A0A087X2Z0_POEFO Loading...

Regulator of G protein signaling 5a

AlphaFold DB , UniProt , Accession A0A087X2Z0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 183 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	37.9	Very low	52.1	Low	237 Å²	237	125.5 Å²	125.5	100%	1.167	74%	0.737	S	S	*	*				0	96.9	0	-75.2	-171.1	-93.3	0	0	108.3	K3	M1-K3 PolarHBondContact O-N 2.75Å
2	C	42.7	Very low	52.3	Low	134 Å²	134	119.4 Å²	119.4	91%	0.905	71%	0.705	S	S	*	*			trans	-77.6	111.2	-177.8	-59	0	0	0	0	109.2	G4	C2-G4 PolarHBondContact O-N 3.05Å; C2-G4 VanDerWaalsContact O-N 3.07Å
3	K	47.4	Very low	52.6	Low	201 Å²	201	115.9 Å²	115.9	87%	0.874	68%	0.681	S	S	*	*			trans	-72.5	100.3	170.6	-69.7	-177.2	178.7	179.6	0	107.2	M1	M1-K3 PolarHBondContact O-N 2.75Å
4	G	50.1	Low	52.9	Low	53 Å²	53	114.2 Å²	114.2	55%	0.546	66%	0.663	S	S	.	*			trans	-60.6	175	173.7	0	0	0	0	0	112.2	C2 A6	C2-G4 PolarHBondContact O-N 3.05Å; C2-G4 VanDerWaalsContact O-N 3.07Å; G4-A6 PolarHBondContact O-N 3.03Å
5	L	53.9	Low	53.4	Low	147 Å²	147	116.6 Å²	116.6	77%	0.77	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-38.4	-2.8	-175.4	-65.9	157.8	0	0	0	119	A7 L8	L5-A7 VanDerWaalsContact C-N 3.28Å; L5-A7 PolarHBondContact O-N 3.37Å; L5-L8 HydrophobicContact CD2-CD1 4.01Å
6	A	55.1	Low	53.8	Low	104 Å²	104	113 Å²	113	86%	0.86	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-73.9	-6.9	176.6	0	0	0	0	0	114.9	G4	G4-A6 PolarHBondContact O-N 3.03Å
7	A	54.2	Low	54.1	Low	84 Å²	84	112.6 Å²	112.6	69%	0.694	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-94.6	0.8	178.9	0	0	0	0	0	114.2	L5	L5-A7 VanDerWaalsContact C-N 3.28Å; L5-A7 PolarHBondContact O-N 3.37Å
8	L	54.2	Low	54.3	Low	92 Å²	92	111.9 Å²	111.9	48%	0.482	63%	0.626	S	S	.	*	S	Bend	trans	-84.6	132.7	-178.6	-76.1	161.9	0	0	0	110.8	L5 Q10	L5-L8 HydrophobicContact CD2-CD1 4.01Å; L8-Q10 PolarHBondContact O-N 3.04Å
9	P	64.9	Low	54.8	Low	75 Å²	75	109 Å²	109	49%	0.487	61%	0.608	S	S	.	*			trans	-53.4	138.7	174.1	-24.4	33	0	0	0	111.2	T11 C12 L13	P9-T11 PolarHBondContact O-N 2.96Å; P9-C12 WeakPolarHBondContact O-CB 3.37Å; P9-C12 PolarHBondContact O-N 3.05Å; P9-L13 PolarHBondContact O-N 3.04Å
10	Q	57.8	Low	55.1	Low	160 Å²	160	111.9 Å²	111.9	75%	0.748	61%	0.614	S	S	*	*	H	α-helix	trans	-55.9	-27.6	-176.6	-160.2	142.3	-30.6	0	0	112.8	L8 L13 E14	L8-Q10 PolarHBondContact O-N 3.04Å; Q10-L13 PolarHBondContact O-N 3Å; Q10-E14 WeakPolarHBondContact O-CG 3.49Å; Q10-E14 PolarHBondContact O-N 3.23Å; Q10-E14 VanDerWaalsContact O-N 3.09Å
11	T	55.2	Low	55.3	Low	93 Å²	93	110.2 Å²	110.2	57%	0.571	61%	0.61	S	S	*	*	H	α-helix	trans	-67.9	-30.3	174.9	54.2	0	0	0	0	113.8	P9 R15	P9-T11 PolarHBondContact O-N 2.96Å; T11-R15 VanDerWaalsContact O-CG 3.31Å; T11-R15 WeakPolarHBondContact O-CG 3.32Å; T11-R15 PolarHBondContact O-N 3.34Å
12	C	54.2	Low	56.3	Low	53 Å²	53	104.5 Å²	104.5	36%	0.358	58%	0.579	S	S	.	*	H	α-helix	trans	-75.7	-38.1	174.7	-62.7	0	0	0	0	111	P9 R15 A16	P9-C12 WeakPolarHBondContact O-CB 3.37Å; P9-C12 PolarHBondContact O-N 3.05Å; C12-R15 PolarHBondContact O-N 3.22Å; C12-A16 PolarHBondContact O-N 3.26Å
13	L	56.7	Low	56.9	Low	74 Å²	74	101.4 Å²	101.4	39%	0.387	55%	0.553	S	S	.	*	H	α-helix	trans	-69	-40.4	-179.7	-163.8	119.1	0	0	0	112	P9 Q10 A16 K17	P9-L13 PolarHBondContact O-N 3.04Å; Q10-L13 PolarHBondContact O-N 3Å; L13-A16 PolarHBondContact O-N 2.92Å; L13-K17 HydrophobicContact CD2-CD 4.43Å; L13-K17 WeakPolarHBondContact O-CG 3.47Å; L13-K17 PolarHBondContact O-N 3.16Å; L13-K17 VanDerWaalsContact O-N 3.1Å
14	E	57.1	Low	56.9	Low	92 Å²	92	93.3 Å²	93.3	43%	0.43	53%	0.526	S	S	.	.	H	α-helix	trans	-68.4	-37	175.6	-69.3	-52.5	132.7	0	0	112.5	Q10 K17 E18	Q10-E14 WeakPolarHBondContact O-CG 3.49Å; Q10-E14 PolarHBondContact O-N 3.23Å; Q10-E14 VanDerWaalsContact O-N 3.09Å; E14-K17 PolarHBondContact O-N 2.93Å; E14-K17 IonicContact OE1-NZ 2.82Å; E14-K17 PolarHBondContact OE1-NZ 3.15Å; E14-E18 PolarHBondContact O-N 2.77Å
15	R	59.1	Low	57.1	Low	150 Å²	150	95.8 Å²	95.8	57%	0.566	53%	0.531	S	S	*	.	H	α-helix	trans	-65	-40.3	173	-75.3	176.9	-177.5	176.1	3.6	112.6	T11 C12 K17 E18 I19	T11-R15 VanDerWaalsContact O-CG 3.31Å; T11-R15 WeakPolarHBondContact O-CG 3.32Å; T11-R15 PolarHBondContact O-N 3.34Å; C12-R15 PolarHBondContact O-N 3.22Å; R15-K17 VanDerWaalsContact C-N 3.32Å; R15-K17 PolarHBondContact O-N 3.18Å; R15-E18 PolarHBondContact O-N 3.27Å; R15-I19 VanDerWaalsContact O-CG1 3.28Å; R15-I19 WeakPolarHBondContact O-CG1 3.46Å; R15-I19 PolarHBondContact O-N 2.86Å
16	A	59.9	Low	57	Low	59 Å²	59	95.4 Å²	95.4	49%	0.488	53%	0.529	S	S	.	.	H	α-helix	trans	-63	-38.5	175.6	0	0	0	0	0	112	C12 L13 K20	C12-A16 PolarHBondContact O-N 3.26Å; L13-A16 PolarHBondContact O-N 2.92Å; A16-K20 VanDerWaalsContact O-CB 3.31Å; A16-K20 WeakPolarHBondContact O-CB 3.43Å; A16-K20 PolarHBondContact O-N 3.42Å
17	K	59.3	Low	56.7	Low	106 Å²	106	96.3 Å²	96.3	46%	0.461	52%	0.519	S	S	.	.	H	α-helix	trans	-67.2	-39.5	173.9	-71.1	173.2	-173.8	168.7	0	112.4	L13 E14 R15 K20 S21	L13-K17 HydrophobicContact CD2-CD 4.43Å; L13-K17 WeakPolarHBondContact O-CG 3.47Å; L13-K17 PolarHBondContact O-N 3.16Å; L13-K17 VanDerWaalsContact O-N 3.1Å; E14-K17 PolarHBondContact O-N 2.93Å; E14-K17 IonicContact OE1-NZ 2.82Å; E14-K17 PolarHBondContact OE1-NZ 3.15Å; R15-K17 VanDerWaalsContact C-N 3.32Å; R15-K17 PolarHBondContact O-N 3.18Å; K17-K20 PolarHBondContact O-N 3.24Å; K17-S21 VanDerWaalsContact O-CB 3.31Å; K17-S21 WeakPolarHBondContact O-CB 3.35Å; K17-S21 PolarHBondContact O-N 3.43Å
18	E	58.1	Low	56.1	Low	100 Å²	100	100.3 Å²	100.3	47%	0.467	52%	0.523	S	S	.	.	H	α-helix	trans	-67.3	-41.4	178.6	-163.1	-175.1	165.5	0	0	111.7	E14 R15 S21 K22	E14-E18 PolarHBondContact O-N 2.77Å; R15-E18 PolarHBondContact O-N 3.27Å; E18-S21 PolarHBondContact O-N 2.83Å; E18-K22 HydrophobicContact CG-CD 4.48Å; E18-K22 WeakPolarHBondContact O-CG 3.49Å; E18-K22 PolarHBondContact O-N 3.35Å; E18-K22 VanDerWaalsContact OE1-CE 3.25Å; E18-K22 WeakPolarHBondContact OE1-CE 3.31Å; E18-K22 IonicContact OE1-NZ 2.93Å; E18-K22 PolarHBondContact OE1-NZ 2.71Å
19	I	64.3	Low	55.8	Low	57 Å²	57	105 Å²	105	29%	0.292	54%	0.539	S	S	.	.	H	α-helix	trans	-62.2	-46.1	173.4	-68.2	165.8	0	0	0	110.2	R15 S21 K22 L23	R15-I19 VanDerWaalsContact O-CG1 3.28Å; R15-I19 WeakPolarHBondContact O-CG1 3.46Å; R15-I19 PolarHBondContact O-N 2.86Å; I19-S21 VanDerWaalsContact C-N 3.33Å; I19-S21 PolarHBondContact O-N 3.32Å; I19-K22 PolarHBondContact O-N 3.07Å; I19-L23 HydrophobicContact CG2-CD1 3.81Å; I19-L23 WeakPolarHBondContact O-CB 3.45Å; I19-L23 WeakPolarHBondContact O-CD1 3.33Å; I19-L23 PolarHBondContact O-N 3.31Å
20	K	60.9	Low	54.9	Low	166 Å²	166	107.2 Å²	107.2	72%	0.722	55%	0.554	S	S	*	*	H	α-helix	trans	-61.8	-38.4	176.6	-170.8	178	-178.3	179.9	0	112.5	A16 K17 G24	A16-K20 VanDerWaalsContact O-CB 3.31Å; A16-K20 WeakPolarHBondContact O-CB 3.43Å; A16-K20 PolarHBondContact O-N 3.42Å; K17-K20 PolarHBondContact O-N 3.24Å; K20-G24 PolarHBondContact O-N 3.22Å
21	S	58.2	Low	54.2	Low	77 Å²	77	108.3 Å²	108.3	54%	0.538	56%	0.559	S	S	.	*	H	α-helix	trans	-68.8	-46.7	178.2	-177.9	0	0	0	0	112	K17 E18 I19 L23 G24 V25	K17-S21 VanDerWaalsContact O-CB 3.31Å; K17-S21 WeakPolarHBondContact O-CB 3.35Å; K17-S21 PolarHBondContact O-N 3.43Å; E18-S21 PolarHBondContact O-N 2.83Å; I19-S21 VanDerWaalsContact C-N 3.33Å; I19-S21 PolarHBondContact O-N 3.32Å; S21-L23 VanDerWaalsContact C-N 3.33Å; S21-L23 PolarHBondContact O-N 3.42Å; S21-G24 WeakPolarHBondContact O-CA 3.28Å; S21-G24 PolarHBondContact O-N 2.81Å; S21-V25 PolarHBondContact O-N 2.68Å
22	K	58.9	Low	53.7	Low	117 Å²	117	111.6 Å²	111.6	51%	0.509	57%	0.573	S	S	.	*	H	α-helix	trans	-65.8	-34.5	177.9	-70.4	-179.6	-175.9	171	0	112.5	E18 I19	E18-K22 HydrophobicContact CG-CD 4.48Å; E18-K22 WeakPolarHBondContact O-CG 3.49Å; E18-K22 PolarHBondContact O-N 3.35Å; E18-K22 VanDerWaalsContact OE1-CE 3.25Å; E18-K22 WeakPolarHBondContact OE1-CE 3.31Å; E18-K22 IonicContact OE1-NZ 2.93Å; E18-K22 PolarHBondContact OE1-NZ 2.71Å; I19-K22 PolarHBondContact O-N 3.07Å
23	L	55	Low	53.7	Low	69 Å²	69	114 Å²	114	36%	0.361	60%	0.597	S	S	.	*	H	α-helix	trans	-68.9	-34.8	168.9	-82.8	156.4	0	0	0	112.5	I19 S21 L26 K115	I19-L23 HydrophobicContact CG2-CD1 3.81Å; I19-L23 WeakPolarHBondContact O-CB 3.45Å; I19-L23 WeakPolarHBondContact O-CD1 3.33Å; I19-L23 PolarHBondContact O-N 3.31Å; S21-L23 VanDerWaalsContact C-N 3.33Å; S21-L23 PolarHBondContact O-N 3.42Å; L23-L26 VanDerWaalsContact O-CB 3.32Å; L23-L26 WeakPolarHBondContact O-CB 3.42Å; L23-L26 PolarHBondContact O-N 3.12Å; L23-K115 HydrophobicContact CD2-CD 4.27Å
24	G	47.4	Very low	53.1	Low	31 Å²	31	117.6 Å²	117.6	32%	0.32	62%	0.615	S	S	.	*	H	α-helix	trans	-65.9	-36.5	178.1	0	0	0	0	0	114	K20 S21 L26 L27	K20-G24 PolarHBondContact O-N 3.22Å; S21-G24 WeakPolarHBondContact O-CA 3.28Å; S21-G24 PolarHBondContact O-N 2.81Å; G24-L26 PolarHBondContact O-N 3.33Å; G24-L27 WeakPolarHBondContact O-CB 3.42Å; G24-L27 PolarHBondContact O-N 3.42Å
25	V	54.4	Low	52.6	Low	105 Å²	105	120.1 Å²	120.1	64%	0.636	63%	0.631	S	S	*	*	H	α-helix	trans	-64.3	-25.8	174.5	176.8	0	0	0	0	111.7	S21 L27	S21-V25 PolarHBondContact O-N 2.68Å; V25-L27 VanDerWaalsContact C-N 3.26Å; V25-L27 PolarHBondContact O-N 3.03Å
26	L	51.3	Low	51.6	Low	139 Å²	139	120.5 Å²	120.5	73%	0.728	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-9	174.4	-144.9	81.1	0	0	0	113.5	L23 G24	L23-L26 VanDerWaalsContact O-CB 3.32Å; L23-L26 WeakPolarHBondContact O-CB 3.42Å; L23-L26 PolarHBondContact O-N 3.12Å; G24-L26 PolarHBondContact O-N 3.33Å
27	L	48.9	Very low	50.8	Low	124 Å²	124	125 Å²	125	65%	0.649	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	4.5	-173.3	-71.6	170.7	0	0	0	114.5	G24 V25 K29	G24-L27 WeakPolarHBondContact O-CB 3.42Å; G24-L27 PolarHBondContact O-N 3.42Å; V25-L27 VanDerWaalsContact C-N 3.26Å; V25-L27 PolarHBondContact O-N 3.03Å; L27-K29 PolarHBondContact O-N 3.19Å
28	Q	42.6	Very low	50.1	Low	167 Å²	167	126.2 Å²	126.2	78%	0.78	67%	0.668	S	S	*	*			trans	-72.6	100.7	171.7	-70.1	-174	4.4	0	0	109.7
29	K	48	Very low	49.3	Very low	190 Å²	190	126.5 Å²	126.5	83%	0.826	68%	0.679	S	S	*	*			trans	-64.5	130.4	165.5	-86.8	-179.3	171.5	177.6	0	108.8	L27 E31	L27-K29 PolarHBondContact O-N 3.19Å; K29-E31 PolarHBondContact O-N 3.01Å
30	P	45	Very low	47.7	Very low	122 Å²	122	134 Å²	134	79%	0.792	71%	0.705	S	S	*	*			trans	-69.8	121.2	165.5	26.9	-29.2	0	0	0	109.1	N32	P30-N32 PolarHBondContact O-N 3.01Å; P30-N32 VanDerWaalsContact O-N 3.1Å
31	E	44	Very low	47.3	Very low	184 Å²	184	131.5 Å²	131.5	86%	0.86	71%	0.706	S	S	*	*	S	Bend	trans	-74.2	90.6	168.6	-67.2	-175.4	167.1	0	0	108.3	K29	K29-E31 PolarHBondContact O-N 3.01Å
32	N	44.2	Very low	46.4	Very low	161 Å²	161	136.2 Å²	136.2	86%	0.861	72%	0.72	S	S	*	*			trans	-171.8	92.2	157.4	-88.5	-28.9	0	0	0	108	P30 I34	P30-N32 PolarHBondContact O-N 3.01Å; P30-N32 VanDerWaalsContact O-N 3.1Å; N32-I34 PolarHBondContact O-N 2.81Å
33	A	53.5	Low	45.7	Very low	105 Å²	105	139.7 Å²	139.7	87%	0.868	73%	0.734	S	S	*	*			trans	-86.6	97.4	179.3	0	0	0	0	0	110.1
34	I	44.5	Very low	45	Very low	149 Å²	149	142.2 Å²	142.2	76%	0.764	75%	0.753	S	S	*	*			trans	-144.1	117.7	160.1	-48	177	0	0	0	108.3	N32	N32-I34 PolarHBondContact O-N 2.81Å
35	D	46.4	Very low	44.8	Very low	144 Å²	144	147.8 Å²	147.8	77%	0.77	78%	0.775	S	S	*	*			trans	43.1	70.6	160	-64.6	-22.1	0	0	0	120.2
36	L	39.4	Very low	44.2	Very low	158 Å²	158	151.1 Å²	151.1	83%	0.827	78%	0.781	S	S	*	*			trans	-120.8	83.3	149.2	-75.8	163.5	0	0	0	108.7	I38	L36-I38 PolarHBondContact O-N 3.05Å
37	I	42.8	Very low	43.4	Very low	154 Å²	154	153.6 Å²	153.6	79%	0.79	79%	0.786	S	S	*	*			trans	-60.4	90.8	154.3	-64	169.8	0	0	0	105.2	P39	I37-P39 VanDerWaalsContact O-CD 3.25Å; I37-P39 WeakPolarHBondContact O-CD 3.48Å
38	I	44	Very low	43.4	Very low	131 Å²	131	153.5 Å²	153.5	67%	0.672	79%	0.793	S	S	*	*			trans	-65.2	116.2	163.3	-60.1	173.7	0	0	0	103.8	L36 Y40	L36-I38 PolarHBondContact O-N 3.05Å; I38-Y40 PolarHBondContact O-N 2.93Å
39	P	40.9	Very low	44.1	Very low	107 Å²	107	153.8 Å²	153.8	70%	0.695	79%	0.794	S	S	*	*			trans	-58.6	109.1	170.6	-14	28	0	0	0	105.4	I37 P41	I37-P39 VanDerWaalsContact O-CD 3.25Å; I37-P39 WeakPolarHBondContact O-CD 3.48Å; P39-P41 WeakPolarHBondContact O-CD 3.3Å; P39-P41 VanDerWaalsContact O-N 3.07Å
