very low	216 Å²	216	138.3 Å²	138.3	85%	0.847	80%	0.797	S	S	*	*			trans	-44.3	168.9	-176.2	-60.1	-89.3	0	0	0	118.8
323	A	35.4	Very low	42.7	Very low	100 Å²	100	136.6 Å²	136.6	83%	0.826	80%	0.796	S	S	*	*			cis	-146.5	-174.7	23	0	0	0	0	0	115.5
324	A	42.2	Very low	42.6	Very low	102 Å²	102	138.6 Å²	138.6	84%	0.843	80%	0.798	S	S	*	*			trans	-156.2	163.5	-154.9	0	0	0	0	0	116
325	A	35	Very low	42.8	Very low	102 Å²	102	140.2 Å²	140.2	84%	0.843	80%	0.799	S	S	*	*			trans	172.2	160.9	149.6	0	0	0	0	0	111.3
326	A	41.1	Very low	41.9	Very low	93 Å²	93	138.7 Å²	138.7	77%	0.769	80%	0.797	S	S	*	*			cis	-174.6	144.9	-36.4	0	0	0	0	0	109.9
327	P	45.3	Very low	41.9	Very low	133 Å²	133	137.3 Å²	137.3	86%	0.864	79%	0.793	S	S	*	*			trans	-136.7	155	163.1	37.8	-23.5	0	0	0	117.2
328	R	38.3	Very low	42	Very low	251 Å²	251	138.9 Å²	138.9	95%	0.947	80%	0.795	S	S	*	*			trans	-158.7	157.6	172.8	-95.7	-176.2	173	-179.1	-2.1	107.2
329	A	34.8	Very low	41.7	Very low	97 Å²	97	136.5 Å²	136.5	80%	0.802	80%	0.8	S	S	*	*			cis	-160.7	-175.8	-8.6	0	0	0	0	0	110.4
330	R	37.3	Very low	41.1	Very low	240 Å²	240	135.9 Å²	135.9	91%	0.906	80%	0.798	S	S	*	*			trans	-92.1	178.3	171.6	-115.7	-174	-177.9	-160.3	3.6	111
331	P	62.6	Low	40.2	Very low	110 Å²	110	140.9 Å²	140.9	71%	0.714	81%	0.806	S	S	*	*			cis	-126.2	-129.2	-9.4	36.1	-12.3	0	0	0	110
332	P	61.1	Low	40.6	Very low	104 Å²	104	136.7 Å²	136.7	68%	0.675	81%	0.805	S	S	*	*			cis	-135.8	167.6	-30.5	38.2	-19.5	0	0	0	118.5
333	S	32.6	Very low	40	Very low	103 Å²	103	132 Å²	132	72%	0.72	80%	0.799	S	S	*	*			trans	56	120.9	141.1	64.2	0	0	0	0	124.9
334	K	33.3	Very low	40.2	Very low	203 Å²	203	131.4 Å²	131.4	88%	0.883	79%	0.794	S	S	*	*				165.5	159.9	127.6	-90.1	166.4	-178.6	-179.9	0	110.1
335	T	37.2	Very low	40.2	Very low	127 Å²	127	132.3 Å²	132.3	78%	0.779	79%	0.792	S	S	*	*			cis	-166	154	-39.7	-78	0	0	0	0	108.1
336	A	34.3	Very low	40.8	Very low	95 Å²	95	133.2 Å²	133.2	79%	0.785	79%	0.789	S	S	*	*			trans	75.1	154	166.1	0	0	0	0	0	119.6
337	S	35.8	Very low	40.7	Very low	98 Å²	98	133.3 Å²	133.3	69%	0.685	79%	0.789	S	S	*	*			cis	-168.2	132.3	-29	-170	0	0	0	0	113.5
338	I	34.8	Very low	40.9	Very low	151 Å²	151	133.1 Å²	133.1	77%	0.774	79%	0.788	S	S	*	*			trans	40.1	124.7	144.4	-57	170.3	0	0	0	121.6
339	A	38.4	Very low	40.7	Very low	104 Å²	104	130.3 Å²	130.3	86%	0.86	79%	0.786	S	S	*	*			trans	-144.9	160.8	136.5	0	0	0	0	0	109.1
340	S	34.8	Very low	40.6	Very low	106 Å²	106	134.5 Å²	134.5	74%	0.741	79%	0.789	S	S	*	*			trans	-126.3	164.5	-155.6	-56.7	0	0	0	0	116.6
341	Y	37.2	Very low	40.6	Very low	206 Å²	206	132 Å²	132	81%	0.808	78%	0.784	S	S	*	*			trans	-66.2	169.2	-179.3	-54.8	-89.7	0	0	0	115.5	V343	Y341-V343 HydrophobicContact CD1-CG2 4.49Å; Y341-V343 HydrophobicContact CG-CG2 4.32Å
342	P	53.2	Low	39.4	Very low	130 Å²	130	135 Å²	135	84%	0.844	79%	0.788	S	S	*	*				-123.6	-158.5	88.3	38.9	-33.3	0	0	0	115.8
343	V	35.7	Very low	38	Very low	116 Å²	116	140.8 Å²	140.8	70%	0.703	80%	0.797	S	S	*	*				-160.5	145.5	-122.5	142	0	0	0	0	113.7	Y341	Y341-V343 HydrophobicContact CD1-CG2 4.49Å; Y341-V343 HydrophobicContact CG-CG2 4.32Å
344	A	38.9	Very low	38.1	Very low	89 Å²	89	140.7 Å²	140.7	74%	0.736	80%	0.803	S	S	*	*			trans	64.7	164.1	162	0	0	0	0	0	117.6
345	P	43.6	Very low	38.3	Very low	121 Å²	121	136.9 Å²	136.9	79%	0.786	80%	0.796	S	S	*	*			cis	-129.4	171.8	6.9	42.8	-28.1	0	0	0	117
346	P	46.6	Very low	38.3	Very low	120 Å²	120	136.7 Å²	136.7	78%	0.779	80%	0.795	S	S	*	*			trans	-119	-176.2	165.5	41.5	-31.1	0	0	0	114.3
347	A	38.4	Very low	38.8	Very low	95 Å²	95	137.7 Å²	137.7	79%	0.785	79%	0.793	S	S	*	*			trans	81.3	154.5	-179.7	0	0	0	0	0	114.4