40	Y	32.2	Very low	44.7	Very low	213 Å²	213	154.2 Å²	154.2	84%	0.835	80%	0.796	S	S	*	*			trans	-51	120.9	161.8	-100.8	-101.1	0	0	0	104.4	I38 E42	I38-Y40 PolarHBondContact O-N 2.93Å; Y40-E42 VanDerWaalsContact C-N 3.34Å; Y40-E42 PolarHBondContact O-N 2.99Å
41	P	50.8	Low	46.3	Very low	114 Å²	114	152.7 Å²	152.7	74%	0.74	78%	0.781	S	S	*	*			trans	-57.6	113.6	167.7	24.1	-28.8	0	0	0	104.2	P39 K43	P39-P41 WeakPolarHBondContact O-CD 3.3Å; P39-P41 VanDerWaalsContact O-N 3.07Å; P41-K43 PolarHBondContact O-N 3.29Å; P41-K43 VanDerWaalsContact O-N 3.1Å
42	E	39.2	Very low	48.2	Very low	177 Å²	177	152 Å²	152	83%	0.827	78%	0.777	S	S	*	*			trans	-41.9	126	169.5	-73.6	177.6	155	0	0	105.9	Y40 V44	Y40-E42 VanDerWaalsContact C-N 3.34Å; Y40-E42 PolarHBondContact O-N 2.99Å; E42-V44 PolarHBondContact O-N 3.05Å
43	K	44.7	Very low	50.3	Low	189 Å²	189	148.7 Å²	148.7	82%	0.822	76%	0.755	S	S	*	*			trans	-54.6	105.7	169	-72.5	-179.1	-179.9	179	0	103.9	P41 D45	P41-K43 PolarHBondContact O-N 3.29Å; P41-K43 VanDerWaalsContact O-N 3.1Å; K43-D45 PolarHBondContact O-N 3.41Å
44	V	40	Very low	52.1	Low	123 Å²	123	144.1 Å²	144.1	75%	0.745	72%	0.717	S	S	*	*			trans	-62.3	100.1	167.7	-179.3	0	0	0	0	102.4	E42 K46	E42-V44 PolarHBondContact O-N 3.05Å; V44-K46 HydrophobicContact CG1-CG 4.2Å; V44-K46 PolarHBondContact O-N 2.7Å
45	D	44.4	Very low	54.3	Low	148 Å²	148	139.3 Å²	139.3	79%	0.791	70%	0.7	S	S	*	*			trans	-61.8	77.5	165.2	-75	-37.8	0	0	0	105.4	K43 K47	K43-D45 PolarHBondContact O-N 3.41Å; D45-K47 PolarHBondContact O-N 3.35Å
46	K	41.5	Very low	56.5	Low	174 Å²	174	133.9 Å²	133.9	76%	0.757	67%	0.672	S	S	*	*			trans	-58.4	103.8	160.1	-85.7	-171.3	172.5	-170.2	0	103.2	V44	V44-K46 HydrophobicContact CG1-CG 4.2Å; V44-K46 PolarHBondContact O-N 2.7Å
47	K	35.2	Very low	59.1	Low	191 Å²	191	132.9 Å²	132.9	83%	0.83	66%	0.663	S	S	*	*			trans	-35.7	128.1	158.3	-93	178.5	173.3	173.8	0	106.4	D45 E49	D45-K47 PolarHBondContact O-N 3.35Å; K47-E49 PolarHBondContact O-N 3.07Å
48	P	48.2	Very low	61.4	Low	122 Å²	122	129.4 Å²	129.4	79%	0.792	64%	0.644	S	S	*	*			trans	-52	111.7	179.1	19.3	-29.4	0	0	0	106.6	K50	P48-K50 PolarHBondContact O-N 3.46Å
49	E	57.1	Low	63.8	Low	173 Å²	173	123.1 Å²	123.1	81%	0.808	61%	0.612	S	S	*	*			trans	-55	116.5	173.1	-168.2	167.4	-156.4	0	0	104	K47 L51	K47-E49 PolarHBondContact O-N 3.07Å; E49-L51 PolarHBondContact O-N 2.79Å
50	K	60.3	Low	66.4	Low	200 Å²	200	119 Å²	119	87%	0.87	59%	0.586	S	S	*	*			trans	-57.3	109.8	-175.2	-78.7	-175.9	175.9	-177	0	106.5	P48 Q52	P48-K50 PolarHBondContact O-N 3.46Å; K50-Q52 PolarHBondContact O-N 2.95Å
51	L	78.9	Confident	69.4	Low	90 Å²	90	112.7 Å²	112.7	47%	0.471	56%	0.564	S	S	.	*			trans	-57.1	110.7	174.8	-76.7	159.4	0	0	0	106.6	E49 K53 Y74 A77	E49-L51 PolarHBondContact O-N 2.79Å; L51-K53 PolarHBondContact O-N 3.14Å; L51-Y74 HydrophobicContact CB-CD2 3.92Å; L51-A77 HydrophobicContact CD1-CB 3.81Å
52	Q	84.1	Confident	71.6	Confident	169 Å²	169	107.5 Å²	107.5	79%	0.79	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-70.2	120.4	179.7	-177.3	173.4	-16.8	0	0	107.8	K50 Y74	K50-Q52 PolarHBondContact O-N 2.95Å; Q52-Y74 WeakPolarHBondContact O-CD2 3.43Å
53	K	88.3	Confident	74.2	Confident	91 Å²	91	106.4 Å²	106.4	40%	0.396	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-60.2	129.5	174.6	-170.8	179.9	179	-176.2	0	108.3	L51 Y74 L180	L51-K53 PolarHBondContact O-N 3.14Å; K53-Y74 HydrophobicContact CB-CD2 4.48Å; K53-Y74 HydrophobicContact CB-CE2 3.99Å; K53-Y74 HydrophobicContact CG-CE2 4.2Å; K53-L180 HydrophobicContact CD-CD2 4.4Å; K53-L180 VanDerWaalsContact CE-CD2 3.42Å; K53-L180 HydrophobicContact CG-CD2 4.21Å
54	P	90.8	Very high	76.7	Confident	9 Å²	9	103 Å²	103	6%	0.058	51%	0.505	C	S	.	.	P	Polyproline II helix	trans	-66.2	155.5	178.7	31	-38.6	0	0	0	110.5	E58 A59 W62 Y74	P54-E58 HydrophobicContact CB-CB 4.27Å; P54-E58 HydrophobicContact CB-CG 4.37Å; P54-A59 HydrophobicContact CG-CB 4.15Å; P54-W62 HydrophobicContact CB-CH2 4.46Å; P54-W62 HydrophobicContact CB-CZ2 4.07Å; P54-W62 HydrophobicContact CG-CH2 3.67Å; P54-W62 HydrophobicContact CG-CZ2 3.77Å; P54-Y74 HydrophobicContact CG-CD1 4.3Å
55	A	92.1	Very high	79.4	Confident	49 Å²	49	98.5 Å²	98.5	41%	0.405	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-67.4	151.5	166.8	0	0	0	0	0	110.1	E57 E58 A59	A55-E57 PolarHBondContact O-N 3.47Å; A55-E58 WeakPolarHBondContact O-CB 3.31Å; A55-E58 PolarHBondContact O-N 3.02Å; A55-A59 PolarHBondContact O-N 2.92Å
56	P	92.3	Very high	81.9	Confident	30 Å²	30	91.4 Å²	91.4	20%	0.195	44%	0.441	C	S	.	.	H	α-helix	trans	-52.7	-37.9	177.7	-30.9	38.1	0	0	0	113.9	E58 A59 A60 L180 N183	P56-E58 VanDerWaalsContact C-N 3.33Å; P56-E58 PolarHBondContact O-N 2.96Å; P56-A59 PolarHBondContact O-N 3.38Å; P56-A60 VanDerWaalsContact O-CB 3.22Å; P56-A60 WeakPolarHBondContact O-CB 3.15Å; P56-A60 PolarHBondContact O-N 3.22Å; P56-L180 WeakPolarHBondContact CA-O 3.47Å; P56-N183 WeakPolarHBondContact CG-O 3.41Å
57	E	92.4	Very high	84.6	Confident	136 Å²	136	88.5 Å²	88.5	64%	0.636	43%	0.431	S	S	*	.	H	α-helix	trans	-66.3	-35.4	178.6	-61.2	76.9	-168.4	0	0	112.2	A55 Q61	A55-E57 PolarHBondContact O-N 3.47Å; E57-Q61 WeakPolarHBondContact O-CG 3.37Å
58	E	92.8	Very high	87.5	Confident	81 Å²	81	83.9 Å²	83.9	38%	0.379	41%	0.408	S	S	.	.	H	α-helix	trans	-72.6	-46.9	175.7	-174.6	-174.9	174	0	0	110.6	P54 A55 P56 A60 Q61 N72	P54-E58 HydrophobicContact CB-CB 4.27Å; P54-E58 HydrophobicContact CB-CG 4.37Å; A55-E58 WeakPolarHBondContact O-CB 3.31Å; A55-E58 PolarHBondContact O-N 3.02Å; P56-E58 VanDerWaalsContact C-N 3.33Å; P56-E58 PolarHBondContact O-N 2.96Å; E58-A60 PolarHBondContact O-N 3.3Å; E58-Q61 WeakPolarHBondContact O-CB 3.41Å; E58-Q61 PolarHBondContact O-N 2.91Å; E58-N72 PolarHBondContact OE1-ND2 3.18Å
59	A	94.2	Very high	89.8	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-59.9	-34.6	176.4	0	0	0	0	0	111.7	P54 A55 P56 Q61 W62 Y177 L180 L181	P54-A59 HydrophobicContact CG-CB 4.15Å; A55-A59 PolarHBondContact O-N 2.92Å; P56-A59 PolarHBondContact O-N 3.38Å; A59-Q61 VanDerWaalsContact C-N 3.26Å; A59-Q61 PolarHBondContact O-N 3.29Å; A59-W62 VanDerWaalsContact O-CB 3.27Å; A59-W62 WeakPolarHBondContact O-CB 3.35Å; A59-W62 PolarHBondContact O-N 2.97Å; A59-W62 VanDerWaalsContact O-N 3.14Å; A59-Y177 WeakPolarHBondContact O-CE2 3.23Å; A59-Y177 PolarHBondContact O-OH 3.34Å; A59-L180 HydrophobicContact CB-CB 3.9Å; A59-L181 HydrophobicContact CB-CD2 3.99Å
60	A	94.6	Very high	91.7	Very high	19 Å²	19	70.2 Å²	70.2	16%	0.157	33%	0.334	C	S	.	.	H	α-helix	trans	-62.6	-29.9	175.8	0	0	0	0	0	113.1	P56 E58 W62 R63 L181	P56-A60 VanDerWaalsContact O-CB 3.22Å; P56-A60 WeakPolarHBondContact O-CB 3.15Å; P56-A60 PolarHBondContact O-N 3.22Å; E58-A60 PolarHBondContact O-N 3.3Å; A60-W62 VanDerWaalsContact C-N 3.26Å; A60-W62 PolarHBondContact O-N 3.44Å; A60-R63 VanDerWaalsContact O-CD 3.24Å; A60-R63 WeakPolarHBondContact O-CD 3.18Å; A60-R63 WeakPolarHBondContact O-CG 3.49Å; A60-R63 VanDerWaalsContact O-CZ 3.3Å; A60-R63 PolarHBondContact O-NE 3Å; A60-R63 PolarHBondContact O-NH1 3.28Å; A60-L181 HydrophobicContact CB-CD2 4.16Å
61	Q	95.4	Very high	93.3	Very high	82 Å²	82	66.2 Å²	66.2	38%	0.383	32%	0.322	S	S	.	.	H	α-helix	trans	-72.4	-21.3	177.4	-64.8	174.4	16.2	0	0	112.3	E57 E58 A59 R63 E64 R68	E57-Q61 WeakPolarHBondContact O-CG 3.37Å; E58-Q61 WeakPolarHBondContact O-CB 3.41Å; E58-Q61 PolarHBondContact O-N 2.91Å; A59-Q61 VanDerWaalsContact C-N 3.26Å; A59-Q61 PolarHBondContact O-N 3.29Å; Q61-R63 PolarHBondContact O-N 3.24Å; Q61-R63 VanDerWaalsContact O-N 3.16Å; Q61-E64 WeakPolarHBondContact O-CB 3.23Å; Q61-E64 WeakPolarHBondContact O-CG 3.5Å; Q61-E64 PolarHBondContact O-N 2.82Å; Q61-E64 VanDerWaalsContact O-N 3.07Å; Q61-R68 WeakPolarHBondContact O-CD 3.24Å
62	W	96	Very high	94.1	Very high	5 Å²	5	63.3 Å²	63.3	2%	0.019	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-60.7	-27.4	-178.6	-67.4	-0.1	0	0	0	113.4	P54 A59 A60 E64 S65 V69 N72 Y74 F168 F171 Y177 L180	P54-W62 HydrophobicContact CB-CH2 4.46Å; P54-W62 HydrophobicContact CB-CZ2 4.07Å; P54-W62 HydrophobicContact CG-CH2 3.67Å; P54-W62 HydrophobicContact CG-CZ2 3.77Å; A59-W62 VanDerWaalsContact O-CB 3.27Å; A59-W62 WeakPolarHBondContact O-CB 3.35Å; A59-W62 PolarHBondContact O-N 2.97Å; A59-W62 VanDerWaalsContact O-N 3.14Å; A60-W62 VanDerWaalsContact C-N 3.26Å; A60-W62 PolarHBondContact O-N 3.44Å; W62-E64 PolarHBondContact O-N 2.85Å; W62-E64 VanDerWaalsContact O-N 3.12Å; W62-S65 PolarHBondContact O-N 3.27Å; W62-S65 VanDerWaalsContact O-O 3.07Å; W62-V69 HydrophobicContact CB-CG2 3.68Å; W62-V69 HydrophobicContact CD2-CG2 4.23Å; W62-V69 HydrophobicContact CE3-CG2 4.32Å; W62-V69 HydrophobicContact CG-CG2 3.97Å; W62-N72 HydrophobicContact CZ2-CB 4.11Å; W62-Y74 AromaticContact CH2-CD1 3.96Å; W62-Y74 HydrophobicContact CH2-CD1 3.96Å; W62-F168 VanDerWaalsContact O-CZ 3.27Å; W62-F168 WeakPolarHBondContact O-CZ 3.46Å; W62-F171 HydrophobicContact CE3-CE1 4.47Å; W62-Y177 HydrophobicContact CB-CE2 4.1Å; W62-Y177 HydrophobicContact CD2-CE2 4.42Å; W62-Y177 AromaticContact CE3-CD2 3.98Å; W62-Y177 HydrophobicContact CE3-CD2 3.98Å; W62-Y177 AromaticContact CE3-CE2 3.71Å; W62-Y177 HydrophobicContact CE3-CE2 3.71Å; W62-Y177 HydrophobicContact CZ3-CD2 4.44Å; W62-L180 HydrophobicContact CE3-CD1 4.46Å; W62-L180 HydrophobicContact CH2-CD1 4.04Å; W62-L180 HydrophobicContact CZ3-CD1 3.55Å
63	R	95.5	Very high	94.5	Very high	154 Å²	154	59 Å²	59	58%	0.581	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-61.8	-17.3	176.4	75.5	-165.1	172	-135.8	-4.9	114.2	A60 Q61 L172	A60-R63 VanDerWaalsContact O-CD 3.24Å; A60-R63 WeakPolarHBondContact O-CD 3.18Å; A60-R63 WeakPolarHBondContact O-CG 3.49Å; A60-R63 VanDerWaalsContact O-CZ 3.3Å; A60-R63 PolarHBondContact O-NE 3Å; A60-R63 PolarHBondContact O-NH1 3.28Å; Q61-R63 PolarHBondContact O-N 3.24Å; Q61-R63 VanDerWaalsContact O-N 3.16Å; R63-L172 HydrophobicContact CB-CD1 4.14Å; R63-L172 HydrophobicContact CB-CD2 4.25Å
64	E	95.5	Very high	94.9	Very high	116 Å²	116	57.6 Å²	57.6	54%	0.542	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-73.9	-34.4	-177.8	-63.4	174.8	-162.6	0	0	112.5	Q61 W62 R68	Q61-E64 WeakPolarHBondContact O-CB 3.23Å; Q61-E64 WeakPolarHBondContact O-CG 3.5Å; Q61-E64 PolarHBondContact O-N 2.82Å; Q61-E64 VanDerWaalsContact O-N 3.07Å; W62-E64 PolarHBondContact O-N 2.85Å; W62-E64 VanDerWaalsContact O-N 3.12Å; E64-R68 IonicContact OE1-NH2 3.68Å; E64-R68 IonicContact OE2-CZ 3.22Å; E64-R68 IonicContact OE2-NE 2.95Å; E64-R68 PolarHBondContact OE2-NE 3.14Å; E64-R68 IonicContact OE2-NH2 3.31Å; E64-R68 PolarHBondContact OE2-NH2 2.95Å
65	S	97.2	Very high	95.1	Very high	29 Å²	29	57.1 Å²	57.1	20%	0.203	29%	0.285	C	S	.	.			trans	-163.3	149.6	177.7	67.4	0	0	0	0	112.4	W62 E67 R68	W62-S65 PolarHBondContact O-N 3.27Å; W62-S65 VanDerWaalsContact O-O 3.07Å; S65-E67 PolarHBondContact O-N 2.89Å; S65-R68 PolarHBondContact O-N 3.26Å; S65-R68 PolarHBondContact OG-N 3.41Å
66	L	98	Very high	95.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.8	-35.1	171.9	174.6	62.6	0	0	0	110.8	R68 V69 L70 F79 Y160 M163 E164 F168	L66-R68 VanDerWaalsContact C-N 3.28Å; L66-R68 PolarHBondContact O-N 3.27Å; L66-V69 HydrophobicContact CD1-CB 4.35Å; L66-V69 WeakPolarHBondContact O-CA 3.5Å; L66-V69 VanDerWaalsContact O-CB 3.31Å; L66-V69 WeakPolarHBondContact O-CB 3.42Å; L66-V69 PolarHBondContact O-N 2.94Å; L66-L70 HydrophobicContact CD1-CD1 4.46Å; L66-L70 HydrophobicContact CD1-CD2 3.96Å; L66-L70 HydrophobicContact CD1-CG 4.03Å; L66-L70 HydrophobicContact CD2-CD1 4.36Å; L66-L70 HydrophobicContact CG-CD1 4.02Å; L66-L70 HydrophobicContact CG-CD2 4.41Å; L66-L70 HydrophobicContact CG-CG 3.99Å; L66-L70 WeakPolarHBondContact O-CG 3.35Å; L66-L70 PolarHBondContact O-N 3.37Å; L66-F79 HydrophobicContact CD1-CD1 4.02Å; L66-F79 HydrophobicContact CD1-CE1 3.64Å; L66-F79 HydrophobicContact CD1-CE2 4.29Å; L66-F79 HydrophobicContact CD1-CG 4.49Å; L66-F79 HydrophobicContact CD1-CZ 3.79Å; L66-Y160 HydrophobicContact CB-CE2 4.09Å; L66-Y160 WeakPolarHBondContact CB-OH 3.36Å; L66-Y160 HydrophobicContact CD2-CD2 4.06Å; L66-Y160 HydrophobicContact CD2-CE2 3.85Å; L66-Y160 HydrophobicContact CG-CE2 3.88Å; L66-M163 HydrophobicContact CD2-CB 3.79Å; L66-E164 HydrophobicContact CB-CB 4.35Å; L66-E164 HydrophobicContact CB-CG 4.29Å; L66-E164 HydrophobicContact CD2-CB 3.96Å; L66-F168 HydrophobicContact CB-CD1 4.13Å; L66-F168 HydrophobicContact CB-CD2 4.19Å; L66-F168 HydrophobicContact CB-CE1 4.39Å; L66-F168 HydrophobicContact CB-CE2 4.45Å; L66-F168 HydrophobicContact CB-CG 4.03Å; L66-F168 HydrophobicContact CD1-CB 4.34Å; L66-F168 HydrophobicContact CD1-CD2 3.83Å; L66-F168 HydrophobicContact CD1-CE2 4.45Å; L66-F168 HydrophobicContact CD1-CG 4.19Å
67	E	96.9	Very high	95.6	Very high	113 Å²	113	56.4 Å²	56.4	53%	0.528	28%	0.277	S	S	.	.	H	α-helix	trans	-52.2	-41.4	175.1	-179.1	176	-167.6	0	0	113.4	S65 V69 L70 N71 Y160	S65-E67 PolarHBondContact O-N 2.89Å; E67-V69 VanDerWaalsContact C-N 3.29Å; E67-V69 PolarHBondContact O-N 3.33Å; E67-L70 PolarHBondContact O-N 3.46Å; E67-N71 VanDerWaalsContact CG-ND2 3.32Å; E67-N71 WeakPolarHBondContact CG-ND2 3.47Å; E67-N71 WeakPolarHBondContact O-CB 3.34Å; E67-N71 PolarHBondContact O-N 2.86Å; E67-N71 PolarHBondContact O-ND2 2.99Å; E67-Y160 PolarHBondContact N-OH 2.65Å
68	R	96.4	Very high	95.8	Very high	94 Å²	94	50.1 Å²	50.1	36%	0.355	25%	0.248	S	C	.	.	H	α-helix	trans	-63.1	-37	177	-75.5	-179.6	175.8	-99	11.5	112.1	Q61 E64 S65 L66 N72	Q61-R68 WeakPolarHBondContact O-CD 3.24Å; E64-R68 IonicContact OE1-NH2 3.68Å; E64-R68 IonicContact OE2-CZ 3.22Å; E64-R68 IonicContact OE2-NE 2.95Å; E64-R68 PolarHBondContact OE2-NE 3.14Å; E64-R68 IonicContact OE2-NH2 3.31Å; E64-R68 PolarHBondContact OE2-NH2 2.95Å; S65-R68 PolarHBondContact O-N 3.26Å; S65-R68 PolarHBondContact OG-N 3.41Å; L66-R68 VanDerWaalsContact C-N 3.28Å; L66-R68 PolarHBondContact O-N 3.27Å; R68-N72 PolarHBondContact O-N 3.47Å
69	V	97.3	Very high	96.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.4	-47.8	174.2	179.3	0	0	0	0	110.5	W62 L66 E67 N71 N72 G75 L76 F79 F168 F171	W62-V69 HydrophobicContact CB-CG2 3.68Å; W62-V69 HydrophobicContact CD2-CG2 4.23Å; W62-V69 HydrophobicContact CE3-CG2 4.32Å; W62-V69 HydrophobicContact CG-CG2 3.97Å; L66-V69 HydrophobicContact CD1-CB 4.35Å; L66-V69 WeakPolarHBondContact O-CA 3.5Å; L66-V69 VanDerWaalsContact O-CB 3.31Å; L66-V69 WeakPolarHBondContact O-CB 3.42Å; L66-V69 PolarHBondContact O-N 2.94Å; E67-V69 VanDerWaalsContact C-N 3.29Å; E67-V69 PolarHBondContact O-N 3.33Å; V69-N71 VanDerWaalsContact C-N 3.33Å; V69-N71 PolarHBondContact O-N 3.43Å; V69-N72 PolarHBondContact O-N 2.96Å; V69-N72 VanDerWaalsContact O-O 3.08Å; V69-G75 VanDerWaalsContact CG1-O 3.31Å; V69-G75 WeakPolarHBondContact CG1-O 3.22Å; V69-G75 CarbonylContact O-C 3.58Å; V69-L76 PolarHBondContact O-N 3.16Å; V69-F79 HydrophobicContact CG1-CB 3.72Å; V69-F79 HydrophobicContact CG1-CG 4.24Å; V69-F168 HydrophobicContact CG2-CE2 3.76Å; V69-F171 HydrophobicContact CG1-CE1 4.18Å; V69-F171 HydrophobicContact CG2-CE1 4.12Å
70	L	97.1	Very high	96.3	Very high	8 Å²	8	50 Å²	50	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-70.8	-27.1	-174.4	-57.7	-170.8	0	0	0	113.5	L66 E67 L76 F79 I92 W95 Y160	L66-L70 HydrophobicContact CD1-CD1 4.46Å; L66-L70 HydrophobicContact CD1-CD2 3.96Å; L66-L70 HydrophobicContact CD1-CG 4.03Å; L66-L70 HydrophobicContact CD2-CD1 4.36Å; L66-L70 HydrophobicContact CG-CD1 4.02Å; L66-L70 HydrophobicContact CG-CD2 4.41Å; L66-L70 HydrophobicContact CG-CG 3.99Å; L66-L70 WeakPolarHBondContact O-CG 3.35Å; L66-L70 PolarHBondContact O-N 3.37Å; E67-L70 PolarHBondContact O-N 3.46Å; L70-L76 HydrophobicContact CD2-CD1 3.96Å; L70-F79 HydrophobicContact CD2-CD1 3.89Å; L70-F79 HydrophobicContact CD2-CE1 4.39Å; L70-I92 HydrophobicContact CD1-CD1 4.48Å; L70-I92 HydrophobicContact CD2-CD1 3.58Å; L70-W95 HydrophobicContact CB-CH2 3.73Å; L70-W95 HydrophobicContact CB-CZ2 4.15Å; L70-W95 HydrophobicContact CB-CZ3 4.09Å; L70-W95 HydrophobicContact CD1-CD2 3.91Å; L70-W95 HydrophobicContact CD1-CE3 4.17Å; L70-W95 HydrophobicContact CD1-CH2 3.98Å; L70-W95 HydrophobicContact CD1-CZ2 3.69Å; L70-W95 HydrophobicContact CD1-CZ3 4.2Å; L70-W95 HydrophobicContact CG-CH2 4.45Å; L70-Y160 HydrophobicContact CD1-CD2 3.89Å; L70-Y160 HydrophobicContact CD1-CE2 3.9Å
71	N	94.3	Very high	96.4	Very high	115 Å²	115	51.9 Å²	51.9	62%	0.615	26%	0.256	S	S	*	.	H	α-helix	trans	-82.8	-14.8	177.5	-74.1	-23.6	0	0	0	113.7	E67 V69	E67-N71 VanDerWaalsContact CG-ND2 3.32Å; E67-N71 WeakPolarHBondContact CG-ND2 3.47Å; E67-N71 WeakPolarHBondContact O-CB 3.34Å; E67-N71 PolarHBondContact O-N 2.86Å; E67-N71 PolarHBondContact O-ND2 2.99Å; V69-N71 VanDerWaalsContact C-N 3.33Å; V69-N71 PolarHBondContact O-N 3.43Å
72	N	94.3	Very high	96.5	Very high	29 Å²	29	48.6 Å²	48.6	16%	0.155	24%	0.24	C	C	.	.	S	Bend	trans	-95.4	131.1	172.7	-179.9	-70	0	0	0	109.9	E58 W62 R68 V69 Y74 G75 L76	E58-N72 PolarHBondContact OE1-ND2 3.18Å; W62-N72 HydrophobicContact CZ2-CB 4.11Å; R68-N72 PolarHBondContact O-N 3.47Å; V69-N72 PolarHBondContact O-N 2.96Å; V69-N72 VanDerWaalsContact O-O 3.08Å; N72-Y74 PolarHBondContact O-N 3.06Å; N72-Y74 WeakPolarHBondContact OD1-CA 3.39Å; N72-Y74 WeakPolarHBondContact OD1-CB 3.27Å; N72-Y74 PolarHBondContact OD1-N 3.39Å; N72-G75 PolarHBondContact O-N 3.12Å; N72-G75 PolarHBondContact OD1-N 3.07Å; N72-L76 WeakPolarHBondContact O-CB 3.47Å; N72-L76 PolarHBondContact O-N 3.45Å
73	S	93.8	Very high	96.6	Very high	79 Å²	79	48.3 Å²	48.3	55%	0.552	24%	0.239	S	C	*	.	H	α-helix	trans	-64	-37.9	-176.6	55.6	0	0	0	0	113.4	A77	S73-A77 WeakPolarHBondContact O-CB 3.29Å; S73-A77 PolarHBondContact O-N 3.26Å
74	Y	95.3	Very high	96.8	Very high	61 Å²	61	45 Å²	45	24%	0.239	23%	0.231	C	C	.	.	H	α-helix	trans	-70.8	-43.5	174	-166.6	-74.2	0	0	0	110.9	L51 Q52 K53 P54 W62 N72 L76 A77 A78 L180	L51-Y74 HydrophobicContact CB-CD2 3.92Å; Q52-Y74 WeakPolarHBondContact O-CD2 3.43Å; K53-Y74 HydrophobicContact CB-CD2 4.48Å; K53-Y74 HydrophobicContact CB-CE2 3.99Å; K53-Y74 HydrophobicContact CG-CE2 4.2Å; P54-Y74 HydrophobicContact CG-CD1 4.3Å; W62-Y74 AromaticContact CH2-CD1 3.96Å; W62-Y74 HydrophobicContact CH2-CD1 3.96Å; N72-Y74 PolarHBondContact O-N 3.06Å; N72-Y74 WeakPolarHBondContact OD1-CA 3.39Å; N72-Y74 WeakPolarHBondContact OD1-CB 3.27Å; N72-Y74 PolarHBondContact OD1-N 3.39Å; Y74-L76 PolarHBondContact O-N 3.04Å; Y74-A77 PolarHBondContact O-N 3.29Å; Y74-A78 HydrophobicContact CD1-CB 4.37Å; Y74-A78 HydrophobicContact CE1-CB 4.37Å; Y74-A78 WeakPolarHBondContact O-CB 3.27Å; Y74-A78 PolarHBondContact O-N 3.29Å; Y74-L180 HydrophobicContact CE1-CD1 4.05Å; Y74-L180 HydrophobicContact CE1-CD2 3.84Å
75	G	96.3	Very high	96.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.7	-48.3	176.8	0	0	0	0	0	112	V69 N72 A77 A78 F79	V69-G75 VanDerWaalsContact CG1-O 3.31Å; V69-G75 WeakPolarHBondContact CG1-O 3.22Å; V69-G75 CarbonylContact O-C 3.58Å; N72-G75 PolarHBondContact O-N 3.12Å; N72-G75 PolarHBondContact OD1-N 3.07Å; G75-A77 PolarHBondContact O-N 2.63Å; G75-A78 PolarHBondContact O-N 3.34Å; G75-F79 WeakPolarHBondContact O-CB 3.22Å; G75-F79 PolarHBondContact O-N 3.08Å
76	L	97.4	Very high	96.8	Very high	32 Å²	32	44.9 Å²	44.9	17%	0.168	24%	0.236	C	C	.	.	H	α-helix	trans	-58.2	-46.5	175.2	178.4	62.2	0	0	0	111.8	V69 L70 N72 Y74 R80 I92 M96	V69-L76 PolarHBondContact O-N 3.16Å; L70-L76 HydrophobicContact CD2-CD1 3.96Å; N72-L76 WeakPolarHBondContact O-CB 3.47Å; N72-L76 PolarHBondContact O-N 3.45Å; Y74-L76 PolarHBondContact O-N 3.04Å; L76-R80 VanDerWaalsContact O-CB 3.3Å; L76-R80 WeakPolarHBondContact O-CB 3.38Å; L76-R80 PolarHBondContact O-N 3.02Å; L76-I92 HydrophobicContact CD1-CD1 3.69Å; L76-I92 HydrophobicContact CD1-CG1 3.92Å; L76-M96 HydrophobicContact CD1-CG 4.2Å; L76-M96 HydrophobicContact CD1-SD 4.03Å; L76-M96 HydrophobicContact CD2-CE 4.21Å; L76-M96 HydrophobicContact CD2-CG 4.44Å; L76-M96 HydrophobicContact CD2-SD 4.18Å; L76-M96 HydrophobicContact CG-SD 4.3Å
77	A	96.8	Very high	96.7	Very high	31 Å²	31	53.7 Å²	53.7	26%	0.256	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-43	178	0	0	0	0	0	111.9	L51 S73 Y74 G75 R80 S81	L51-A77 HydrophobicContact CD1-CB 3.81Å; S73-A77 WeakPolarHBondContact O-CB 3.29Å; S73-A77 PolarHBondContact O-N 3.26Å; Y74-A77 PolarHBondContact O-N 3.29Å; G75-A77 PolarHBondContact O-N 2.63Å; A77-R80 PolarHBondContact O-N 2.79Å; A77-S81 PolarHBondContact O-N 2.93Å; A77-S81 PolarHBondContact O-OG 3.4Å
78	A	96.9	Very high	96.7	Very high	4 Å²	4	49.1 Å²	49.1	3%	0.033	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-46.5	178.3	0	0	0	0	0	111.6	Y74 G75 S81 F82 F171 Q176	Y74-A78 HydrophobicContact CD1-CB 4.37Å; Y74-A78 HydrophobicContact CE1-CB 4.37Å; Y74-A78 WeakPolarHBondContact O-CB 3.27Å; Y74-A78 PolarHBondContact O-N 3.29Å; G75-A78 PolarHBondContact O-N 3.34Å; A78-S81 PolarHBondContact O-N 2.95Å; A78-F82 PolarHBondContact O-N 2.79Å; A78-F171 HydrophobicContact CB-CE2 4.19Å; A78-F171 HydrophobicContact CB-CZ 4.24Å; A78-Q176 PolarHBondContact O-NE2 3.32Å
79	F	98.3	Very high	96.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65.1	-39.1	178	-171.3	-120	0	0	0	112.1	L66 V69 L70 G75 F82 L83 I92 M163 F171	L66-F79 HydrophobicContact CD1-CD1 4.02Å; L66-F79 HydrophobicContact CD1-CE1 3.64Å; L66-F79 HydrophobicContact CD1-CE2 4.29Å; L66-F79 HydrophobicContact CD1-CG 4.49Å; L66-F79 HydrophobicContact CD1-CZ 3.79Å; V69-F79 HydrophobicContact CG1-CB 3.72Å; V69-F79 HydrophobicContact CG1-CG 4.24Å; L70-F79 HydrophobicContact CD2-CD1 3.89Å; L70-F79 HydrophobicContact CD2-CE1 4.39Å; G75-F79 WeakPolarHBondContact O-CB 3.22Å; G75-F79 PolarHBondContact O-N 3.08Å; F79-F82 HydrophobicContact CD2-CD1 4.38Å; F79-F82 HydrophobicContact CE2-CD1 4.32Å; F79-F82 WeakPolarHBondContact O-CB 3.36Å; F79-F82 PolarHBondContact O-N 2.71Å; F79-L83 HydrophobicContact CD1-CD1 3.93Å; F79-L83 HydrophobicContact CD1-CG 4.47Å; F79-L83 HydrophobicContact CE1-CD1 3.57Å; F79-L83 HydrophobicContact CE1-CG 4.2Å; F79-L83 HydrophobicContact CE2-CD2 4.32Å; F79-L83 HydrophobicContact CE2-CG 4.38Å; F79-L83 HydrophobicContact CZ-CD1 3.95Å; F79-L83 HydrophobicContact CZ-CD2 4.05Å; F79-L83 HydrophobicContact CZ-CG 4.15Å; F79-L83 WeakPolarHBondContact O-CG 3.03Å; F79-L83 PolarHBondContact O-N 3.26Å; F79-I92 HydrophobicContact CD1-CD1 4.33Å; F79-M163 HydrophobicContact CE1-CB 4.32Å; F79-M163 HydrophobicContact CE1-SD 3.91Å; F79-M163 HydrophobicContact CZ-CB 4.21Å; F79-F171 HydrophobicContact CB-CE2 4.43Å; F79-F171 HydrophobicContact CB-CZ 4.48Å; F79-F171 HydrophobicContact CD2-CB 3.79Å; F79-F171 AromaticContact CD2-CD1 3.9Å; F79-F171 HydrophobicContact CD2-CD1 3.9Å; F79-F171 AromaticContact CD2-CD2 3.9Å; F79-F171 HydrophobicContact CD2-CD2 3.9Å; F79-F171 HydrophobicContact CD2-CE1 4.46Å; F79-F171 HydrophobicContact CD2-CE2 4.45Å; F79-F171 AromaticContact CD2-CG 3.58Å; F79-F171 HydrophobicContact CD2-CG 3.58Å; F79-F171 HydrophobicContact CE2-CB 3.82Å; F79-F171 HydrophobicContact CE2-CD1 4.48Å; F79-F171 HydrophobicContact CE2-CG 4.12Å
80	R	98.3	Very high	96.9	Very high	80 Å²	80	48 Å²	48	30%	0.302	26%	0.255	S	S	.	.	H	α-helix	trans	-59.9	-48.3	172.5	179	-177	175.1	154.1	12.5	111.9	L76 A77 F82 L83 Q84 I92 E93	L76-R80 VanDerWaalsContact O-CB 3.3Å; L76-R80 WeakPolarHBondContact O-CB 3.38Å; L76-R80 PolarHBondContact O-N 3.02Å; A77-R80 PolarHBondContact O-N 2.79Å; R80-F82 VanDerWaalsContact C-N 3.26Å; R80-F82 PolarHBondContact O-N 2.73Å; R80-L83 PolarHBondContact O-N 2.92Å; R80-Q84 WeakPolarHBondContact O-CG 3.49Å; R80-Q84 PolarHBondContact O-N 2.91Å; R80-I92 HydrophobicContact CB-CG2 4.17Å; R80-I92 HydrophobicContact CG-CG2 4.06Å; R80-E93 WeakPolarHBondContact CD-OE1 3.3Å; R80-E93 IonicContact CZ-OE1 3.93Å; R80-E93 IonicContact CZ-OE2 2.79Å; R80-E93 IonicContact NE-OE1 2.71Å; R80-E93 PolarHBondContact NE-OE1 3.45Å; R80-E93 IonicContact NH1-OE1 3.46Å; R80-E93 PolarHBondContact NH1-OE1 3.5Å; R80-E93 IonicContact NH1-OE2 3.93Å; R80-E93 IonicContact NH2-OE1 3.89Å; R80-E93 PolarHBondContact NH2-OE1 3.13Å; R80-E93 IonicContact NH2-OE2 2.95Å; R80-E93 PolarHBondContact NH2-OE2 2.8Å