348	P	49.5	Very low	38.7	Very low	129 Å²	129	139.2 Å²	139.2	84%	0.838	80%	0.799	S	S	*	*			cis	-112.2	177.2	39.7	41	-35.6	0	0	0	117.1
349	E	34.7	Very low	39.7	Very low	192 Å²	192	137.6 Å²	137.6	90%	0.897	80%	0.798	S	S	*	*			trans	-86.9	155.9	170.8	-59.5	169.1	85.5	0	0	112.7
350	E	32.5	Very low	39.4	Very low	186 Å²	186	139.6 Å²	139.6	87%	0.869	80%	0.799	S	S	*	*			trans	-141	162.5	153.2	-161.2	163.7	-170	0	0	111.6
351	K	36.8	Very low	39.4	Very low	186 Å²	186	138.9 Å²	138.9	81%	0.809	79%	0.794	S	S	*	*			trans	-141.9	90.4	-136.9	179.9	-171.1	176.7	177.2	0	114.1
352	H	38	Very low	39.3	Very low	173 Å²	173	135.6 Å²	135.6	80%	0.801	80%	0.796	S	S	*	*			trans	-126	79.9	178.4	-78.2	-80.4	0	0	0	115.9
353	R	31.7	Very low	39.2	Very low	227 Å²	227	134.7 Å²	134.7	86%	0.857	79%	0.79	S	S	*	*			trans	31.2	101	133.2	-166.1	177.5	-163.8	149.2	2.6	118.4	V355	R353-V355 HydrophobicContact CG-CG2 4.45Å
354	A	33.9	Very low	39.1	Very low	101 Å²	101	135.4 Å²	135.4	84%	0.835	79%	0.794	S	S	*	*			trans	-69.6	155.7	158.2	0	0	0	0	0	112.1
355	V	38.1	Very low	38.7	Very low	123 Å²	123	137.4 Å²	137.4	75%	0.745	80%	0.797	S	S	*	*			trans	-135.9	128.9	175.5	178	0	0	0	0	110.3	R353	R353-V355 HydrophobicContact CG-CG2 4.45Å
356	T	37.3	Very low	38.7	Very low	122 Å²	122	138.7 Å²	138.7	75%	0.748	80%	0.796	S	S	*	*			trans	-98.7	137.9	180	-48.6	0	0	0	0	111.1
357	P	44.7	Very low	39.1	Very low	117 Å²	117	138 Å²	138	76%	0.76	79%	0.792	S	S	*	*			trans	-100	128.5	169.7	34.6	-28.8	0	0	0	112.9
358	T	33	Very low	39.6	Very low	130 Å²	130	139.2 Å²	139.2	80%	0.798	79%	0.789	S	S	*	*			trans	-142.9	155.4	165.5	38.2	0	0	0	0	110.4
359	P	56.6	Low	39.7	Very low	117 Å²	117	138.6 Å²	138.6	76%	0.76	79%	0.785	S	S	*	*			trans	-112.7	149.3	-144.5	39.1	-32.9	0	0	0	117.8
360	V	32.7	Very low	40	Very low	146 Å²	146	136.6 Å²	136.6	89%	0.885	78%	0.779	S	S	*	*			trans	-155.2	159.6	167	-168.3	0	0	0	0	108.7
361	S	34.4	Very low	40.6	Very low	91 Å²	91	133.9 Å²	133.9	64%	0.636	78%	0.777	S	S	*	*				-168.6	134.2	-71.5	-90.4	0	0	0	0	112.1
362	T	36.1	Very low	40.6	Very low	137 Å²	137	130.6 Å²	130.6	84%	0.84	77%	0.773	S	S	*	*			trans	65.3	164.8	164.1	67.1	0	0	0	0	118.7
363	P	49.6	Very low	40.8	Very low	110 Å²	110	128.5 Å²	128.5	71%	0.714	78%	0.775	S	S	*	*			cis	-130	144.8	-4.2	34.7	-16	0	0	0	118
364	V	35.2	Very low	40.9	Very low	131 Å²	131	124.3 Å²	124.3	79%	0.794	78%	0.775	S	S	*	*				38.5	125.3	129.8	-175.3	0	0	0	0	121.9
365	T	30.3	Very low	41	Very low	132 Å²	132	124.8 Å²	124.8	81%	0.81	77%	0.772	S	S	*	*				-163.7	140	119.5	-74	0	0	0	0	111.3
366	I	43.1	Very low	40.8	Very low	148 Å²	148	123.5 Å²	123.5	76%	0.759	78%	0.775	S	S	*	*			trans	-140.8	159.9	168	-25.1	176.8	0	0	0	106.9
367	P	54.7	Low	40.5	Very low	106 Å²	106	123.6 Å²	123.6	69%	0.688	77%	0.774	S	S	*	*				-153	129.8	94.9	36.8	-17.1	0	0	0	117.8
368	T	49.6	Very low	40.1	Very low	120 Å²	120	125.3 Å²	125.3	74%	0.736	78%	0.776	S	S	*	*			trans	65.7	167.6	132.4	66.1	0	0	0	0	122
369	P	50.8	Low	40.1	Very low	115 Å²	115	126.3 Å²	126.3	75%	0.747	78%	0.776	S	S	*	*			cis	-127.7	172	-21.6	19.9	3.1	0	0	0	114.8
370	I	42.1	Very low	38.7	Very low	151 Å²	151	130.7 Å²	130.7	77%	0.774	78%	0.779	S	S	*	*			trans	-107.8	154.2	164.6	-63.2	162.8	0	0	0	108.5
371	P	44.1	Very low	38.8	Very low	128 Å²	128	133.9 Å²	133.9	83%	0.831	78%	0.781	S	S	*	*			trans	-119.8	147.7	139.6	-1	21.9	0	0	0	113.6
372	T	36.3	Very low	38.6	Very low	118 Å²	118	136.2 Å²	136.2	72%	0.724	79%	0.787	S	S	*	*			trans	-88.2	162	-176.1	44.8	0	0	0	0	113.8
373	P	43.2	Very low	38.4	Very low	128 Å²	128	133.7 Å²	133.7	83%	0.831	78%	0.775	S	S	*	*			trans	-73.1	154.9	173.1	31.8	-36.5	0	0	0	113.1