81	S	97.8	Very high	96.9	Very high	57 Å²	57	48 Å²	48	40%	0.399	26%	0.255	S	S	.	.	H	α-helix	trans	-60.5	-38.1	177.1	-63	0	0	0	0	112.1	A77 A78 Q84 S85	A77-S81 PolarHBondContact O-N 2.93Å; A77-S81 PolarHBondContact O-OG 3.4Å; A78-S81 PolarHBondContact O-N 2.95Å; S81-Q84 WeakPolarHBondContact O-CB 3.39Å; S81-Q84 PolarHBondContact O-N 3.05Å; S81-S85 PolarHBondContact O-N 3.18Å; S81-S85 VanDerWaalsContact O-N 3.15Å
82	F	98.2	Very high	97.1	Very high	13 Å²	13	42.6 Å²	42.6	6%	0.057	23%	0.226	C	C	.	.	H	α-helix	trans	-63	-46.8	174	173.3	-94.6	0	0	0	112	A78 F79 R80 Q84 S85 E86 S167 R170 F171	A78-F82 PolarHBondContact O-N 2.79Å; F79-F82 HydrophobicContact CD2-CD1 4.38Å; F79-F82 HydrophobicContact CE2-CD1 4.32Å; F79-F82 WeakPolarHBondContact O-CB 3.36Å; F79-F82 PolarHBondContact O-N 2.71Å; R80-F82 VanDerWaalsContact C-N 3.26Å; R80-F82 PolarHBondContact O-N 2.73Å; F82-Q84 VanDerWaalsContact C-N 3.25Å; F82-Q84 PolarHBondContact O-N 3.48Å; F82-S85 PolarHBondContact O-N 3.45Å; F82-S85 PolarHBondContact O-OG 3.25Å; F82-E86 HydrophobicContact CE1-CG 4.37Å; F82-E86 VanDerWaalsContact CE1-OE2 3.28Å; F82-E86 WeakPolarHBondContact CE1-OE2 3.43Å; F82-E86 HydrophobicContact CE2-CG 4.43Å; F82-E86 HydrophobicContact CZ-CG 4.08Å; F82-E86 WeakPolarHBondContact CZ-OE1 3.38Å; F82-E86 WeakPolarHBondContact CZ-OE2 3.45Å; F82-E86 PolarHBondContact O-N 3.28Å; F82-S167 WeakPolarHBondContact CE1-O 3.49Å; F82-R170 HydrophobicContact CE1-CB 4.29Å; F82-R170 HydrophobicContact CZ-CB 3.64Å; F82-F171 HydrophobicContact CB-CD2 3.74Å; F82-F171 HydrophobicContact CB-CE2 4.36Å; F82-F171 HydrophobicContact CD1-CB 3.72Å; F82-F171 HydrophobicContact CD1-CD2 4.16Å; F82-F171 HydrophobicContact CD1-CG 4.4Å; F82-F171 HydrophobicContact CD2-CB 4.46Å; F82-F171 HydrophobicContact CD2-CD2 4.25Å; F82-F171 HydrophobicContact CE1-CB 3.82Å; F82-F171 HydrophobicContact CG-CB 4.07Å; F82-F171 AromaticContact CG-CD2 3.77Å; F82-F171 HydrophobicContact CG-CD2 3.77Å; F82-F171 HydrophobicContact CG-CG 4.41Å; F82-F171 HydrophobicContact CZ-CB 4.26Å
83	L	98.1	Very high	97.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.3	-30.2	177.1	-65.9	175.1	0	0	0	112.6	F79 R80 E86 F87 S88 D89 I92 M163 S167	F79-L83 HydrophobicContact CD1-CD1 3.93Å; F79-L83 HydrophobicContact CD1-CG 4.47Å; F79-L83 HydrophobicContact CE1-CD1 3.57Å; F79-L83 HydrophobicContact CE1-CG 4.2Å; F79-L83 HydrophobicContact CE2-CD2 4.32Å; F79-L83 HydrophobicContact CE2-CG 4.38Å; F79-L83 HydrophobicContact CZ-CD1 3.95Å; F79-L83 HydrophobicContact CZ-CD2 4.05Å; F79-L83 HydrophobicContact CZ-CG 4.15Å; F79-L83 WeakPolarHBondContact O-CG 3.03Å; F79-L83 PolarHBondContact O-N 3.26Å; R80-L83 PolarHBondContact O-N 2.92Å; L83-E86 CarbonylContact O-C 3.58Å; L83-E86 PolarHBondContact O-N 2.96Å; L83-F87 PolarHBondContact O-N 3.01Å; L83-F87 VanDerWaalsContact O-N 3.07Å; L83-S88 VanDerWaalsContact CD2-OG 3.31Å; L83-S88 WeakPolarHBondContact CD2-OG 3.39Å; L83-S88 PolarHBondContact O-N 3.11Å; L83-D89 HydrophobicContact CB-CB 4.1Å; L83-D89 PolarHBondContact O-N 3.19Å; L83-I92 HydrophobicContact CD1-CB 3.55Å; L83-I92 HydrophobicContact CD1-CG2 3.56Å; L83-M163 HydrophobicContact CD1-SD 4Å; L83-S167 WeakPolarHBondContact CD2-OG 3.44Å
84	Q	97.8	Very high	97.6	Very high	85 Å²	85	39 Å²	39	40%	0.397	20%	0.199	S	C	.	.	H	α-helix	trans	-66.1	-38.4	174	-74.9	177.7	-23.8	0	0	112.3	R80 S81 F82 E86 F87 D89	R80-Q84 WeakPolarHBondContact O-CG 3.49Å; R80-Q84 PolarHBondContact O-N 2.91Å; S81-Q84 WeakPolarHBondContact O-CB 3.39Å; S81-Q84 PolarHBondContact O-N 3.05Å; F82-Q84 VanDerWaalsContact C-N 3.25Å; F82-Q84 PolarHBondContact O-N 3.48Å; Q84-E86 PolarHBondContact O-N 3.04Å; Q84-F87 PolarHBondContact O-N 3.29Å; Q84-D89 HydrophobicContact CB-CB 4.32Å; Q84-D89 HydrophobicContact CG-CB 3.44Å; Q84-D89 VanDerWaalsContact CG-CB 3.44Å; Q84-D89 PolarHBondContact NE2-OD2 3.25Å
85	S	97.3	Very high	97.7	Very high	83 Å²	83	37.5 Å²	37.5	58%	0.58	19%	0.193	S	C	*	.	H	α-helix	trans	-69.9	-23.8	176.3	73	0	0	0	0	112.6	S81 F82	S81-S85 PolarHBondContact O-N 3.18Å; S81-S85 VanDerWaalsContact O-N 3.15Å; F82-S85 PolarHBondContact O-N 3.45Å; F82-S85 PolarHBondContact O-OG 3.25Å
86	E	96.4	Very high	97.8	Very high	58 Å²	58	40.3 Å²	40.3	27%	0.271	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	7	174.8	-62	-162.9	140.5	0	0	114	F82 L83 Q84 S88 R170	F82-E86 HydrophobicContact CE1-CG 4.37Å; F82-E86 VanDerWaalsContact CE1-OE2 3.28Å; F82-E86 WeakPolarHBondContact CE1-OE2 3.43Å; F82-E86 HydrophobicContact CE2-CG 4.43Å; F82-E86 HydrophobicContact CZ-CG 4.08Å; F82-E86 WeakPolarHBondContact CZ-OE1 3.38Å; F82-E86 WeakPolarHBondContact CZ-OE2 3.45Å; F82-E86 PolarHBondContact O-N 3.28Å; L83-E86 CarbonylContact O-C 3.58Å; L83-E86 PolarHBondContact O-N 2.96Å; Q84-E86 PolarHBondContact O-N 3.04Å; E86-S88 PolarHBondContact O-N 3.49Å; E86-R170 IonicContact OE1-CZ 3.44Å; E86-R170 IonicContact OE1-NE 3.79Å; E86-R170 IonicContact OE1-NH1 2.75Å; E86-R170 PolarHBondContact OE1-NH1 3.02Å; E86-R170 IonicContact OE2-CZ 3.13Å; E86-R170 IonicContact OE2-NE 3.68Å; E86-R170 IonicContact OE2-NH1 3.05Å; E86-R170 PolarHBondContact OE2-NH1 2.86Å; E86-R170 IonicContact OE2-NH2 2.71Å; E86-R170 PolarHBondContact OE2-NH2 3.29Å
87	F	95.8	Very high	97.9	Very high	186 Å²	186	39.9 Å²	39.9	82%	0.816	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	36.7	-178.2	-55.3	-88	0	0	0	113.9	L83 Q84	L83-F87 PolarHBondContact O-N 3.01Å; L83-F87 VanDerWaalsContact O-N 3.07Å; Q84-F87 PolarHBondContact O-N 3.29Å
88	S	97.8	Very high	98	Very high	16 Å²	16	38.4 Å²	38.4	11%	0.112	20%	0.196	C	C	.	.			trans	-128.7	25.2	-179.3	66.5	0	0	0	0	112.6	L83 E86 E90 N91	L83-S88 VanDerWaalsContact CD2-OG 3.31Å; L83-S88 WeakPolarHBondContact CD2-OG 3.39Å; L83-S88 PolarHBondContact O-N 3.11Å; E86-S88 PolarHBondContact O-N 3.49Å; S88-E90 VanDerWaalsContact C-N 3.3Å; S88-E90 WeakPolarHBondContact CA-OE2 3.42Å; S88-E90 PolarHBondContact O-N 3.32Å; S88-N91 PolarHBondContact O-ND2 3.07Å
89	D	98.1	Very high	98	Very high	32 Å²	32	40.7 Å²	40.7	17%	0.171	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-14	-174.3	81	-46.7	0	0	0	113.6	L83 Q84 N91 I92 E93 R128	L83-D89 HydrophobicContact CB-CB 4.1Å; L83-D89 PolarHBondContact O-N 3.19Å; Q84-D89 HydrophobicContact CB-CB 4.32Å; Q84-D89 HydrophobicContact CG-CB 3.44Å; Q84-D89 VanDerWaalsContact CG-CB 3.44Å; Q84-D89 PolarHBondContact NE2-OD2 3.25Å; D89-N91 PolarHBondContact O-N 2.86Å; D89-I92 HydrophobicContact CB-CG2 4.49Å; D89-I92 VanDerWaalsContact O-CG2 3.28Å; D89-I92 WeakPolarHBondContact O-CG2 3.5Å; D89-I92 PolarHBondContact O-N 3.31Å; D89-E93 WeakPolarHBondContact O-CB 3.23Å; D89-E93 VanDerWaalsContact O-CG 3.23Å; D89-E93 WeakPolarHBondContact O-CG 3.28Å; D89-E93 PolarHBondContact O-N 2.68Å; D89-R128 IonicContact OD1-NH2 3.32Å; D89-R128 PolarHBondContact OD1-NH2 2.85Å; D89-R128 IonicContact OD2-CZ 2.98Å; D89-R128 IonicContact OD2-NH2 2.68Å; D89-R128 PolarHBondContact OD2-NH2 2.88Å
90	E	98.5	Very high	98	Very high	40 Å²	40	44.5 Å²	44.5	19%	0.187	23%	0.227	C	C	.	.	H	α-helix	trans	-54.8	-33	170.6	73	-67.1	159.2	0	0	112.5	S88 F94 R128 V130	S88-E90 VanDerWaalsContact C-N 3.3Å; S88-E90 WeakPolarHBondContact CA-OE2 3.42Å; S88-E90 PolarHBondContact O-N 3.32Å; E90-F94 VanDerWaalsContact O-CB 3.25Å; E90-F94 WeakPolarHBondContact O-CB 3.34Å; E90-F94 PolarHBondContact O-N 3.42Å; E90-R128 HydrophobicContact CB-CB 4Å; E90-V130 HydrophobicContact CB-CG1 4.48Å; E90-V130 HydrophobicContact CG-CG1 4.17Å
91	N	98.4	Very high	98	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.043	21%	0.212	C	C	.	.	H	α-helix	trans	-65.2	-47.1	-179.3	-63.3	-61	0	0	0	112.2	S88 D89 W95 I159 M163	S88-N91 PolarHBondContact O-ND2 3.07Å; D89-N91 PolarHBondContact O-N 2.86Å; N91-W95 PolarHBondContact O-N 3.41Å; N91-W95 VanDerWaalsContact O-N 3.11Å; N91-I159 HydrophobicContact CB-CG2 3.68Å; N91-I159 VanDerWaalsContact O-CG2 3.28Å; N91-I159 WeakPolarHBondContact O-CG2 3.42Å; N91-M163 HydrophobicContact CB-CG 3.62Å; N91-M163 HydrophobicContact CB-SD 3.66Å
92	I	98.5	Very high	98.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-75.2	-35	179.6	-170.5	58.4	0	0	0	111.5	L70 L76 F79 R80 L83 D89 F94 W95 M96 M163	L70-I92 HydrophobicContact CD1-CD1 4.48Å; L70-I92 HydrophobicContact CD2-CD1 3.58Å; L76-I92 HydrophobicContact CD1-CD1 3.69Å; L76-I92 HydrophobicContact CD1-CG1 3.92Å; F79-I92 HydrophobicContact CD1-CD1 4.33Å; R80-I92 HydrophobicContact CB-CG2 4.17Å; R80-I92 HydrophobicContact CG-CG2 4.06Å; L83-I92 HydrophobicContact CD1-CB 3.55Å; L83-I92 HydrophobicContact CD1-CG2 3.56Å; D89-I92 HydrophobicContact CB-CG2 4.49Å; D89-I92 VanDerWaalsContact O-CG2 3.28Å; D89-I92 WeakPolarHBondContact O-CG2 3.5Å; D89-I92 PolarHBondContact O-N 3.31Å; I92-F94 VanDerWaalsContact C-N 3.35Å; I92-F94 PolarHBondContact O-N 2.72Å; I92-W95 HydrophobicContact CD1-CB 4.4Å; I92-W95 HydrophobicContact CD1-CD2 4.49Å; I92-W95 HydrophobicContact CD1-CE3 4.02Å; I92-W95 PolarHBondContact O-N 3.24Å; I92-M96 HydrophobicContact CD1-CG 4.47Å; I92-M96 HydrophobicContact CG1-CG 4.35Å; I92-M96 HydrophobicContact CG1-SD 4.26Å; I92-M96 WeakPolarHBondContact O-CB 3.43Å; I92-M96 VanDerWaalsContact O-CG 3.29Å; I92-M96 WeakPolarHBondContact O-CG 3.25Å; I92-M96 PolarHBondContact O-N 2.82Å; I92-M163 HydrophobicContact CB-SD 3.98Å; I92-M163 HydrophobicContact CD1-CE 4.24Å; I92-M163 HydrophobicContact CD1-SD 4.25Å
93	E	98.6	Very high	98	Very high	33 Å²	33	48 Å²	48	15%	0.154	24%	0.236	C	C	.	.	H	α-helix	trans	-64.5	-41.1	177.1	-69.9	-65.7	108.8	0	0	111.6	R80 D89 A97 F121 R128	R80-E93 WeakPolarHBondContact CD-OE1 3.3Å; R80-E93 IonicContact CZ-OE1 3.93Å; R80-E93 IonicContact CZ-OE2 2.79Å; R80-E93 IonicContact NE-OE1 2.71Å; R80-E93 PolarHBondContact NE-OE1 3.45Å; R80-E93 IonicContact NH1-OE1 3.46Å; R80-E93 PolarHBondContact NH1-OE1 3.5Å; R80-E93 IonicContact NH1-OE2 3.93Å; R80-E93 IonicContact NH2-OE1 3.89Å; R80-E93 PolarHBondContact NH2-OE1 3.13Å; R80-E93 IonicContact NH2-OE2 2.95Å; R80-E93 PolarHBondContact NH2-OE2 2.8Å; D89-E93 WeakPolarHBondContact O-CB 3.23Å; D89-E93 VanDerWaalsContact O-CG 3.23Å; D89-E93 WeakPolarHBondContact O-CG 3.28Å; D89-E93 PolarHBondContact O-N 2.68Å; E93-A97 VanDerWaalsContact O-CB 3.32Å; E93-A97 WeakPolarHBondContact O-CB 3.45Å; E93-A97 PolarHBondContact O-N 3.12Å; E93-F121 HydrophobicContact CB-CE1 3.97Å; E93-F121 HydrophobicContact CB-CZ 3.9Å; E93-R128 IonicContact OE2-NH1 3.42Å
94	F	98.8	Very high	97.9	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.9	-46.2	171.6	172.8	-110.8	0	0	0	111.9	E90 I92 M96 A97 C98 I117 F121 I122 V130 A155 Q156 I159	E90-F94 VanDerWaalsContact O-CB 3.25Å; E90-F94 WeakPolarHBondContact O-CB 3.34Å; E90-F94 PolarHBondContact O-N 3.42Å; I92-F94 VanDerWaalsContact C-N 3.35Å; I92-F94 PolarHBondContact O-N 2.72Å; F94-M96 PolarHBondContact O-N 3.07Å; F94-A97 PolarHBondContact O-N 3.01Å; F94-C98 VanDerWaalsContact CE2-SG 3.55Å; F94-C98 VanDerWaalsContact CZ-SG 3.52Å; F94-C98 PolarHBondContact O-N 3.12Å; F94-C98 PolarHBondContact O-SG 3.46Å; F94-I117 HydrophobicContact CD2-CG2 4.04Å; F94-I117 HydrophobicContact CE2-CG2 3.68Å; F94-F121 HydrophobicContact CB-CB 4.27Å; F94-F121 HydrophobicContact CB-CD1 3.7Å; F94-F121 HydrophobicContact CB-CD2 4.3Å; F94-F121 HydrophobicContact CB-CE1 4.05Å; F94-F121 HydrophobicContact CB-CG 3.84Å; F94-F121 HydrophobicContact CB-CZ 4.49Å; F94-F121 HydrophobicContact CD2-CB 3.5Å; F94-F121 HydrophobicContact CD2-CD1 4.44Å; F94-F121 AromaticContact CD2-CD2 3.9Å; F94-F121 HydrophobicContact CD2-CD2 3.9Å; F94-F121 AromaticContact CD2-CG 3.71Å; F94-F121 HydrophobicContact CD2-CG 3.71Å; F94-F121 HydrophobicContact CE2-CB 4.21Å; F94-F121 HydrophobicContact CG-CB 4.16Å; F94-F121 HydrophobicContact CG-CD1 4.5Å; F94-F121 HydrophobicContact CG-CG 4.2Å; F94-I122 HydrophobicContact CE2-CD1 3.73Å; F94-I122 HydrophobicContact CE2-CG1 4.31Å; F94-I122 HydrophobicContact CZ-CD1 3.9Å; F94-V130 HydrophobicContact CB-CG1 3.66Å; F94-V130 HydrophobicContact CD1-CG1 4.27Å; F94-V130 HydrophobicContact CD1-CG2 4.23Å; F94-V130 HydrophobicContact CE1-CG2 4.4Å; F94-V130 HydrophobicContact CG-CG1 3.95Å; F94-V130 HydrophobicContact CG-CG2 4.34Å; F94-A155 HydrophobicContact CE1-CB 4.14Å; F94-A155 HydrophobicContact CZ-CB 3.74Å; F94-Q156 HydrophobicContact CE1-CB 4.44Å; F94-I159 HydrophobicContact CD1-CB 3.93Å; F94-I159 HydrophobicContact CD1-CG1 3.68Å; F94-I159 HydrophobicContact CD1-CG2 4.09Å; F94-I159 HydrophobicContact CE1-CB 4.2Å; F94-I159 HydrophobicContact CE1-CG1 3.79Å