374	T	33.4	Very low	38	Very low	140 Å²	140	136.4 Å²	136.4	86%	0.859	78%	0.783	S	S	*	*			trans	-120.5	156.2	178.5	-50.8	0	0	0	0	110.8
375	S	35.8	Very low	38.1	Very low	111 Å²	111	135.5 Å²	135.5	78%	0.776	78%	0.783	S	S	*	*			trans	-100	-179.5	-166	58	0	0	0	0	115.5
376	A	33.2	Very low	38.6	Very low	96 Å²	96	138.8 Å²	138.8	79%	0.793	79%	0.789	S	S	*	*			trans	82	153.5	-178.3	0	0	0	0	0	114.4
377	V	31.9	Very low	38.6	Very low	123 Å²	123	135.7 Å²	135.7	75%	0.745	79%	0.785	S	S	*	*			cis	-132	148.4	19.4	170.9	0	0	0	0	112.1
378	I	37	Very low	38.2	Very low	154 Å²	154	137.3 Å²	137.3	79%	0.79	79%	0.787	S	S	*	*			trans	-81.3	128.4	167.6	-63.6	171.2	0	0	0	109.3
379	N	31.3	Very low	37.9	Very low	150 Å²	150	136.3 Å²	136.3	80%	0.802	79%	0.791	S	S	*	*			trans	-119.8	127.8	165.8	-96.1	-27.3	0	0	0	111.2
380	Y	28.7	Very low	37.5	Very low	210 Å²	210	134.1 Å²	134.1	82%	0.824	78%	0.782	S	S	*	*			trans	-76.9	134.6	169.8	-111.5	-108.8	0	0	0	109.7
381	F	33.2	Very low	37.9	Very low	212 Å²	212	133.7 Å²	133.7	93%	0.93	78%	0.777	S	S	*	*			trans	-141.9	146.3	152.5	-110.7	-82.8	0	0	0	110
382	N	30.4	Very low	37.9	Very low	140 Å²	140	135 Å²	135	75%	0.749	77%	0.772	S	S	*	*			trans	-131.4	161.1	-171.6	-176.4	24.3	0	0	0	110.1
383	S	31.7	Very low	38.4	Very low	85 Å²	85	135.2 Å²	135.2	59%	0.594	77%	0.769	S	S	*	*			trans	96.1	111.7	166.8	-39.3	0	0	0	0	117.8
384	N	41.5	Very low	38.4	Very low	166 Å²	166	138.5 Å²	138.5	89%	0.888	77%	0.765	S	S	*	*			trans	44.5	98.4	131.2	-58.6	-15.1	0	0	0	119.7
385	S	38	Very low	39.1	Very low	112 Å²	112	136.9 Å²	136.9	78%	0.783	75%	0.754	S	S	*	*			trans	-140.9	24.1	166.1	54.6	0	0	0	0	114.7	A387	S385-A387 PolarHBondContact O-N 3.06Å
386	H	41	Very low	39.9	Very low	202 Å²	202	137.2 Å²	137.2	94%	0.935	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	25.5	-177.1	-107.5	-75.6	0	0	0	115.4
387	A	43.4	Very low	40.6	Very low	82 Å²	82	139.2 Å²	139.2	68%	0.678	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.8	-8.7	-172.6	0	0	0	0	0	115.8	S385	S385-A387 PolarHBondContact O-N 3.06Å
388	L	46.4	Very low	41.2	Very low	141 Å²	141	137.1 Å²	137.1	74%	0.738	74%	0.738	S	S	*	*	S	Bend	trans	-111.6	11.8	-168.8	-72.6	175.8	0	0	0	115.5
389	A	43	Very low	41.7	Very low	98 Å²	98	133.5 Å²	133.5	81%	0.81	73%	0.731	S	S	*	*	S	Bend	trans	-90.7	-5.5	174.5	0	0	0	0	0	113.9
390	A	41.9	Very low	42.4	Very low	69 Å²	69	135 Å²	135	57%	0.57	73%	0.733	S	S	*	*	S	Bend	trans	-96.3	-30.6	-170.7	0	0	0	0	0	114.7
391	E	49.4	Very low	42.9	Very low	143 Å²	143	133.7 Å²	133.7	67%	0.668	73%	0.734	S	S	*	*	S	Bend	trans	-80.6	-32.9	-174	-64.6	-159.5	101.1	0	0	113.5	N393 W394	E391-N393 PolarHBondContact O-N 2.81Å; E391-W394 PolarHBondContact O-N 3.38Å
392	Q	43.9	Very low	43.2	Very low	155 Å²	155	132.6 Å²	132.6	72%	0.724	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	-24.4	-177.5	-139.2	74.3	15.2	0	0	113.8
393	N	47.5	Very low	43.3	Very low	122 Å²	122	129.7 Å²	129.7	65%	0.652	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-9.2	-171.1	-145.6	10.5	0	0	0	114	E391	E391-N393 PolarHBondContact O-N 2.81Å
394	W	44.2	Very low	43.3	Very low	197 Å²	197	135.3 Å²	135.3	75%	0.746	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-29.3	-179.7	-83	92.8	0	0	0	113.9	E391 N396	E391-W394 PolarHBondContact O-N 3.38Å; W394-N396 VanDerWaalsContact C-N 3.33Å; W394-N396 PolarHBondContact O-N 2.94Å
395	V	47.7	Very low	42.9	Very low	106 Å²	106	133.4 Å²	133.4	64%	0.642	74%	0.743	S	S	*	*	H	α-helix	trans	-63.1	-40.2	-177.8	-177.3	0	0	0	0	111.5	M397 A398	V395-M397 PolarHBondContact O-N 3.38Å; V395-A398 PolarHBondContact O-N 3.08Å
396	N	52.2	Low	43.3	Very low	118 Å²	118	133 Å²	133	63%	0.631	74%	0.738	S	S	*	*	H	α-helix	trans	-72.5	-30.8	-172.3	-65.8	-12.1	0	0	0	113.8	W394 A398	W394-N396 VanDerWaalsContact C-N 3.33Å; W394-N396 PolarHBondContact O-N 2.94Å; N396-A398 VanDerWaalsContact C-N 3.34Å
397	M	48	Very low	42.6	Very low	138 Å²	138	128.2 Å²	128.2	68%	0.68	73%	0.727	S	S	*	*	H	α-helix	trans	-79.5	-14	177.2	-72.3	-160.8	-63.6	0	0	113.8	V395 A399	V395-M397 PolarHBondContact O-N 3.38Å; M397-A399 VanDerWaalsContact C-N 3.34Å
398	A	45	Very low	41.8	Very low	79 Å²	79	129.1 Å²	129.1	65%	0.653	73%	0.729	S	S	*	*	H	α-helix	trans	-76.6	-21.1	177.9	0	0	0	0	0	113.2	V395 N396	V395-A398 PolarHBondContact O-N 3.08Å; N396-A398 VanDerWaalsContact C-N 3.34Å
399	A	46.8	Very low	41	Very low	79 Å²	79	127.6 Å²	127.6	65%	0.653	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-80	-22.7	-170.3	0	0	0	0	0	115	M397	M397-A399 VanDerWaalsContact C-N 3.34Å
400	E	45.5	Very low	40.4	Very low	181 Å²	181	128.3 Å²	128.3	85%	0.846	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-94.2	5	-170.2	-70	-166.2	99.4	0	0	115.6
401	Q	40.1	Very low	39.7	Very low	182 Å²	182	128.9 Å²	128.9	85%	0.85	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-110.2	9.8	-178.1	-65.2	-144.9	7.4	0	0	116.3
402	Q	38.8	Very low	38.7	Very low	190 Å²	190	127.7 Å²	127.7	89%	0.888	76%	0.756	S	S	*	*	S	Bend	trans	-123.9	94.6	170.7	-68.3	-172.8	-6.4	0	0	110.9
403	G	32.9	Very low	38	Very low	79 Å²	79	126 Å²	126	81%	0.814	76%	0.761	S	S	*	*			trans	179.1	45.8	-174	0	0	0	0	0	118.4
404	K	32.8	Very low	37.2	Very low	202 Å²	202	126.5 Å²	126.5	88%	0.878	77%	0.769	S	S	*	*			trans	-160.2	134.6	170.8	-125	169.7	-173.3	168.3	0	107.8
405	V	32.8	Very low	37.5	Very low	126 Å²	126	122.2 Å²	122.2	76%	0.764	77%	0.767	S	S	*	*				178.7	157.2	66.2	173.2	0	0	0	0	105.8
406	P	46	Very low	36.7	Very low	104 Å²	104	122.7 Å²	122.7	68%	0.675	78%	0.775	S	S	*	*			cis	-135.1	-174.5	-27.1	39.6	-20.8	0	0	0	116
407	S	25.7	Very low	35.6	Very low	101 Å²	101	122.9 Å²	122.9	71%	0.706	79%	0.785	S	S	*	*			trans	90.5	137.6	134.1	66.7	0	0	0	0	124.8
408	S	27.8	Very low	34.8	Very low	102 Å²	102	122.6 Å²	122.6	71%	0.713	79%	0.791	S	S	*	*			trans	76.6	116.4	145.7	46.6	0	0	0	0	123.9
409	S	29.4	Very low	33.9	Very low	109 Å²	109	130.4 Å²	130.4	76%	0.762	80%	0.803	S	S	*	*			trans	74.9	120.5	130.4	64	0	0	0	0	123.5
410	A	29.3	Very low	33.3	Very low	112 Å²	112	134.4 Å²	134.4	93%	0.926	81%	0.808	S	S	*	*			trans	70.5	158.3	141.2	0	0	0	0	0	119.8
411	G	27	Very low	33.1	Very low	82 Å²	82	131.8 Å²	131.8	85%	0.845	81%	0.807	S	S	*	*			trans	125.6	109.7	172.2	0	0	0	0	0	113.9
412	S	29.1	Very low	32.6	Very low	117 Å²	117	130 Å²	130	82%	0.818	80%	0.802	S	S	*	*			trans	-109.9	133.8	175	55.9	0	0	0	0	111.6
413	S	28.6	Very low	33	Very low	121 Å²	121	125.6 Å²	125.6	85%	0.846	79%	0.79	S	S	*	*			trans	-166.6	139.9	148.6	44.7	0	0	0	0	113.7
414	T	31.7	Very low	32.8	Very low	132 Å²	132	129.3 Å²	129.3	81%	0.81	79%	0.787	S	S	*	*			trans	-108.5	-171	159.8	54.9	0	0	0	0	106.9
415	P	51.3	Low	32.5	Very low	107 Å²	107	126.9 Å²	126.9	70%	0.695	78%	0.778	S	S	*	*			cis	-143	-168.3	4.7	44.1	-24.6	0	0	0	116.3
416	S	30.8	Very low	32.3	Very low	116 Å²	116	128.1 Å²	128.1	81%	0.811	78%	0.776	S	S	*	*			trans	74.1	150	154.9	-60.6	0	0	0	0	118
417	S	27.6	Very low	31.7	Very low	121 Å²	121	130.6 Å²	130.6	85%	0.846	78%	0.778	S	S	*	*			cis	-146	177.2	26.5	-162.8	0	0	0	0	114.8
418	V	31.7	Very low	32.8	Very low	132 Å²	132	130.6 Å²	130.6	80%	0.8	78%	0.776	S	S	*	*			trans	-110.2	138.7	-172.3	171.3	0	0	0	0	112.3
419	R	27	Very low	33	Very low	244 Å²	244	131.9 Å²	131.9	92%	0.921	77%	0.774	S	S	*	*			trans	-157.1	140	143.6	-150.3	120.5	-165.2	-165	6.2	114