95	W	98.6	Very high	97.8	Very high	30 Å²	30	54.2 Å²	54.2	11%	0.114	26%	0.264	C	S	.	.	H	α-helix	trans	-60.3	-45	178.8	-177.2	95	0	0	0	111.7	L70 N91 I92 C98 E99 Q156 Y160 M163	L70-W95 HydrophobicContact CB-CH2 3.73Å; L70-W95 HydrophobicContact CB-CZ2 4.15Å; L70-W95 HydrophobicContact CB-CZ3 4.09Å; L70-W95 HydrophobicContact CD1-CD2 3.91Å; L70-W95 HydrophobicContact CD1-CE3 4.17Å; L70-W95 HydrophobicContact CD1-CH2 3.98Å; L70-W95 HydrophobicContact CD1-CZ2 3.69Å; L70-W95 HydrophobicContact CD1-CZ3 4.2Å; L70-W95 HydrophobicContact CG-CH2 4.45Å; N91-W95 PolarHBondContact O-N 3.41Å; N91-W95 VanDerWaalsContact O-N 3.11Å; I92-W95 HydrophobicContact CD1-CB 4.4Å; I92-W95 HydrophobicContact CD1-CD2 4.49Å; I92-W95 HydrophobicContact CD1-CE3 4.02Å; I92-W95 PolarHBondContact O-N 3.24Å; W95-C98 WeakPolarHBondContact O-CB 3.46Å; W95-C98 PolarHBondContact O-N 3.31Å; W95-E99 HydrophobicContact CD2-CG 4.23Å; W95-E99 HydrophobicContact CE3-CG 4.1Å; W95-E99 HydrophobicContact CH2-CG 3.68Å; W95-E99 HydrophobicContact CZ2-CG 3.82Å; W95-E99 HydrophobicContact CZ3-CG 3.83Å; W95-E99 PolarHBondContact O-N 3.08Å; W95-E99 VanDerWaalsContact O-N 3.08Å; W95-Q156 HydrophobicContact CG-CG 4.22Å; W95-Q156 PolarHBondContact O-NE2 2.86Å; W95-Y160 AromaticContact NE1-CD2 3.96Å; W95-M163 HydrophobicContact CB-CE 4.03Å; W95-M163 HydrophobicContact CG-CE 4.22Å
96	M	98.5	Very high	97.8	Very high	58 Å²	58	53.5 Å²	53.5	29%	0.286	25%	0.253	S	S	.	.	H	α-helix	trans	-63.5	-41	176.2	-71.7	177.4	61.9	0	0	112.1	L76 I92 F94 C98 E99 D100	L76-M96 HydrophobicContact CD1-CG 4.2Å; L76-M96 HydrophobicContact CD1-SD 4.03Å; L76-M96 HydrophobicContact CD2-CE 4.21Å; L76-M96 HydrophobicContact CD2-CG 4.44Å; L76-M96 HydrophobicContact CD2-SD 4.18Å; L76-M96 HydrophobicContact CG-SD 4.3Å; I92-M96 HydrophobicContact CD1-CG 4.47Å; I92-M96 HydrophobicContact CG1-CG 4.35Å; I92-M96 HydrophobicContact CG1-SD 4.26Å; I92-M96 WeakPolarHBondContact O-CB 3.43Å; I92-M96 VanDerWaalsContact O-CG 3.29Å; I92-M96 WeakPolarHBondContact O-CG 3.25Å; I92-M96 PolarHBondContact O-N 2.82Å; F94-M96 PolarHBondContact O-N 3.07Å; M96-C98 VanDerWaalsContact C-N 3.28Å; M96-C98 PolarHBondContact O-N 3.35Å; M96-E99 PolarHBondContact O-N 3.01Å; M96-D100 PolarHBondContact O-N 3.48Å
97	A	98.6	Very high	97.7	Very high	24 Å²	24	55.5 Å²	55.5	20%	0.198	27%	0.272	C	S	.	.	H	α-helix	trans	-63	-36.8	176.6	0	0	0	0	0	111.7	E93 F94 F101 I117 F121	E93-A97 VanDerWaalsContact O-CB 3.32Å; E93-A97 WeakPolarHBondContact O-CB 3.45Å; E93-A97 PolarHBondContact O-N 3.12Å; F94-A97 PolarHBondContact O-N 3.01Å; A97-F101 VanDerWaalsContact O-CB 3.24Å; A97-F101 WeakPolarHBondContact O-CB 3.28Å; A97-F101 PolarHBondContact O-N 3.24Å; A97-I117 HydrophobicContact CB-CD1 4.08Å; A97-I117 HydrophobicContact CB-CG1 3.87Å; A97-F121 HydrophobicContact CB-CE2 4.27Å
98	C	98.6	Very high	97.7	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.2	-43.4	173.8	-67.8	0	0	0	0	112.1	F94 W95 M96 D100 F101 K102 F152 Q156	F94-C98 VanDerWaalsContact CE2-SG 3.55Å; F94-C98 VanDerWaalsContact CZ-SG 3.52Å; F94-C98 PolarHBondContact O-N 3.12Å; F94-C98 PolarHBondContact O-SG 3.46Å; W95-C98 WeakPolarHBondContact O-CB 3.46Å; W95-C98 PolarHBondContact O-N 3.31Å; M96-C98 VanDerWaalsContact C-N 3.28Å; M96-C98 PolarHBondContact O-N 3.35Å; C98-D100 PolarHBondContact O-N 2.98Å; C98-F101 WeakPolarHBondContact O-CB 3.38Å; C98-F101 PolarHBondContact O-N 3.45Å; C98-K102 WeakPolarHBondContact O-CG 3.35Å; C98-K102 PolarHBondContact O-N 2.98Å; C98-F152 HydrophobicContact CB-CB 4.5Å; C98-F152 VanDerWaalsContact SG-CB 3.6Å; C98-Q156 HydrophobicContact CB-CB 4.14Å; C98-Q156 HydrophobicContact CB-CG 3.82Å
99	E	98.3	Very high	97.7	Very high	51 Å²	51	59.6 Å²	59.6	24%	0.238	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-40.6	176.6	-73.8	-55.9	110.9	0	0	112.8	W95 M96 K102 K103 Q156	W95-E99 HydrophobicContact CD2-CG 4.23Å; W95-E99 HydrophobicContact CE3-CG 4.1Å; W95-E99 HydrophobicContact CH2-CG 3.68Å; W95-E99 HydrophobicContact CZ2-CG 3.82Å; W95-E99 HydrophobicContact CZ3-CG 3.83Å; W95-E99 PolarHBondContact O-N 3.08Å; W95-E99 VanDerWaalsContact O-N 3.08Å; M96-E99 PolarHBondContact O-N 3.01Å; E99-K102 IonicContact OE1-NZ 3.79Å; E99-K102 PolarHBondContact OE1-NZ 3.04Å; E99-K103 WeakPolarHBondContact O-CD 3.33Å; E99-K103 WeakPolarHBondContact O-CG 3.31Å; E99-K103 PolarHBondContact O-N 3.32Å; E99-Q156 PolarHBondContact OE1-NE2 3.39Å
100	D	98.1	Very high	97.6	Very high	81 Å²	81	59.2 Å²	59.2	43%	0.433	29%	0.289	S	S	.	.	H	α-helix	trans	-69.5	-36.5	174.8	177.4	46	0	0	0	112.2	M96 C98 K103 T104 K113	M96-D100 PolarHBondContact O-N 3.48Å; C98-D100 PolarHBondContact O-N 2.98Å; D100-K103 PolarHBondContact O-N 3.24Å; D100-T104 PolarHBondContact O-N 3.4Å; D100-T104 PolarHBondContact O-OG1 3.19Å; D100-K113 PolarHBondContact O-NZ 2.98Å; D100-K113 IonicContact OD1-NZ 3.75Å; D100-K113 PolarHBondContact OD1-NZ 3.32Å; D100-K113 WeakPolarHBondContact OD2-CE 3.47Å; D100-K113 IonicContact OD2-NZ 3.91Å; D100-K113 PolarHBondContact OD2-NZ 2.92Å
101	F	98.4	Very high	97.6	Very high	1 Å²	1	59 Å²	59	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-61.4	-46.6	173.7	173.9	-94.5	0	0	0	111.9	A97 C98 K103 T104 M110 K113 A114 I117 S148 F152	A97-F101 VanDerWaalsContact O-CB 3.24Å; A97-F101 WeakPolarHBondContact O-CB 3.28Å; A97-F101 PolarHBondContact O-N 3.24Å; C98-F101 WeakPolarHBondContact O-CB 3.38Å; C98-F101 PolarHBondContact O-N 3.45Å; F101-K103 PolarHBondContact O-N 3.35Å; F101-T104 VanDerWaalsContact O-CB 3.23Å; F101-T104 WeakPolarHBondContact O-CB 3.2Å; F101-T104 PolarHBondContact O-N 2.73Å; F101-T104 PolarHBondContact O-OG1 2.93Å; F101-M110 HydrophobicContact CD2-CG 4.1Å; F101-M110 HydrophobicContact CE1-CE 4.02Å; F101-M110 HydrophobicContact CE2-CB 4.41Å; F101-M110 HydrophobicContact CE2-CE 4.25Å; F101-M110 HydrophobicContact CE2-CG 3.29Å; F101-M110 WeakPolarHBondContact CE2-O 3.41Å; F101-M110 HydrophobicContact CE2-SD 4.43Å; F101-M110 HydrophobicContact CZ-CE 3.83Å; F101-M110 HydrophobicContact CZ-CG 3.63Å; F101-M110 HydrophobicContact CZ-SD 4.21Å; F101-K113 HydrophobicContact CD2-CB 3.96Å; F101-A114 HydrophobicContact CD2-CB 4.48Å; F101-A114 HydrophobicContact CE2-CB 3.73Å; F101-A114 HydrophobicContact CZ-CB 4.36Å; F101-I117 HydrophobicContact CB-CD1 3.75Å; F101-I117 HydrophobicContact CD2-CD1 4.29Å; F101-I117 HydrophobicContact CG-CD1 4.16Å; F101-S148 WeakPolarHBondContact CE1-O 3.05Å; F101-S148 WeakPolarHBondContact CZ-O 3.02Å; F101-F152 AromaticContact CD1-CD2 3.63Å; F101-F152 HydrophobicContact CD1-CD2 3.63Å; F101-F152 AromaticContact CD1-CE2 3.93Å; F101-F152 HydrophobicContact CD1-CE2 3.93Å; F101-F152 HydrophobicContact CD2-CE2 4.02Å; F101-F152 AromaticContact CE1-CD2 3.73Å; F101-F152 HydrophobicContact CE1-CD2 3.73Å; F101-F152 AromaticContact CE1-CE2 3.85Å; F101-F152 HydrophobicContact CE1-CE2 3.85Å; F101-F152 AromaticContact CE2-CE2 3.97Å; F101-F152 HydrophobicContact CE2-CE2 3.97Å; F101-F152 HydrophobicContact CG-CD2 4.04Å; F101-F152 HydrophobicContact CG-CE2 4Å; F101-F152 HydrophobicContact CZ-CD2 4.24Å; F101-F152 AromaticContact CZ-CE2 3.88Å; F101-F152 HydrophobicContact CZ-CE2 3.88Å
102	K	97.9	Very high	97.6	Very high	70 Å²	70	61.7 Å²	61.7	30%	0.304	32%	0.317	S	S	.	.	H	α-helix	trans	-56.8	-35.3	177.6	-75.2	175.2	-170.2	-175.7	0	113.7	C98 E99 T104 S149 D153	C98-K102 WeakPolarHBondContact O-CG 3.35Å; C98-K102 PolarHBondContact O-N 2.98Å; E99-K102 IonicContact OE1-NZ 3.79Å; E99-K102 PolarHBondContact OE1-NZ 3.04Å; K102-T104 PolarHBondContact O-N 3.03Å; K102-S149 VanDerWaalsContact CG-O 3.32Å; K102-S149 WeakPolarHBondContact CG-O 3.37Å; K102-D153 WeakPolarHBondContact CE-OD1 3.4Å; K102-D153 IonicContact NZ-OD1 2.69Å; K102-D153 PolarHBondContact NZ-OD1 3.48Å
103	K	97.1	Very high	97.6	Very high	151 Å²	151	64.4 Å²	64.4	66%	0.657	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-9.6	179.7	-65.7	167.1	-170.6	172.4	0	112.8	E99 D100 F101 K105	E99-K103 WeakPolarHBondContact O-CD 3.33Å; E99-K103 WeakPolarHBondContact O-CG 3.31Å; E99-K103 PolarHBondContact O-N 3.32Å; D100-K103 PolarHBondContact O-N 3.24Å; F101-K103 PolarHBondContact O-N 3.35Å; K103-K105 PolarHBondContact O-N 2.68Å
104	T	96.9	Very high	97.6	Very high	15 Å²	15	62.9 Å²	62.9	9%	0.092	32%	0.322	C	S	.	.			trans	-82.8	113.1	-174.3	-57.9	0	0	0	0	111.5	D100 F101 K102 K109 M110 K113	D100-T104 PolarHBondContact O-N 3.4Å; D100-T104 PolarHBondContact O-OG1 3.19Å; F101-T104 VanDerWaalsContact O-CB 3.23Å; F101-T104 WeakPolarHBondContact O-CB 3.2Å; F101-T104 PolarHBondContact O-N 2.73Å; F101-T104 PolarHBondContact O-OG1 2.93Å; K102-T104 PolarHBondContact O-N 3.03Å; T104-K109 HydrophobicContact CG2-CB 3.77Å; T104-M110 HydrophobicContact CG2-CB 4.04Å; T104-M110 WeakPolarHBondContact O-CE 3.4Å; T104-K113 HydrophobicContact CG2-CD 4.46Å; T104-K113 WeakPolarHBondContact OG1-CD 3.49Å; T104-K113 PolarHBondContact OG1-NZ 3.26Å
105	K	94.3	Very high	97.5	Very high	202 Å²	202	66.8 Å²	66.8	88%	0.878	34%	0.339	S	S	*	.			trans	-92	-24.6	179.1	-59.6	-175.6	-178.8	-178.1	0	114.4	K103 P107	K103-K105 PolarHBondContact O-N 2.68Å; K105-P107 WeakPolarHBondContact O-CD 3.47Å
106	N	96.9	Very high	97.5	Very high	67 Å²	67	71.5 Å²	71.5	36%	0.358	36%	0.36	S	S	.	.			trans	-78.4	121.7	-178	178.1	-73.2	0	0	0	110.1	M108 K109 M110	N106-M108 PolarHBondContact O-N 2.92Å; N106-M108 WeakPolarHBondContact OD1-CB 3.41Å; N106-M108 PolarHBondContact OD1-N 3.47Å; N106-K109 HydrophobicContact CB-CB 4.14Å; N106-K109 HydrophobicContact CB-CD 4.22Å; N106-K109 HydrophobicContact CB-CG 4.17Å; N106-K109 PolarHBondContact O-N 3.01Å; N106-K109 PolarHBondContact OD1-N 2.81Å; N106-M110 WeakPolarHBondContact O-CB 3.36Å; N106-M110 PolarHBondContact O-N 3.01Å
107	P	95.2	Very high	97.5	Very high	101 Å²	101	69.1 Å²	69.1	66%	0.656	35%	0.349	S	S	*	.	H	α-helix	trans	-60.1	-39.5	-174.9	-27.3	35.8	0	0	0	114.5	K105 M110 A111	K105-P107 WeakPolarHBondContact O-CD 3.47Å; P107-M110 PolarHBondContact O-N 3.06Å; P107-A111 WeakPolarHBondContact O-CB 3.31Å; P107-A111 PolarHBondContact O-N 3.49Å
108	M	96.1	Very high	97.5	Very high	152 Å²	152	70.9 Å²	70.9	75%	0.749	35%	0.35	S	S	*	.	H	α-helix	trans	-66.5	-43.3	178.7	-67.4	-173.4	-78.2	0	0	111.5	N106 M110 A111 A112	N106-M108 PolarHBondContact O-N 2.92Å; N106-M108 WeakPolarHBondContact OD1-CB 3.41Å; N106-M108 PolarHBondContact OD1-N 3.47Å; M108-M110 VanDerWaalsContact C-N 3.33Å; M108-A111 PolarHBondContact O-N 2.83Å; M108-A112 PolarHBondContact O-N 2.86Å
109	K	97.1	Very high	97.5	Very high	136 Å²	136	74.6 Å²	74.6	59%	0.591	37%	0.368	S	S	*	.	H	α-helix	trans	-65.1	-38.5	174.7	-67.3	-173.8	178.5	-178.1	0	111.5	T104 N106 A112 K113	T104-K109 HydrophobicContact CG2-CB 3.77Å; N106-K109 HydrophobicContact CB-CB 4.14Å; N106-K109 HydrophobicContact CB-CD 4.22Å; N106-K109 HydrophobicContact CB-CG 4.17Å; N106-K109 PolarHBondContact O-N 3.01Å; N106-K109 PolarHBondContact OD1-N 2.81Å; K109-A112 PolarHBondContact O-N 3.22Å; K109-K113 WeakPolarHBondContact O-CB 3.46Å; K109-K113 WeakPolarHBondContact O-CG 3.46Å; K109-K113 PolarHBondContact O-N 2.85Å
110	M	97.4	Very high	97.4	Very high	24 Å²	24	74.2 Å²	74.2	12%	0.118	37%	0.367	C	S	.	.	H	α-helix	trans	-62.3	-47	176.9	-170.7	173.9	-122.5	0	0	110.6	F101 T104 N106 P107 M108 A112 K113 A114 L147	F101-M110 HydrophobicContact CD2-CG 4.1Å; F101-M110 HydrophobicContact CE1-CE 4.02Å; F101-M110 HydrophobicContact CE2-CB 4.41Å; F101-M110 HydrophobicContact CE2-CE 4.25Å; F101-M110 HydrophobicContact CE2-CG 3.29Å; F101-M110 WeakPolarHBondContact CE2-O 3.41Å; F101-M110 HydrophobicContact CE2-SD 4.43Å; F101-M110 HydrophobicContact CZ-CE 3.83Å; F101-M110 HydrophobicContact CZ-CG 3.63Å; F101-M110 HydrophobicContact CZ-SD 4.21Å; T104-M110 HydrophobicContact CG2-CB 4.04Å; T104-M110 WeakPolarHBondContact O-CE 3.4Å; N106-M110 WeakPolarHBondContact O-CB 3.36Å; N106-M110 PolarHBondContact O-N 3.01Å; P107-M110 PolarHBondContact O-N 3.06Å; M108-M110 VanDerWaalsContact C-N 3.33Å; M110-A112 PolarHBondContact O-N 3.46Å; M110-K113 PolarHBondContact O-N 3.01Å; M110-A114 WeakPolarHBondContact O-CB 3.41Å; M110-A114 PolarHBondContact O-N 3.45Å; M110-L147 HydrophobicContact SD-CB 4.44Å