420	Q	33.7	Very low	33	Very low	163 Å²	163	133.1 Å²	133.1	76%	0.762	77%	0.768	S	S	*	*			trans	-102.7	163.4	166.4	-118.3	174	-1	0	0	108.4
421	P	41.3	Very low	33.1	Very low	125 Å²	125	135.5 Å²	135.5	81%	0.812	76%	0.76	S	S	*	*				-149.1	-178.2	70.1	40	-19.3	0	0	0	117.6
422	L	28.7	Very low	33.3	Very low	144 Å²	144	138.8 Å²	138.8	75%	0.754	76%	0.757	S	S	*	*			trans	-79.2	-172.1	171.9	-130.1	76.1	0	0	0	111
423	P	47.1	Very low	33.6	Very low	98 Å²	98	140.8 Å²	140.8	64%	0.636	76%	0.758	S	S	*	*			cis	-150.9	169.7	40.7	45.2	-23.7	0	0	0	121.2
424	E	29.2	Very low	34.5	Very low	158 Å²	158	140.2 Å²	140.2	74%	0.738	75%	0.752	S	S	*	*			trans	61.6	150.5	136.5	-76.9	167.7	121.3	0	0	121.4
425	Q	27.8	Very low	35.5	Very low	151 Å²	151	139.5 Å²	139.5	71%	0.706	75%	0.749	S	S	*	*			cis	-149.2	170.1	2.8	-98.7	150.7	-93.8	0	0	106.1
426	E	28.3	Very low	35.3	Very low	151 Å²	151	140 Å²	140	71%	0.706	75%	0.752	S	S	*	*			cis	-153.1	157.2	-6.8	-102.5	160.4	94.7	0	0	104.9
427	E	32.3	Very low	35.4	Very low	156 Å²	156	140.2 Å²	140.2	73%	0.729	75%	0.754	S	S	*	*				69.1	144.5	54.9	-80.5	-71.3	90.7	0	0	116.6
428	P	49	Very low	35.6	Very low	102 Å²	102	138 Å²	138	66%	0.662	75%	0.75	S	S	*	*			cis	-118.3	-161.4	-12.3	44.6	-30.6	0	0	0	110.9
429	L	31.6	Very low	36.9	Very low	129 Å²	129	137.7 Å²	137.7	68%	0.675	75%	0.751	S	S	*	*			cis	-157.3	-169.2	-1.8	-149.1	58.6	0	0	0	104.9
430	E	30.7	Very low	38.1	Very low	135 Å²	135	131.2 Å²	131.2	63%	0.631	74%	0.74	S	S	*	*			cis	-160.3	152.7	3.5	-172.1	152.8	-160.8	0	0	113.1
431	Q	29.9	Very low	38.1	Very low	162 Å²	162	130.5 Å²	130.5	76%	0.757	74%	0.74	S	S	*	*			trans	64.6	154	157.6	-79.9	168.7	43.5	0	0	123
432	L	32.4	Very low	37.7	Very low	151 Å²	151	129.7 Å²	129.7	79%	0.791	74%	0.737	S	S	*	*			trans	-137.3	141.7	-154.2	-92.9	87.5	0	0	0	110.4
433	L	35.7	Very low	37.8	Very low	158 Å²	158	129.1 Å²	129.1	83%	0.827	74%	0.74	S	S	*	*				78.5	158	79.1	-76.7	170.8	0	0	0	115.2
434	P	46.4	Very low	37.2	Very low	110 Å²	110	128.3 Å²	128.3	71%	0.714	74%	0.741	S	S	*	*			trans	-123.2	-162.7	-130.5	50.4	-38.8	0	0	0	115.3
435	P	53.1	Low	37.4	Very low	117 Å²	117	128.2 Å²	128.2	76%	0.76	75%	0.746	S	S	*	*			trans	-94.1	172.9	-157.1	40.2	-39.8	0	0	0	116.9
436	P	47.8	Very low	37.8	Very low	116 Å²	116	126.2 Å²	126.2	75%	0.753	75%	0.748	S	S	*	*				-154.4	154.7	123.6	40	-22.8	0	0	0	119.4
437	S	32.9	Very low	37.8	Very low	122 Å²	122	122.2 Å²	122.2	85%	0.853	75%	0.748	S	S	*	*			trans	46.3	136.7	141.2	67	0	0	0	0	126.1
438	G	30.5	Very low	37.9	Very low	74 Å²	74	120.5 Å²	120.5	76%	0.763	75%	0.753	S	S	*	*			trans	149.4	134.7	147.2	0	0	0	0	0	119.3
439	P	59.2	Low	37.2	Very low	126 Å²	126	120.2 Å²	120.2	82%	0.818	75%	0.753	S	S	*	*			trans	-107.7	-161.8	171.9	44.6	-36.7	0	0	0	112.2
440	P	52.4	Low	37.2	Very low	108 Å²	108	120.1 Å²	120.1	70%	0.701	76%	0.758	S	S	*	*			cis	-147.3	-167.3	5.3	29.8	-0.9	0	0	0	118.8
441	I	34.2	Very low	37.3	Very low	148 Å²	148	118.1 Å²	118.1	76%	0.759	76%	0.759	S	S	*	*			trans	101.4	122.2	148.3	-49.4	-172	0	0	0	123.4
442	S	32.9	Very low	37.4	Very low	107 Å²	107	117.8 Å²	117.8	75%	0.748	76%	0.761	S	S	*	*			trans	66	158.3	152.4	76.1	0	0	0	0	122
443	V	31.3	Very low	37.4	Very low	133 Å²	133	116.2 Å²	116.2	81%	0.806	76%	0.763	S	S	*	*			cis	-150	140.8	26.1	174	0	0	0	0	115.3
444	A	33.6	Very low	37	Very low	80 Å²	80	112.6 Å²	112.6	66%	0.661	76%	0.764	S	S	*	*			trans	19.9	147.6	151.8	0	0	0	0	0	129.4
445	N	34.2	Very low	36.4	Very low	157 Å²	157	112.3 Å²	112.3	84%	0.84	77%	0.771	S	S	*	*			trans	74.1	152.2	138.1	-80.2	15.2	0	0	0	122.8
446	S	34.2	Very low	35.3	Very low	109 Å²	109	112.7 Å²	112.7	76%	0.762	78%	0.777	S	S	*	*			cis	-170.9	155.8	-8.3	45.6	0	0	0	0	114.8
447	G	29.5	Very low	34.4	Very low	67 Å²	67	110.3 Å²	110.3	69%	0.691	77%	0.773	S	S	*	*			trans	108.9	132.2	160.6	0	0	0	0	0	115.5
448	S	33.8	Very low	34.4	Very low	119 Å²	119	109.9 Å²	109.9	83%	0.832	77%	0.77	S	S	*	*			cis	83.6	133.1	35.8	75	0	0	0	0	115.2
449	S	34.6	Very low	34.3	Very low	96 Å²	96	112.5 Å²	112.5	67%	0.671	76%	0.76	S	S	*	*			cis	-176.3	161.9	-11	49.2	0	0	0	0	110.7
450	T	31.6	Very low	32.8	Very low	128 Å²	128	116.9 Å²	116.9	79%	0.785	76%	0.761	S	S	*	*			trans	60.5	160.9	156.8	46.1	0	0	0	0	119.8
451	S	32.2	Very low	31.7	Very low	92 Å²	92	116.4 Å²	116.4	64%	0.643	75%	0.752	S	S	*	*			cis	-175.5	155.5	-34.8	56.8	0	0	0	0	112
452	L	32.9	Very low	31.7	Very low	155 Å²	155	115 Å²	115	81%	0.812	75%	0.751	S	S	*	*			trans	74.2	116.1	148.2	-78.5	162.8	0	0	0	123.8
453	S	32.7	Very low	31.7	Very low	119 Å²	119	118.2 Å²	118.2	83%	0.832	75%	0.754	S	S	*	*				69.3	138	129.8	66.6	0	0	0	0	124.1
454	G	27.8	Very low	31.5	Very low	81 Å²	81	114.8 Å²	114.8	84%	0.835	75%	0.745	S	S	*	*			trans	175.3	152.2	166.9	0	0	0	0	0	111.1
455	A	32.6	Very low	31.4	Very low	105 Å²	105	120.4 Å²	120.4	87%	0.868	76%	0.757	S	S	*	*			trans	-151	175	-171.3	0	0	0	0	0	115
456	S	30.6	Very low	31.2	Very low	125 Å²	125	121.9 Å²	121.9	87%	0.874	76%	0.759	S	S	*	*			trans	77.9	150	178	-153.5	0	0	0	0	116.3
457	G	29.1	Very low	31.1	Very low	66 Å²	66	125.1 Å²	125.1	68%	0.68	76%	0.763	S	S	*	*			cis	145.6	101.7	-13.8	0	0	0	0	0	115.9
458	S	32.2	Very low	31.8	Very low	113 Å²	113	127 Å²	127	79%	0.79	76%	0.762	S	S	*	*			trans	-172.7	124.9	167.2	49.4	0	0	0	0	108.8
459	K	28.5	Very low	31.5	Very low	128 Å²	128	126.1 Å²	126.1	56%	0.557	76%	0.756	S	S	*	*				68.9	122	72.9	175.3	166.7	172.8	132.6	0	114.7	D461	K459-D461 WeakPolarHBondContact CE-OD1 3.23Å; K459-D461 VanDerWaalsContact CE-OD2 3.3Å; K459-D461 WeakPolarHBondContact CE-OD2 3.29Å; K459-D461 IonicContact NZ-OD1 3.29Å; K459-D461 PolarHBondContact NZ-OD1 2.94Å; K459-D461 VanDerWaalsContact NZ-OD1 3.14Å; K459-D461 IonicContact NZ-OD2 3.14Å; K459-D461 PolarHBondContact NZ-OD2 2.81Å
460	W	28.5	Very low	31.3	Very low	219 Å²	219	130 Å²	130	83%	0.83	76%	0.764	S	S	*	*				-171.4	167	123	-92.6	115.4	0	0	0	112.4
461	D	28.9	Very low	31.3	Very low	98 Å²	98	132.6 Å²	132.6	52%	0.524	77%	0.767	S	S	.	*			trans	-144.6	147	-155.9	5.8	-69.6	0	0	0	107.5	K459	K459-D461 WeakPolarHBondContact CE-OD1 3.23Å; K459-D461 VanDerWaalsContact CE-OD2 3.3Å; K459-D461 WeakPolarHBondContact CE-OD2 3.29Å; K459-D461 IonicContact NZ-OD1 3.29Å; K459-D461 PolarHBondContact NZ-OD1 2.94Å; K459-D461 VanDerWaalsContact NZ-OD1 3.14Å; K459-D461 IonicContact NZ-OD2 3.14Å; K459-D461 PolarHBondContact NZ-OD2 2.81Å
462	V	34.5	Very low	31.2	Very low	119 Å²	119	139.1 Å²	139.1	72%	0.721	78%	0.777	S	S	*	*			cis	-163.5	-179.6	1.9	74.3	0	0	0	0	106.8
463	E	31.6	Very low	31.3	Very low	174 Å²	174	137.4 Å²	137.4	81%	0.813	78%	0.776	S	S	*	*			cis	-147.9	-155.8	17.2	-145.5	89	61.2	0	0	108.1
464	G	28.4	Very low	31.4	Very low	60 Å²	60	138.3 Å²	138.3	62%	0.619	78%	0.776	S	S	*	*			cis	165.4	149.6	-2.7	0	0	0	0	0	114.2
465	E	30.8	Very low	31.6	Very low	198 Å²	198	139.9 Å²	139.9	93%	0.925	77%	0.774	S	S	*	*			trans	60.5	142.2	164.9	-45.7	-160.7	126.7	0	0	120
466	E	30.5	Very low	31.6	Very low	189 Å²	189	139.9 Å²	139.9	88%	0.883	77%	0.774	S	S	*	*			cis	-142.9	165.9	11.9	-139.5	177	166.1	0	0	111.6
467	E	31.6	Very low	31.7	Very low	177 Å²	177	138.6 Å²	138.6	83%	0.827	77%	0.771	S	S	*	*			trans	-116	-172.7	-171.2	-92.5	-89.9	152.8	0	0	111.9