111	A	97.5	Very high	97.4	Very high	36 Å²	36	71 Å²	71	30%	0.298	35%	0.349	S	S	.	.	H	α-helix	trans	-60.7	-44.3	175.8	0	0	0	0	0	112.8	P107 M108 K113 A114 K115 L147	P107-A111 WeakPolarHBondContact O-CB 3.31Å; P107-A111 PolarHBondContact O-N 3.49Å; M108-A111 PolarHBondContact O-N 2.83Å; A111-K113 PolarHBondContact O-N 2.93Å; A111-A114 PolarHBondContact O-N 3.26Å; A111-K115 WeakPolarHBondContact O-CB 3.45Å; A111-K115 PolarHBondContact O-N 3.23Å; A111-L147 HydrophobicContact CB-CD1 3.98Å
112	A	98	Very high	97.4	Very high	63 Å²	63	71 Å²	71	52%	0.521	35%	0.349	S	S	.	.	H	α-helix	trans	-61.5	-43.3	176.5	0	0	0	0	0	112.3	M108 K109 M110 K116	M108-A112 PolarHBondContact O-N 2.86Å; K109-A112 PolarHBondContact O-N 3.22Å; M110-A112 PolarHBondContact O-N 3.46Å; A112-K116 PolarHBondContact O-N 3.08Å; A112-K116 VanDerWaalsContact O-N 3.09Å
113	K	98.5	Very high	97.3	Very high	57 Å²	57	71.4 Å²	71.4	25%	0.248	35%	0.352	C	S	.	.	H	α-helix	trans	-67	-43.7	176	-73.7	-177.3	-177.1	-175.2	0	112.2	D100 F101 T104 K109 M110 A111 K115 K116 I117	D100-K113 PolarHBondContact O-NZ 2.98Å; D100-K113 IonicContact OD1-NZ 3.75Å; D100-K113 PolarHBondContact OD1-NZ 3.32Å; D100-K113 WeakPolarHBondContact OD2-CE 3.47Å; D100-K113 IonicContact OD2-NZ 3.91Å; D100-K113 PolarHBondContact OD2-NZ 2.92Å; F101-K113 HydrophobicContact CD2-CB 3.96Å; T104-K113 HydrophobicContact CG2-CD 4.46Å; T104-K113 WeakPolarHBondContact OG1-CD 3.49Å; T104-K113 PolarHBondContact OG1-NZ 3.26Å; K109-K113 WeakPolarHBondContact O-CB 3.46Å; K109-K113 WeakPolarHBondContact O-CG 3.46Å; K109-K113 PolarHBondContact O-N 2.85Å; M110-K113 PolarHBondContact O-N 3.01Å; A111-K113 PolarHBondContact O-N 2.93Å; K113-K115 VanDerWaalsContact C-N 3.31Å; K113-K115 PolarHBondContact O-N 2.97Å; K113-K116 PolarHBondContact O-N 3.33Å; K113-I117 WeakPolarHBondContact O-CB 3.16Å; K113-I117 VanDerWaalsContact O-CG1 3.28Å; K113-I117 WeakPolarHBondContact O-CG1 3.33Å; K113-I117 PolarHBondContact O-N 3.36Å
114	A	98.3	Very high	97.2	Very high	2 Å²	2	67.5 Å²	67.5	2%	0.017	34%	0.344	C	S	.	.	H	α-helix	trans	-58.4	-45	177.2	0	0	0	0	0	111.6	F101 M110 A111 I117 Y118 L144 L147 F152	F101-A114 HydrophobicContact CD2-CB 4.48Å; F101-A114 HydrophobicContact CE2-CB 3.73Å; F101-A114 HydrophobicContact CZ-CB 4.36Å; M110-A114 WeakPolarHBondContact O-CB 3.41Å; M110-A114 PolarHBondContact O-N 3.45Å; A111-A114 PolarHBondContact O-N 3.26Å; A114-I117 PolarHBondContact O-N 2.9Å; A114-Y118 WeakPolarHBondContact O-CB 2.96Å; A114-Y118 PolarHBondContact O-N 3Å; A114-L144 HydrophobicContact CB-CD2 4Å; A114-L147 HydrophobicContact CB-CD1 3.79Å; A114-L147 HydrophobicContact CB-CD2 3.65Å; A114-L147 HydrophobicContact CB-CG 4.4Å; A114-F152 HydrophobicContact CB-CE2 4.25Å; A114-F152 HydrophobicContact CB-CZ 4.16Å
115	K	97.9	Very high	97	Very high	81 Å²	81	75.3 Å²	75.3	35%	0.352	38%	0.38	S	S	.	.	H	α-helix	trans	-58.6	-50	175.4	-178.6	-178.8	172.3	-174.9	0	111.1	L23 A111 K113 I117 Y118 E119	L23-K115 HydrophobicContact CD2-CD 4.27Å; A111-K115 WeakPolarHBondContact O-CB 3.45Å; A111-K115 PolarHBondContact O-N 3.23Å; K113-K115 VanDerWaalsContact C-N 3.31Å; K113-K115 PolarHBondContact O-N 2.97Å; K115-I117 PolarHBondContact O-N 3.47Å; K115-Y118 WeakPolarHBondContact O-CB 3.35Å; K115-Y118 PolarHBondContact O-N 3.46Å; K115-E119 VanDerWaalsContact CE-CD 3.46Å; K115-E119 WeakPolarHBondContact CE-OE1 3.46Å; K115-E119 HydrophobicContact CG-CG 4.43Å; K115-E119 IonicContact NZ-OE1 2.87Å; K115-E119 WeakPolarHBondContact O-CG 3.46Å; K115-E119 PolarHBondContact O-N 3.47Å
116	K	98.2	Very high	96.9	Very high	130 Å²	130	66.3 Å²	66.3	57%	0.565	35%	0.345	S	S	*	.	H	α-helix	trans	-60.8	-46.3	179.4	-174.2	176.5	-179.7	-176.6	0	112.4	A112 K113 Y118 E119 D120	A112-K116 PolarHBondContact O-N 3.08Å; A112-K116 VanDerWaalsContact O-N 3.09Å; K113-K116 PolarHBondContact O-N 3.33Å; K116-Y118 VanDerWaalsContact C-N 3.26Å; K116-Y118 PolarHBondContact O-N 3.25Å; K116-E119 PolarHBondContact O-N 3.43Å; K116-D120 WeakPolarHBondContact CE-OD2 3.35Å; K116-D120 WeakPolarHBondContact CG-OD2 3.36Å; K116-D120 WeakPolarHBondContact O-CB 3.32Å; K116-D120 PolarHBondContact O-N 2.99Å
117	I	98.6	Very high	96.8	Very high	8 Å²	8	68.3 Å²	68.3	4%	0.041	36%	0.361	C	S	.	.	H	α-helix	trans	-59.5	-41.5	177.7	-69.7	167	0	0	0	110.6	F94 A97 F101 K113 A114 K115 F121 F152	F94-I117 HydrophobicContact CD2-CG2 4.04Å; F94-I117 HydrophobicContact CE2-CG2 3.68Å; A97-I117 HydrophobicContact CB-CD1 4.08Å; A97-I117 HydrophobicContact CB-CG1 3.87Å; F101-I117 HydrophobicContact CB-CD1 3.75Å; F101-I117 HydrophobicContact CD2-CD1 4.29Å; F101-I117 HydrophobicContact CG-CD1 4.16Å; K113-I117 WeakPolarHBondContact O-CB 3.16Å; K113-I117 VanDerWaalsContact O-CG1 3.28Å; K113-I117 WeakPolarHBondContact O-CG1 3.33Å; K113-I117 PolarHBondContact O-N 3.36Å; A114-I117 PolarHBondContact O-N 2.9Å; K115-I117 PolarHBondContact O-N 3.47Å; I117-F121 HydrophobicContact CG2-CD2 4.43Å; I117-F121 WeakPolarHBondContact O-CB 3.43Å; I117-F121 PolarHBondContact O-N 3.37Å; I117-F152 HydrophobicContact CB-CE1 4.21Å; I117-F152 HydrophobicContact CB-CE2 4.24Å; I117-F152 HydrophobicContact CB-CZ 3.84Å; I117-F152 HydrophobicContact CD1-CD2 4.22Å; I117-F152 HydrophobicContact CD1-CE2 3.85Å; I117-F152 HydrophobicContact CD1-CZ 4.34Å; I117-F152 HydrophobicContact CG2-CD1 3.87Å; I117-F152 HydrophobicContact CG2-CD2 4.39Å; I117-F152 HydrophobicContact CG2-CE1 3.51Å; I117-F152 HydrophobicContact CG2-CE2 4.07Å; I117-F152 HydrophobicContact CG2-CG 4.3Å; I117-F152 HydrophobicContact CG2-CZ 3.62Å
118	Y	98.3	Very high	96.9	Very high	61 Å²	61	66.9 Å²	66.9	24%	0.239	34%	0.342	C	S	.	.	I	π-helix	trans	-63	-53	176.6	172.4	-100.7	0	0	0	112.2	A114 K115 K116 D120 I122 Q123 L141 L144	A114-Y118 WeakPolarHBondContact O-CB 2.96Å; A114-Y118 PolarHBondContact O-N 3Å; K115-Y118 WeakPolarHBondContact O-CB 3.35Å; K115-Y118 PolarHBondContact O-N 3.46Å; K116-Y118 VanDerWaalsContact C-N 3.26Å; K116-Y118 PolarHBondContact O-N 3.25Å; Y118-D120 PolarHBondContact O-N 3.24Å; Y118-I122 HydrophobicContact CD2-CB 3.81Å; Y118-I122 HydrophobicContact CD2-CG2 3.86Å; Y118-I122 HydrophobicContact CE2-CB 4.36Å; Y118-I122 HydrophobicContact CE2-CG2 4.09Å; Y118-I122 CarbonylContact O-C 3.31Å; Y118-I122 PolarHBondContact O-N 3.36Å; Y118-Q123 HydrophobicContact CE1-CB 4.24Å; Y118-Q123 WeakPolarHBondContact O-CB 3.33Å; Y118-Q123 PolarHBondContact O-N 3.13Å; Y118-L141 HydrophobicContact CD2-CD2 4.09Å; Y118-L141 HydrophobicContact CE2-CD2 3.36Å; Y118-L144 HydrophobicContact CD2-CD1 3.62Å; Y118-L144 HydrophobicContact CE2-CD1 4.38Å; Y118-L144 HydrophobicContact CG-CD1 3.95Å
119	E	97.8	Very high	96.9	Very high	77 Å²	77	62.9 Å²	62.9	36%	0.36	32%	0.322	S	S	.	.	I	π-helix	trans	-63.1	-40.3	-176.9	-70.9	174.5	160.4	0	0	112.3	K115 K116	K115-E119 VanDerWaalsContact CE-CD 3.46Å; K115-E119 WeakPolarHBondContact CE-OE1 3.46Å; K115-E119 HydrophobicContact CG-CG 4.43Å; K115-E119 IonicContact NZ-OE1 2.87Å; K115-E119 WeakPolarHBondContact O-CG 3.46Å; K115-E119 PolarHBondContact O-N 3.47Å; K116-E119 PolarHBondContact O-N 3.43Å
120	D	97.6	Very high	97	Very high	44 Å²	44	56.6 Å²	56.6	24%	0.235	30%	0.295	C	S	.	.	I	π-helix	trans	-77.6	-44.9	-176.8	-70.6	-15.9	0	0	0	112.1	K116 Y118 R128 E129	K116-D120 WeakPolarHBondContact CE-OD2 3.35Å; K116-D120 WeakPolarHBondContact CG-OD2 3.36Å; K116-D120 WeakPolarHBondContact O-CB 3.32Å; K116-D120 PolarHBondContact O-N 2.99Å; Y118-D120 PolarHBondContact O-N 3.24Å; D120-R128 CarbonylContact O-C 3.37Å; D120-R128 WeakPolarHBondContact O-CA 3.36Å; D120-R128 WeakPolarHBondContact O-CB 3.29Å; D120-R128 PolarHBondContact O-N 2.68Å; D120-R128 VanDerWaalsContact O-N 3.13Å; D120-E129 PolarHBondContact O-N 2.77Å
121	F	98.5	Very high	97	Very high	12 Å²	12	61.4 Å²	61.4	5%	0.053	32%	0.321	C	S	.	.	I	π-helix	trans	-118.4	-26.1	-163.8	-56.7	-75.1	0	0	0	115.5	E93 F94 A97 I117 R128 E129 V130	E93-F121 HydrophobicContact CB-CE1 3.97Å; E93-F121 HydrophobicContact CB-CZ 3.9Å; F94-F121 HydrophobicContact CB-CB 4.27Å; F94-F121 HydrophobicContact CB-CD1 3.7Å; F94-F121 HydrophobicContact CB-CD2 4.3Å; F94-F121 HydrophobicContact CB-CE1 4.05Å; F94-F121 HydrophobicContact CB-CG 3.84Å; F94-F121 HydrophobicContact CB-CZ 4.49Å; F94-F121 HydrophobicContact CD2-CB 3.5Å; F94-F121 HydrophobicContact CD2-CD1 4.44Å; F94-F121 AromaticContact CD2-CD2 3.9Å; F94-F121 HydrophobicContact CD2-CD2 3.9Å; F94-F121 AromaticContact CD2-CG 3.71Å; F94-F121 HydrophobicContact CD2-CG 3.71Å; F94-F121 HydrophobicContact CE2-CB 4.21Å; F94-F121 HydrophobicContact CG-CB 4.16Å; F94-F121 HydrophobicContact CG-CD1 4.5Å; F94-F121 HydrophobicContact CG-CG 4.2Å; A97-F121 HydrophobicContact CB-CE2 4.27Å; I117-F121 HydrophobicContact CG2-CD2 4.43Å; I117-F121 WeakPolarHBondContact O-CB 3.43Å; I117-F121 PolarHBondContact O-N 3.37Å; F121-R128 HydrophobicContact CD1-CB 3.98Å; F121-R128 WeakPolarHBondContact CD1-O 2.8Å; F121-R128 HydrophobicContact CE1-CB 4Å; F121-E129 WeakPolarHBondContact O-CA 3.31Å; F121-V130 HydrophobicContact CB-CG1 4.13Å; F121-V130 HydrophobicContact CB-CG2 4.49Å; F121-V130 HydrophobicContact CD1-CG1 4Å; F121-V130 HydrophobicContact CG-CG1 4.48Å; F121-V130 WeakPolarHBondContact O-CG2 3.48Å; F121-V130 PolarHBondContact O-N 3Å
122	I	98.1	Very high	97	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.005	31%	0.313	C	S	.	.	I	π-helix	trans	-105.3	-32	-172.8	-54.6	-63.1	0	0	0	112	F94 Y118 S124 V130 I132 K137 T140 A155	F94-I122 HydrophobicContact CE2-CD1 3.73Å; F94-I122 HydrophobicContact CE2-CG1 4.31Å; F94-I122 HydrophobicContact CZ-CD1 3.9Å; Y118-I122 HydrophobicContact CD2-CB 3.81Å; Y118-I122 HydrophobicContact CD2-CG2 3.86Å; Y118-I122 HydrophobicContact CE2-CB 4.36Å; Y118-I122 HydrophobicContact CE2-CG2 4.09Å; Y118-I122 CarbonylContact O-C 3.31Å; Y118-I122 PolarHBondContact O-N 3.36Å; I122-S124 PolarHBondContact O-N 3.32Å; I122-V130 HydrophobicContact CD1-CG2 4.34Å; I122-I132 HydrophobicContact CD1-CD1 3.82Å; I122-K137 HydrophobicContact CG2-CG 4.12Å; I122-K137 WeakPolarHBondContact O-CE 3.24Å; I122-K137 PolarHBondContact O-NZ 3.43Å; I122-T140 HydrophobicContact CG1-CG2 4.31Å; I122-T140 HydrophobicContact CG2-CG2 4.22Å; I122-A155 HydrophobicContact CD1-CB 4.39Å
123	Q	96.1	Very high	96.9	Very high	79 Å²	79	61.1 Å²	61.1	37%	0.369	31%	0.306	S	S	.	.	S	Bend	trans	-60.2	135.7	-179.4	-178.8	176.6	-34.4	0	0	110.6	Y118 E125 G126	Y118-Q123 HydrophobicContact CE1-CB 4.24Å; Y118-Q123 WeakPolarHBondContact O-CB 3.33Å; Y118-Q123 PolarHBondContact O-N 3.13Å; Q123-E125 PolarHBondContact O-N 2.78Å; Q123-G126 PolarHBondContact O-N 2.94Å
124	S	94.5	Very high	96.8	Very high	70 Å²	70	64.8 Å²	64.8	49%	0.49	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	134.3	175	-61.7	0	0	0	0	110.5	I122 G126 E129 K137	I122-S124 PolarHBondContact O-N 3.32Å; S124-G126 PolarHBondContact O-N 2.93Å; S124-E129 WeakPolarHBondContact CA-OE1 3.41Å; S124-E129 WeakPolarHBondContact CA-OE2 3.3Å; S124-K137 VanDerWaalsContact CA-NZ 3.3Å; S124-K137 WeakPolarHBondContact OG-CE 3.32Å; S124-K137 PolarHBondContact OG-NZ 2.84Å
125	E	92.6	Very high	96.8	Very high	179 Å²	179	70.6 Å²	70.6	84%	0.836	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	26	-174.8	-47.4	-64.6	140	0	0	112.1	Q123 E129	Q123-E125 PolarHBondContact O-N 2.78Å; E125-E129 PolarHBondContact N-OE2 3.41Å
126	G	91.3	Very high	96.8	Very high	13 Å²	13	66.8 Å²	66.8	13%	0.134	33%	0.332	C	S	.	.			trans	-65.8	155.5	172.2	0	0	0	0	0	111	Q123 S124 R128 E129	Q123-G126 PolarHBondContact O-N 2.94Å; S124-G126 PolarHBondContact O-N 2.93Å; G126-R128 PolarHBondContact O-N 2.8Å; G126-R128 VanDerWaalsContact O-N 3.08Å; G126-E129 PolarHBondContact O-N 2.86Å