468	P	44.8	Very low	31.7	Very low	105 Å²	105	141.3 Å²	141.3	68%	0.682	78%	0.778	S	S	*	*			cis	-133.4	168.1	-12	36.5	-19.5	0	0	0	116.3
469	S	26.7	Very low	31.9	Very low	101 Å²	101	141.7 Å²	141.7	71%	0.706	78%	0.776	S	S	*	*				172.4	132.5	127.8	58.5	0	0	0	0	114.2
470	E	30.4	Very low	32.1	Very low	179 Å²	179	142.1 Å²	142.1	84%	0.836	79%	0.79	S	S	*	*			trans	29.3	138.9	150.8	-64.5	173	123.4	0	0	120.9
471	E	31.1	Very low	32.3	Very low	181 Å²	181	137.9 Å²	137.9	85%	0.846	79%	0.787	S	S	*	*			cis	-156.5	177.3	16.5	-136.2	-174.1	163.9	0	0	111.8
472	R	31.6	Very low	32.4	Very low	229 Å²	229	141.8 Å²	141.8	86%	0.864	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-86	141.4	-177.3	-65.1	-172.8	-174.4	100.7	-1.8	114.6
473	P	34.3	Very low	32.5	Very low	120 Å²	120	145.1 Å²	145.1	78%	0.779	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-90.2	138.1	147.5	33.8	-29.2	0	0	0	111.5
474	V	34.1	Very low	32.8	Very low	137 Å²	137	145.4 Å²	145.4	83%	0.83	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-92	137.6	174.1	176.6	0	0	0	0	110.3
475	S	32.4	Very low	33.5	Very low	115 Å²	115	150.8 Å²	150.8	80%	0.804	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-66.2	131.1	-177.4	-48	0	0	0	0	113.1
476	A	33.3	Very low	34	Very low	105 Å²	105	146.4 Å²	146.4	87%	0.868	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-77.5	121.2	170.5	0	0	0	0	0	110.8
477	A	32.4	Very low	34.6	Very low	97 Å²	97	143.5 Å²	143.5	80%	0.802	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-83.1	127	171	0	0	0	0	0	110.3
478	C	28.8	Very low	34.7	Very low	123 Å²	123	143.1 Å²	143.1	83%	0.831	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-93.9	117.9	176.3	-171.9	0	0	0	0	110.4
479	T	36.1	Very low	34.2	Very low	122 Å²	122	146 Å²	146	75%	0.748	82%	0.82	S	S	*	*			trans	-105	106.1	171.5	53	0	0	0	0	110	V481	T479-V481 PolarHBondContact O-N 2.96Å
480	T	32.6	Very low	34.7	Very low	137 Å²	137	147 Å²	147	84%	0.84	82%	0.822	S	S	*	*			trans	-66.9	126.5	171.1	47.7	0	0	0	0	110.5
481	V	33.2	Very low	34.8	Very low	129 Å²	129	144.6 Å²	144.6	78%	0.782	82%	0.815	S	S	*	*			trans	-109.1	126.1	169.5	178.8	0	0	0	0	108.8	T479	T479-V481 PolarHBondContact O-N 2.96Å
482	E	32.3	Very low	34.9	Very low	180 Å²	180	141.9 Å²	141.9	84%	0.841	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-76.7	128.4	-177.5	-163.2	173.2	144.8	0	0	110.4
483	M	35.4	Very low	35.1	Very low	189 Å²	189	141.5 Å²	141.5	93%	0.931	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-93.9	124.2	177.2	-77.8	-165.8	-71	0	0	110.9
484	H	37.4	Very low	35.1	Very low	180 Å²	180	147 Å²	147	83%	0.833	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-86.3	141.6	-179.3	-132.8	-78.7	0	0	0	112
485	E	43.9	Very low	35.2	Very low	173 Å²	173	148.3 Å²	148.3	81%	0.808	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-74.4	140.2	-177.6	-164.3	174.3	117.6	0	0	112.8
486	P	40.6	Very low	35.3	Very low	106 Å²	106	147.8 Å²	147.8	69%	0.688	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-82	137.7	-179.7	32	-34.6	0	0	0	113
487	P	43.3	Very low	35.4	Very low	129 Å²	129	153.9 Å²	153.9	84%	0.838	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-75.8	153.4	-177.7	31	-35.8	0	0	0	113.7
488	L	34.6	Very low	35.5	Very low	168 Å²	168	153.7 Å²	153.7	88%	0.88	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-75.1	158.1	-175.9	-67.1	173.7	0	0	0	114.6
489	L	33.7	Very low	35.7	Very low	165 Å²	165	153.7 Å²	153.7	86%	0.864	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-73.5	121.8	-173.6	-162.7	168.3	0	0	0	111.9
490	V	37.2	Very low	35.6	Very low	123 Å²	123	157.1 Å²	157.1	75%	0.745	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-93.6	130.2	176.2	177.7	0	0	0	0	111.2
491	D	32.7	Very low	35.6	Very low	128 Å²	128	156.4 Å²	156.4	68%	0.684	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-74	139.1	178.5	-176.6	15.4	0	0	0	112.4
492	T	33.3	Very low	35.8	Very low	125 Å²	125	155 Å²	155	77%	0.767	81%	0.814	S	S	*	*			trans	-136.3	80.5	175.3	62.2	0	0	0	0	112.3
493	R	35.1	Very low	35.9	Very low	220 Å²	220	151.9 Å²	151.9	83%	0.83	81%	0.812	S	S	*	*			trans	-102.3	136.8	158.5	-74.3	-175.4	172.4	-172.3	0.4	110.8
494	R	34.6	Very low	35.9	Very low	235 Å²	235	148.5 Å²	148.5	89%	0.887	81%	0.807	S	S	*	*			trans	71.7	136.8	-169.5	-50.3	171.5	172.3	-112.3	0.7	111
495	L	37.6	Very low	35.9	Very low	166 Å²	166	151 Å²	151	87%	0.869	81%	0.809	S	S	*	*			cis	-130.1	146.8	30.8	-81.4	161.2	0	0	0	114.9
496	S	34.5	Very low	35.6	Very low	103 Å²	103	147.7 Å²	147.7	72%	0.72	81%	0.811	S	S	*	*			trans	-82.2	154.6	167.6	48.7	0	0	0	0	112.2
497	R	34.2	Very low	35.4	Very low	233 Å²	233	153.7 Å²	153.7	88%	0.879	82%	0.82	S	S	*	*				142.9	115.3	107.1	-166.9	175.9	-161.8	165.9	3.1	115.3
498	A	33.7	Very low	35.4	Very low	94 Å²	94	152.4 Å²	152.4	78%	0.777	81%	0.814	S	S	*	*			trans	66.5	161	162.3	0	0	0	0	0	116
499	S	34	Very low	36.1	Very low	123 Å²	123	151.7 Å²	151.7	86%	0.86	81%	0.811	S	S	*	*			cis	-142	-174.1	24	-65.9	0	0	0	0	114.7
500	K	34	Very low	36.4	Very low	194 Å²	194	151.8 Å²	151.8	84%	0.843	81%	0.812	S	S	*	*			trans	-91.6	158.6	-170.4	-60.9	169	178	172.1	0	113.9
501	S	33.5	Very low	36.9	Very low	121 Å²	121	154.1 Å²	154.1	85%	0.846	82%	0.82	S	S	*	*			trans	69	156.5	156.2	70.5	0	0	0	0	116.3
502	S	35.8	Very low	37.3	Very low	101 Å²	101	152.5 Å²	152.5	71%	0.706	82%	0.824	S	S	*	*			cis	-143.3	162.5	18.1	66.6	0	0	0	0	115.5	S504	S502-S504 PolarHBondContact O-N 3.4Å
503	S	35.3	Very low	37.4	Very low	113 Å²	113	157.3 Å²	157.3	79%	0.79	85%	0.853	S	S	*	*			trans	-69.3	110.4	173.1	148.1	0	0	0	0	111.6	R505	S503-R505 PolarHBondContact O-N 2.88Å
504	S	34.6	Very low	37.5	Very low	118 Å²	118	154.2 Å²	154.2	83%	0.825	85%	0.854	S	S	*	*			trans	-84.6	108.6	170.7	-61.9	0	0	0	0	111.7	S502	S502-S504 PolarHBondContact O-N 3.4Å
505	R	38.2	Very low	37.6	Very low	234 Å²	234	149.9 Å²	149.9	88%	0.883	85%	0.852	S	S	*	*			trans	-93.6	106.9	174.2	-171.2	-174.3	-149.1	163.9	7	108.9	S503	S503-R505 PolarHBondContact O-N 2.88Å
506	A	36.9	Very low	37.6	Very low	102 Å²	102	149 Å²	149	84%	0.843	85%	0.851	S	S	*	*			trans	-55.8	145.3	175	0	0	0	0	0	111.3
507	R	37.5	Very low	37.8	Very low	232 Å²	232	151.7 Å²	151.7	88%	0.875	86%	0.859	S	S	*	*			trans	-131.6	138.6	176.8	-158.1	-179.5	-165.8	128	-0.6	106.8
508	S	42	Very low	38	Very low	102 Å²	102	146.6 Å²	146.6	71%	0.713	86%	0.858	S	S	*	*	S	Bend	trans	-64.5	145.7	165.8	-53.8	0	0	0	0	109.6
509	D	49.5	Very low	38.3	Very low	153 Å²	153	150.1 Å²	150.1	82%	0.818	86%	0.863	S	S	*	*			trans	155.6	5.3	142.4	-71.7	-13.8	0	0	0	113	L511	D509-L511 PolarHBondContact O-N 2.7Å
510	D	41.2	Very low	38.6	Very low	168 Å²	168	152.1 Å²	152.1	90%	0.898	86%	0.863	S	S	*	*			trans	-82.2	86.3	169.1	-67.6	-50.9	0	0	0	112.1
511	L	47.2	Very low	39	Very low	172 Å²	172	148.8 Å²	148.8	90%	0.901	87%	0.865	S	S	*	*			trans	-140.5	80.9	168.4	-95.9	176.6	0	0	0	110.7	D509	D509-L511 PolarHBondContact O-N 2.7Å
512	A	39.7	Very low	39.5	Very low	94 Å²	94	151.2 Å²	151.2	78%	0.777	87%	0.866	S	S	*	*			trans	-161.1	142.7	165	0	0	0	0	0	111.8
513	V	35.7	Very low	39.8	Very low	225 Å²	225	155.7 Å²	155.7	100%	1.364	88%	0.881	S	S	*	*			trans	68.3	0	176.8	-166.2	0	0	0	0	114.6

Retrieved 513 of 513 residues in 136.6 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).