127	P	94.3	Very high	96.8	Very high	108 Å²	108	61.7 Å²	61.7	70%	0.701	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.7	-175.1	27.1	-35.9	0	0	0	113.2
128	R	97.3	Very high	96.7	Very high	71 Å²	71	64.2 Å²	64.2	27%	0.268	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.7	37	-179.5	-54.2	-168.8	72.6	-177.2	7	111.1	D89 E90 E93 D120 F121 G126 V130	D89-R128 IonicContact OD1-NH2 3.32Å; D89-R128 PolarHBondContact OD1-NH2 2.85Å; D89-R128 IonicContact OD2-CZ 2.98Å; D89-R128 IonicContact OD2-NH2 2.68Å; D89-R128 PolarHBondContact OD2-NH2 2.88Å; E90-R128 HydrophobicContact CB-CB 4Å; E93-R128 IonicContact OE2-NH1 3.42Å; D120-R128 CarbonylContact O-C 3.37Å; D120-R128 WeakPolarHBondContact O-CA 3.36Å; D120-R128 WeakPolarHBondContact O-CB 3.29Å; D120-R128 PolarHBondContact O-N 2.68Å; D120-R128 VanDerWaalsContact O-N 3.13Å; F121-R128 HydrophobicContact CD1-CB 3.98Å; F121-R128 WeakPolarHBondContact CD1-O 2.8Å; F121-R128 HydrophobicContact CE1-CB 4Å; G126-R128 PolarHBondContact O-N 2.8Å; G126-R128 VanDerWaalsContact O-N 3.08Å; R128-V130 PolarHBondContact O-N 3.32Å
129	E	97.9	Very high	96.7	Very high	68 Å²	68	62.3 Å²	62.3	32%	0.318	32%	0.318	S	S	.	.			trans	-54.2	126.9	-177.9	-178.4	173.3	-160.7	0	0	111.2	D120 F121 S124 E125 G126 K137	D120-E129 PolarHBondContact O-N 2.77Å; F121-E129 WeakPolarHBondContact O-CA 3.31Å; S124-E129 WeakPolarHBondContact CA-OE1 3.41Å; S124-E129 WeakPolarHBondContact CA-OE2 3.3Å; E125-E129 PolarHBondContact N-OE2 3.41Å; G126-E129 PolarHBondContact O-N 2.86Å; E129-K137 IonicContact OE1-NZ 2.8Å; E129-K137 PolarHBondContact OE1-NZ 3.16Å
130	V	98.1	Very high	96.7	Very high	4 Å²	4	58.7 Å²	58.7	2%	0.024	30%	0.301	C	S	.	.			trans	-86.8	149.1	178.6	-62.5	0	0	0	0	111.4	E90 F94 F121 I122 R128 I132 I159	E90-V130 HydrophobicContact CB-CG1 4.48Å; E90-V130 HydrophobicContact CG-CG1 4.17Å; F94-V130 HydrophobicContact CB-CG1 3.66Å; F94-V130 HydrophobicContact CD1-CG1 4.27Å; F94-V130 HydrophobicContact CD1-CG2 4.23Å; F94-V130 HydrophobicContact CE1-CG2 4.4Å; F94-V130 HydrophobicContact CG-CG1 3.95Å; F94-V130 HydrophobicContact CG-CG2 4.34Å; F121-V130 HydrophobicContact CB-CG1 4.13Å; F121-V130 HydrophobicContact CB-CG2 4.49Å; F121-V130 HydrophobicContact CD1-CG1 4Å; F121-V130 HydrophobicContact CG-CG1 4.48Å; F121-V130 WeakPolarHBondContact O-CG2 3.48Å; F121-V130 PolarHBondContact O-N 3Å; I122-V130 HydrophobicContact CD1-CG2 4.34Å; R128-V130 PolarHBondContact O-N 3.32Å; V130-I132 HydrophobicContact CG2-CG1 4.48Å; V130-I132 HydrophobicContact CG2-CG2 4.19Å; V130-I132 PolarHBondContact O-N 2.94Å; V130-I159 HydrophobicContact CB-CD1 3.66Å; V130-I159 HydrophobicContact CB-CG1 3.99Å; V130-I159 HydrophobicContact CG2-CD1 3.89Å; V130-I159 HydrophobicContact CG2-CG1 3.88Å
131	N	97.1	Very high	96.6	Very high	125 Å²	125	58.6 Å²	58.6	67%	0.668	30%	0.301	S	S	*	.			trans	-78.1	90.4	-177.9	-174.2	7.5	0	0	0	112.1	I159 L162	N131-I159 WeakPolarHBondContact O-CD1 3.41Å; N131-L162 HydrophobicContact CB-CD2 4.03Å
132	I	97.1	Very high	96.6	Very high	24 Å²	24	64.7 Å²	64.7	12%	0.123	32%	0.323	C	S	.	.			trans	-124.6	150.1	174	56.7	175.6	0	0	0	112	I122 V130 T136 K137 A155 R158 I159	I122-I132 HydrophobicContact CD1-CD1 3.82Å; V130-I132 HydrophobicContact CG2-CG1 4.48Å; V130-I132 HydrophobicContact CG2-CG2 4.19Å; V130-I132 PolarHBondContact O-N 2.94Å; I132-T136 HydrophobicContact CB-CG2 4.18Å; I132-T136 HydrophobicContact CD1-CG2 4.18Å; I132-T136 HydrophobicContact CG2-CG2 4.37Å; I132-K137 HydrophobicContact CD1-CB 4.21Å; I132-A155 HydrophobicContact CD1-CB 4.25Å; I132-R158 HydrophobicContact CG2-CB 3.95Å; I132-I159 HydrophobicContact CG2-CD1 3.61Å; I132-I159 HydrophobicContact CG2-CG1 3.89Å
133	D	96.4	Very high	96.5	Very high	69 Å²	69	67.3 Å²	67.3	37%	0.369	34%	0.337	S	S	.	.			trans	-68	157.6	176.7	64.6	48.4	0	0	0	112.8	F135 T136 K137 R158	D133-F135 PolarHBondContact O-N 3.41Å; D133-F135 WeakPolarHBondContact OD1-CB 3.47Å; D133-F135 PolarHBondContact OD1-N 3.39Å; D133-T136 PolarHBondContact O-N 3.49Å; D133-T136 VanDerWaalsContact O-N 3.12Å; D133-T136 WeakPolarHBondContact OD1-CB 3.4Å; D133-T136 PolarHBondContact OD1-N 2.85Å; D133-T136 PolarHBondContact OD1-OG1 3.36Å; D133-T136 PolarHBondContact OD2-OG1 2.96Å; D133-K137 PolarHBondContact O-N 3.44Å; D133-R158 IonicContact OD2-CZ 3.7Å; D133-R158 IonicContact OD2-NE 2.77Å; D133-R158 IonicContact OD2-NH2 3.76Å
134	H	96.9	Very high	96.5	Very high	134 Å²	134	65.6 Å²	65.6	62%	0.62	33%	0.33	S	S	*	.	H	α-helix	trans	-57.3	-37.9	-178.5	-171.2	-74.3	0	0	0	112.4	T136 K137 D138	H134-T136 VanDerWaalsContact C-N 3.35Å; H134-T136 PolarHBondContact O-N 3.09Å; H134-K137 PolarHBondContact O-N 3.21Å; H134-D138 VanDerWaalsContact CE1-CG 3.46Å; H134-D138 IonicContact CE1-OD1 2.71Å; H134-D138 PolarHBondContact CE1-OD1 3.09Å; H134-D138 IonicContact CE1-OD2 3.05Å; H134-D138 PolarHBondContact CE1-OD2 3.1Å; H134-D138 IonicContact ND1-OD1 2.65Å; H134-D138 IonicContact ND1-OD2 2.93Å; H134-D138 PolarHBondContact ND1-OD2 3.23Å; H134-D138 WeakPolarHBondContact O-CB 3.31Å; H134-D138 VanDerWaalsContact O-CG 3.3Å; H134-D138 PolarHBondContact O-N 3.21Å
135	F	97.8	Very high	96.5	Very high	125 Å²	125	66.7 Å²	66.7	55%	0.548	33%	0.334	S	S	.	.	H	α-helix	trans	-61.7	-44.2	178.5	170.4	-96.7	0	0	0	111.8	D133 D138 V139 L154	D133-F135 PolarHBondContact O-N 3.41Å; D133-F135 WeakPolarHBondContact OD1-CB 3.47Å; D133-F135 PolarHBondContact OD1-N 3.39Å; F135-D138 PolarHBondContact O-N 3.35Å; F135-V139 HydrophobicContact CD1-CG2 4.48Å; F135-V139 HydrophobicContact CE1-CG2 4.04Å; F135-V139 HydrophobicContact CE2-CG2 4.26Å; F135-V139 HydrophobicContact CZ-CG2 3.92Å; F135-V139 WeakPolarHBondContact O-CG2 3.48Å; F135-V139 PolarHBondContact O-N 3.38Å; F135-L154 HydrophobicContact CD1-CD2 4.37Å; F135-L154 HydrophobicContact CE1-CD2 3.96Å
136	T	97.9	Very high	96.5	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.8	-44.2	178.7	-60.3	0	0	0	0	110.4	I132 D133 H134 D138 V139 T140 L154 A155 R158	I132-T136 HydrophobicContact CB-CG2 4.18Å; I132-T136 HydrophobicContact CD1-CG2 4.18Å; I132-T136 HydrophobicContact CG2-CG2 4.37Å; D133-T136 PolarHBondContact O-N 3.49Å; D133-T136 VanDerWaalsContact O-N 3.12Å; D133-T136 WeakPolarHBondContact OD1-CB 3.4Å; D133-T136 PolarHBondContact OD1-N 2.85Å; D133-T136 PolarHBondContact OD1-OG1 3.36Å; D133-T136 PolarHBondContact OD2-OG1 2.96Å; H134-T136 VanDerWaalsContact C-N 3.35Å; H134-T136 PolarHBondContact O-N 3.09Å; T136-D138 PolarHBondContact O-N 3.42Å; T136-V139 PolarHBondContact O-N 3.03Å; T136-T140 PolarHBondContact O-N 3.47Å; T136-T140 PolarHBondContact O-OG1 3.06Å; T136-L154 HydrophobicContact CG2-CD2 4.21Å; T136-L154 HydrophobicContact CG2-CG 3.93Å; T136-A155 HydrophobicContact CG2-CB 3.86Å; T136-R158 HydrophobicContact CG2-CG 3.89Å
137	K	97.7	Very high	96.8	Very high	24 Å²	24	64.1 Å²	64.1	10%	0.104	33%	0.333	C	S	.	.	H	α-helix	trans	-59.3	-44.6	174.9	-171.1	161.3	175.8	151.6	0	112	I122 S124 E129 I132 D133 H134 V139 T140 L141	I122-K137 HydrophobicContact CG2-CG 4.12Å; I122-K137 WeakPolarHBondContact O-CE 3.24Å; I122-K137 PolarHBondContact O-NZ 3.43Å; S124-K137 VanDerWaalsContact CA-NZ 3.3Å; S124-K137 WeakPolarHBondContact OG-CE 3.32Å; S124-K137 PolarHBondContact OG-NZ 2.84Å; E129-K137 IonicContact OE1-NZ 2.8Å; E129-K137 PolarHBondContact OE1-NZ 3.16Å; I132-K137 HydrophobicContact CD1-CB 4.21Å; D133-K137 PolarHBondContact O-N 3.44Å; H134-K137 PolarHBondContact O-N 3.21Å; K137-V139 PolarHBondContact O-N 2.89Å; K137-T140 PolarHBondContact O-N 3Å; K137-L141 WeakPolarHBondContact O-CG 3.28Å; K137-L141 PolarHBondContact O-N 3.25Å
138	D	97.3	Very high	96.9	Very high	61 Å²	61	61.1 Å²	61.1	33%	0.326	31%	0.314	S	S	.	.	H	α-helix	trans	-63.2	-37.9	176.1	-75.2	-24.7	0	0	0	113.4	H134 F135 T136 R142	H134-D138 VanDerWaalsContact CE1-CG 3.46Å; H134-D138 IonicContact CE1-OD1 2.71Å; H134-D138 PolarHBondContact CE1-OD1 3.09Å; H134-D138 IonicContact CE1-OD2 3.05Å; H134-D138 PolarHBondContact CE1-OD2 3.1Å; H134-D138 IonicContact ND1-OD1 2.65Å; H134-D138 IonicContact ND1-OD2 2.93Å; H134-D138 PolarHBondContact ND1-OD2 3.23Å; H134-D138 WeakPolarHBondContact O-CB 3.31Å; H134-D138 VanDerWaalsContact O-CG 3.3Å; H134-D138 PolarHBondContact O-N 3.21Å; F135-D138 PolarHBondContact O-N 3.35Å; T136-D138 PolarHBondContact O-N 3.42Å; D138-R142 WeakPolarHBondContact O-CG 3.36Å; D138-R142 PolarHBondContact O-N 3.39Å; D138-R142 VanDerWaalsContact O-N 3.16Å; D138-R142 PolarHBondContact O-NE 3.23Å
139	V	97.9	Very high	96.9	Very high	21 Å²	21	60.9 Å²	60.9	13%	0.127	32%	0.324	C	S	.	.	H	α-helix	trans	-63.8	-48	174	170.3	0	0	0	0	110	F135 T136 K137 L141 R142 N143 L154	F135-V139 HydrophobicContact CD1-CG2 4.48Å; F135-V139 HydrophobicContact CE1-CG2 4.04Å; F135-V139 HydrophobicContact CE2-CG2 4.26Å; F135-V139 HydrophobicContact CZ-CG2 3.92Å; F135-V139 WeakPolarHBondContact O-CG2 3.48Å; F135-V139 PolarHBondContact O-N 3.38Å; T136-V139 PolarHBondContact O-N 3.03Å; K137-V139 PolarHBondContact O-N 2.89Å; V139-L141 VanDerWaalsContact C-N 3.34Å; V139-L141 PolarHBondContact O-N 3.48Å; V139-R142 VanDerWaalsContact CG2-NH2 3.31Å; V139-R142 PolarHBondContact O-N 3.08Å; V139-N143 VanDerWaalsContact O-CG 3.28Å; V139-N143 PolarHBondContact O-N 3.13Å; V139-N143 PolarHBondContact O-OD1 3.23Å; V139-L154 HydrophobicContact CB-CD2 3.91Å; V139-L154 HydrophobicContact CG1-CB 4.49Å; V139-L154 HydrophobicContact CG1-CD2 3.89Å; V139-L154 HydrophobicContact CG2-CD2 3.92Å
140	T	97.8	Very high	96.9	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.006	33%	0.326	C	S	.	.	H	α-helix	trans	-58.9	-45	177.4	-61.7	0	0	0	0	111.7	I122 T136 K137 R142 N143 L144 F152	I122-T140 HydrophobicContact CG1-CG2 4.31Å; I122-T140 HydrophobicContact CG2-CG2 4.22Å; T136-T140 PolarHBondContact O-N 3.47Å; T136-T140 PolarHBondContact O-OG1 3.06Å; K137-T140 PolarHBondContact O-N 3Å; T140-R142 VanDerWaalsContact C-N 3.31Å; T140-R142 PolarHBondContact O-N 3.45Å; T140-N143 PolarHBondContact O-N 3.03Å; T140-N143 VanDerWaalsContact O-N 3.12Å; T140-L144 WeakPolarHBondContact O-CG 3.44Å; T140-L144 PolarHBondContact O-N 3.12Å; T140-F152 HydrophobicContact CG2-CD1 3.67Å; T140-F152 HydrophobicContact CG2-CE1 3.76Å
141	L	96.8	Very high	96.9	Very high	42 Å²	42	60 Å²	60	22%	0.22	33%	0.325	C	S	.	.	H	α-helix	trans	-59.3	-39.4	177.5	-74.6	176.4	0	0	0	113	Y118 K137 V139 L144	Y118-L141 HydrophobicContact CD2-CD2 4.09Å; Y118-L141 HydrophobicContact CE2-CD2 3.36Å; K137-L141 WeakPolarHBondContact O-CG 3.28Å; K137-L141 PolarHBondContact O-N 3.25Å; V139-L141 VanDerWaalsContact C-N 3.34Å; V139-L141 PolarHBondContact O-N 3.48Å; L141-L144 HydrophobicContact CD2-CD1 4.27Å; L141-L144 PolarHBondContact O-N 2.95Å
142	R	97.1	Very high	96.9	Very high	139 Å²	139	54.1 Å²	54.1	53%	0.525	29%	0.294	S	S	.	.	H	α-helix	trans	-66.4	-40.9	174.8	-75.2	-176.9	-74.5	155.9	-7.9	111.8	D138 V139 T140 L144 V145	D138-R142 WeakPolarHBondContact O-CG 3.36Å; D138-R142 PolarHBondContact O-N 3.39Å; D138-R142 VanDerWaalsContact O-N 3.16Å; D138-R142 PolarHBondContact O-NE 3.23Å; V139-R142 VanDerWaalsContact CG2-NH2 3.31Å; V139-R142 PolarHBondContact O-N 3.08Å; T140-R142 VanDerWaalsContact C-N 3.31Å; T140-R142 PolarHBondContact O-N 3.45Å; R142-L144 PolarHBondContact O-N 2.77Å; R142-V145 WeakPolarHBondContact O-CB 3.41Å; R142-V145 WeakPolarHBondContact O-CG2 3.27Å; R142-V145 PolarHBondContact O-N 2.75Å
143	N	96.6	Very high	97	Very high	56 Å²	56	56.2 Å²	56.2	30%	0.299	31%	0.305	S	S	.	.	H	α-helix	trans	-68	-22.3	178.8	-65.1	-11	0	0	0	113	V139 T140 V145 A146 T151	V139-N143 VanDerWaalsContact O-CG 3.28Å; V139-N143 PolarHBondContact O-N 3.13Å; V139-N143 PolarHBondContact O-OD1 3.23Å; T140-N143 PolarHBondContact O-N 3.03Å; T140-N143 VanDerWaalsContact O-N 3.12Å; N143-V145 PolarHBondContact O-N 3.1Å; N143-A146 CarbonylContact O-C 3.48Å; N143-A146 VanDerWaalsContact O-C 3.31Å; N143-A146 PolarHBondContact O-N 3.22Å; N143-T151 HydrophobicContact CB-CG2 3.89Å; N143-T151 PolarHBondContact ND2-O 3.31Å; N143-T151 VanDerWaalsContact ND2-O 3.08Å
144	L	95.9	Very high	97.1	Very high	44 Å²	44	55.3 Å²	55.3	23%	0.23	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-16.9	175.6	-72.6	170.7	0	0	0	113.3	A114 Y118 T140 L141 R142 L147 T151 F152	A114-L144 HydrophobicContact CB-CD2 4Å; Y118-L144 HydrophobicContact CD2-CD1 3.62Å; Y118-L144 HydrophobicContact CE2-CD1 4.38Å; Y118-L144 HydrophobicContact CG-CD1 3.95Å; T140-L144 WeakPolarHBondContact O-CG 3.44Å; T140-L144 PolarHBondContact O-N 3.12Å; L141-L144 HydrophobicContact CD2-CD1 4.27Å; L141-L144 PolarHBondContact O-N 2.95Å; R142-L144 PolarHBondContact O-N 2.77Å; L144-L147 HydrophobicContact CD2-CD2 3.86Å; L144-T151 HydrophobicContact CD2-CG2 3.91Å; L144-T151 HydrophobicContact CG-CG2 4.33Å; L144-F152 HydrophobicContact CD2-CE1 4.22Å; L144-F152 HydrophobicContact CD2-CZ 3.88Å
145	V	94.3	Very high	97.2	Very high	93 Å²	93	48.9 Å²	48.9	56%	0.564	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-35.3	176.3	-178.9	0	0	0	0	111.5	R142 N143	R142-V145 WeakPolarHBondContact O-CB 3.41Å; R142-V145 WeakPolarHBondContact O-CG2 3.27Å; R142-V145 PolarHBondContact O-N 2.75Å; N143-V145 PolarHBondContact O-N 3.1Å
146	A	93.9	Very high	97.2	Very high	76 Å²	76	43.3 Å²	43.3	63%	0.628	25%	0.246	S	C	*	.	S	Bend	trans	-137.2	94.3	178.8	0	0	0	0	0	109	N143	N143-A146 CarbonylContact O-C 3.48Å; N143-A146 VanDerWaalsContact O-C 3.31Å; N143-A146 PolarHBondContact O-N 3.22Å
147	L	96	Very high	97.3	Very high	62 Å²	62	50.6 Å²	50.6	33%	0.325	28%	0.278	S	S	.	.			trans	-65	137.3	-174.3	-59.8	178.2	0	0	0	112	M110 A111 A114 L144 T151	M110-L147 HydrophobicContact SD-CB 4.44Å; A111-L147 HydrophobicContact CB-CD1 3.98Å; A114-L147 HydrophobicContact CB-CD1 3.79Å; A114-L147 HydrophobicContact CB-CD2 3.65Å; A114-L147 HydrophobicContact CB-CG 4.4Å; L144-L147 HydrophobicContact CD2-CD2 3.86Å; L147-T151 HydrophobicContact CD2-CG2 4.06Å
148	S	96.8	Very high	97.3	Very high	44 Å²	44	54.9 Å²	54.9	31%	0.308	29%	0.293	S	S	.	.			trans	-141.4	170.1	171.9	66.9	0	0	0	0	108.5	F101 S150 T151	F101-S148 WeakPolarHBondContact CE1-O 3.05Å; F101-S148 WeakPolarHBondContact CZ-O 3.02Å; S148-S150 PolarHBondContact O-N 2.84Å; S148-S150 VanDerWaalsContact O-N 3.15Å; S148-S150 PolarHBondContact OG-N 3.42Å; S148-S150 PolarHBondContact OG-OG 3.37Å; S148-T151 PolarHBondContact N-OG1 3.43Å; S148-T151 WeakPolarHBondContact O-CB 3.31Å; S148-T151 PolarHBondContact O-N 3.33Å; S148-T151 PolarHBondContact O-OG1 2.98Å; S148-T151 PolarHBondContact OG-N 2.99Å
149	S	96.9	Very high	97.4	Very high	67 Å²	67	52 Å²	52	47%	0.469	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-26.1	171.2	50.5	0	0	0	0	112.8	K102	K102-S149 VanDerWaalsContact CG-O 3.32Å; K102-S149 WeakPolarHBondContact CG-O 3.37Å
150	S	97.8	Very high	97.4	Very high	53 Å²	53	53.2 Å²	53.2	37%	0.371	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	4	-179	57.1	0	0	0	0	115	S148 F152 D153	S148-S150 PolarHBondContact O-N 2.84Å; S148-S150 VanDerWaalsContact O-N 3.15Å; S148-S150 PolarHBondContact OG-N 3.42Å; S148-S150 PolarHBondContact OG-OG 3.37Å; S150-F152 PolarHBondContact O-N 3.41Å; S150-D153 VanDerWaalsContact CA-OD2 3.27Å; S150-D153 WeakPolarHBondContact CA-OD2 3.46Å; S150-D153 WeakPolarHBondContact CB-OD2 3.39Å; S150-D153 PolarHBondContact O-N 3.02Å; S150-D153 VanDerWaalsContact O-N 3.13Å
151	T	98.3	Very high	97.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-38.3	-174.5	-69.4	0	0	0	0	113.4	N143 L144 L147 S148	N143-T151 HydrophobicContact CB-CG2 3.89Å; N143-T151 PolarHBondContact ND2-O 3.31Å; N143-T151 VanDerWaalsContact ND2-O 3.08Å; L144-T151 HydrophobicContact CD2-CG2 3.91Å; L144-T151 HydrophobicContact CG-CG2 4.33Å; L147-T151 HydrophobicContact CD2-CG2 4.06Å; S148-T151 PolarHBondContact N-OG1 3.43Å; S148-T151 WeakPolarHBondContact O-CB 3.31Å; S148-T151 PolarHBondContact O-N 3.33Å; S148-T151 PolarHBondContact O-OG1 2.98Å; S148-T151 PolarHBondContact OG-N 2.99Å
152	F	98.7	Very high	97.5	Very high	2 Å²	2	56 Å²	56	1%	0.009	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	4.6	-175.9	-58.9	-73.9	0	0	0	114.7	C98 F101 A114 I117 T140 L144 S150 L154 A155 Q156	C98-F152 HydrophobicContact CB-CB 4.5Å; C98-F152 VanDerWaalsContact SG-CB 3.6Å; F101-F152 AromaticContact CD1-CD2 3.63Å; F101-F152 HydrophobicContact CD1-CD2 3.63Å; F101-F152 AromaticContact CD1-CE2 3.93Å; F101-F152 HydrophobicContact CD1-CE2 3.93Å; F101-F152 HydrophobicContact CD2-CE2 4.02Å; F101-F152 AromaticContact CE1-CD2 3.73Å; F101-F152 HydrophobicContact CE1-CD2 3.73Å; F101-F152 AromaticContact CE1-CE2 3.85Å; F101-F152 HydrophobicContact CE1-CE2 3.85Å; F101-F152 AromaticContact CE2-CE2 3.97Å; F101-F152 HydrophobicContact CE2-CE2 3.97Å; F101-F152 HydrophobicContact CG-CD2 4.04Å; F101-F152 HydrophobicContact CG-CE2 4Å; F101-F152 HydrophobicContact CZ-CD2 4.24Å; F101-F152 AromaticContact CZ-CE2 3.88Å; F101-F152 HydrophobicContact CZ-CE2 3.88Å; A114-F152 HydrophobicContact CB-CE2 4.25Å; A114-F152 HydrophobicContact CB-CZ 4.16Å; I117-F152 HydrophobicContact CB-CE1 4.21Å; I117-F152 HydrophobicContact CB-CE2 4.24Å; I117-F152 HydrophobicContact CB-CZ 3.84Å; I117-F152 HydrophobicContact CD1-CD2 4.22Å; I117-F152 HydrophobicContact CD1-CE2 3.85Å; I117-F152 HydrophobicContact CD1-CZ 4.34Å; I117-F152 HydrophobicContact CG2-CD1 3.87Å; I117-F152 HydrophobicContact CG2-CD2 4.39Å; I117-F152 HydrophobicContact CG2-CE1 3.51Å; I117-F152 HydrophobicContact CG2-CE2 4.07Å; I117-F152 HydrophobicContact CG2-CG 4.3Å; I117-F152 HydrophobicContact CG2-CZ 3.62Å; T140-F152 HydrophobicContact CG2-CD1 3.67Å; T140-F152 HydrophobicContact CG2-CE1 3.76Å; L144-F152 HydrophobicContact CD2-CE1 4.22Å; L144-F152 HydrophobicContact CD2-CZ 3.88Å; S150-F152 PolarHBondContact O-N 3.41Å; F152-L154 PolarHBondContact O-N 3.42Å; F152-A155 PolarHBondContact O-N 3.48Å; F152-A155 VanDerWaalsContact O-N 3.13Å; F152-Q156 WeakPolarHBondContact O-CB 3.48Å; F152-Q156 PolarHBondContact O-N 3.3Å
153	D	98.6	Very high	97.6	Very high	67 Å²	67	49.4 Å²	49.4	36%	0.358	28%	0.277	S	S	.	.	H	α-helix	trans	-56	-44.8	-169.3	-78.9	-10.8	0	0	0	113.7	K102 S150 K157	K102-D153 WeakPolarHBondContact CE-OD1 3.4Å; K102-D153 IonicContact NZ-OD1 2.69Å; K102-D153 PolarHBondContact NZ-OD1 3.48Å; S150-D153 VanDerWaalsContact CA-OD2 3.27Å; S150-D153 WeakPolarHBondContact CA-OD2 3.46Å; S150-D153 WeakPolarHBondContact CB-OD2 3.39Å; S150-D153 PolarHBondContact O-N 3.02Å; S150-D153 VanDerWaalsContact O-N 3.13Å; D153-K157 VanDerWaalsContact O-CB 3.3Å; D153-K157 WeakPolarHBondContact O-CB 3.5Å; D153-K157 PolarHBondContact O-N 2.94Å
154	L	98.6	Very high	97.6	Very high	50 Å²	50	50.4 Å²	50.4	26%	0.262	28%	0.28	S	S	.	.	H	α-helix	trans	-65.4	-46.2	180	-178	62.8	0	0	0	111.3	F135 T136 V139 F152 K157 R158	F135-L154 HydrophobicContact CD1-CD2 4.37Å; F135-L154 HydrophobicContact CE1-CD2 3.96Å; T136-L154 HydrophobicContact CG2-CD2 4.21Å; T136-L154 HydrophobicContact CG2-CG 3.93Å; V139-L154 HydrophobicContact CB-CD2 3.91Å; V139-L154 HydrophobicContact CG1-CB 4.49Å; V139-L154 HydrophobicContact CG1-CD2 3.89Å; V139-L154 HydrophobicContact CG2-CD2 3.92Å; F152-L154 PolarHBondContact O-N 3.42Å; L154-K157 PolarHBondContact O-N 3.38Å; L154-R158 WeakPolarHBondContact O-CG 3.46Å; L154-R158 PolarHBondContact O-N 3.31Å
155	A	98.6	Very high	97.7	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-64	-45.4	179	0	0	0	0	0	111.4	F94 I122 I132 T136 F152 K157 R158 I159	F94-A155 HydrophobicContact CE1-CB 4.14Å; F94-A155 HydrophobicContact CZ-CB 3.74Å; I122-A155 HydrophobicContact CD1-CB 4.39Å; I132-A155 HydrophobicContact CD1-CB 4.25Å; T136-A155 HydrophobicContact CG2-CB 3.86Å; F152-A155 PolarHBondContact O-N 3.48Å; F152-A155 VanDerWaalsContact O-N 3.13Å; A155-K157 VanDerWaalsContact C-N 3.3Å; A155-K157 PolarHBondContact O-N 2.95Å; A155-R158 WeakPolarHBondContact O-CB 3.14Å; A155-R158 PolarHBondContact O-N 2.96Å; A155-R158 VanDerWaalsContact O-N 3.12Å; A155-I159 PolarHBondContact O-N 3.47Å
156	Q	98.8	Very high	97.7	Very high	7 Å²	7	57 Å²	57	3%	0.033	30%	0.303	C	S	.	.	H	α-helix	trans	-59.5	-41.5	175.8	-169.4	-173.2	12.6	0	0	111.7	F94 W95 C98 E99 F152 R158 I159 Y160	F94-Q156 HydrophobicContact CE1-CB 4.44Å; W95-Q156 HydrophobicContact CG-CG 4.22Å; W95-Q156 PolarHBondContact O-NE2 2.86Å; C98-Q156 HydrophobicContact CB-CB 4.14Å; C98-Q156 HydrophobicContact CB-CG 3.82Å; E99-Q156 PolarHBondContact OE1-NE2 3.39Å; F152-Q156 WeakPolarHBondContact O-CB 3.48Å; F152-Q156 PolarHBondContact O-N 3.3Å; Q156-R158 VanDerWaalsContact C-N 3.35Å; Q156-R158 PolarHBondContact O-N 3.27Å; Q156-I159 PolarHBondContact O-N 2.83Å; Q156-Y160 WeakPolarHBondContact O-CB 3.28Å; Q156-Y160 PolarHBondContact O-N 2.84Å
157	K	98.6	Very high	97.9	Very high	153 Å²	153	53.5 Å²	53.5	67%	0.665	27%	0.274	S	S	*	.	H	α-helix	trans	-62.8	-39.2	175.3	-175.7	176.3	-178.5	175.6	0	112.3	D153 L154 A155 A161	D153-K157 VanDerWaalsContact O-CB 3.3Å; D153-K157 WeakPolarHBondContact O-CB 3.5Å; D153-K157 PolarHBondContact O-N 2.94Å; L154-K157 PolarHBondContact O-N 3.38Å; A155-K157 VanDerWaalsContact C-N 3.3Å; A155-K157 PolarHBondContact O-N 2.95Å; K157-A161 WeakPolarHBondContact O-CB 3.41Å; K157-A161 PolarHBondContact O-N 2.87Å; K157-A161 VanDerWaalsContact O-N 3.08Å
158	R	98.6	Very high	98	Very high	114 Å²	114	51.3 Å²	51.3	43%	0.43	26%	0.262	S	S	.	.	H	α-helix	trans	-63.2	-45.6	175.4	-68.7	-52.9	-171	-179.3	2.3	111.6	I132 D133 T136 L154 A155 Q156 A161 L162	I132-R158 HydrophobicContact CG2-CB 3.95Å; D133-R158 IonicContact OD2-CZ 3.7Å; D133-R158 IonicContact OD2-NE 2.77Å; D133-R158 IonicContact OD2-NH2 3.76Å; T136-R158 HydrophobicContact CG2-CG 3.89Å; L154-R158 WeakPolarHBondContact O-CG 3.46Å; L154-R158 PolarHBondContact O-N 3.31Å; A155-R158 WeakPolarHBondContact O-CB 3.14Å; A155-R158 PolarHBondContact O-N 2.96Å; A155-R158 VanDerWaalsContact O-N 3.12Å; Q156-R158 VanDerWaalsContact C-N 3.35Å; Q156-R158 PolarHBondContact O-N 3.27Å; R158-A161 PolarHBondContact O-N 3.5Å; R158-L162 PolarHBondContact O-N 3.26Å
159	I	98.6	Very high	98	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-70.4	-37.7	-179.5	-64.1	-51.6	0	0	0	112.3	N91 F94 V130 N131 I132 A155 Q156 A161 L162 M163	N91-I159 HydrophobicContact CB-CG2 3.68Å; N91-I159 VanDerWaalsContact O-CG2 3.28Å; N91-I159 WeakPolarHBondContact O-CG2 3.42Å; F94-I159 HydrophobicContact CD1-CB 3.93Å; F94-I159 HydrophobicContact CD1-CG1 3.68Å; F94-I159 HydrophobicContact CD1-CG2 4.09Å; F94-I159 HydrophobicContact CE1-CB 4.2Å; F94-I159 HydrophobicContact CE1-CG1 3.79Å; V130-I159 HydrophobicContact CB-CD1 3.66Å; V130-I159 HydrophobicContact CB-CG1 3.99Å; V130-I159 HydrophobicContact CG2-CD1 3.89Å; V130-I159 HydrophobicContact CG2-CG1 3.88Å; N131-I159 WeakPolarHBondContact O-CD1 3.41Å; I132-I159 HydrophobicContact CG2-CD1 3.61Å; I132-I159 HydrophobicContact CG2-CG1 3.89Å; A155-I159 PolarHBondContact O-N 3.47Å; Q156-I159 PolarHBondContact O-N 2.83Å; I159-A161 VanDerWaalsContact C-N 3.34Å; I159-A161 PolarHBondContact O-N 2.85Å; I159-L162 HydrophobicContact CD1-CD2 4.1Å; I159-L162 WeakPolarHBondContact O-CB 3.47Å; I159-L162 PolarHBondContact O-N 3.45Å; I159-M163 HydrophobicContact CG2-CE 4.23Å; I159-M163 WeakPolarHBondContact O-CG 3.48Å; I159-M163 PolarHBondContact O-N 3.22Å
160	Y	98.6	Very high	98.1	Very high	47 Å²	47	51.3 Å²	51.3	18%	0.184	25%	0.252	C	S	.	.	H	α-helix	trans	-56.1	-50	170	177.3	-83.1	0	0	0	111.2	L66 E67 L70 W95 Q156 L162 M163 E164	L66-Y160 HydrophobicContact CB-CE2 4.09Å; L66-Y160 WeakPolarHBondContact CB-OH 3.36Å; L66-Y160 HydrophobicContact CD2-CD2 4.06Å; L66-Y160 HydrophobicContact CD2-CE2 3.85Å; L66-Y160 HydrophobicContact CG-CE2 3.88Å; E67-Y160 PolarHBondContact N-OH 2.65Å; L70-Y160 HydrophobicContact CD1-CD2 3.89Å; L70-Y160 HydrophobicContact CD1-CE2 3.9Å; W95-Y160 AromaticContact NE1-CD2 3.96Å; Q156-Y160 WeakPolarHBondContact O-CB 3.28Å; Q156-Y160 PolarHBondContact O-N 2.84Å; Y160-L162 VanDerWaalsContact C-N 3.29Å; Y160-L162 PolarHBondContact O-N 3.38Å; Y160-M163 PolarHBondContact O-N 3.33Å; Y160-E164 HydrophobicContact CE1-CB 4.31Å; Y160-E164 WeakPolarHBondContact O-CB 3.4Å; Y160-E164 PolarHBondContact O-N 3.04Å; Y160-E164 PolarHBondContact OH-OE1 2.96Å
161	A	98.3	Very high	98.1	Very high	48 Å²	48	48.8 Å²	48.8	40%	0.397	24%	0.235	S	C	.	.	H	α-helix	trans	-64.5	-33.5	179.9	0	0	0	0	0	112.8	K157 R158 I159 K165	K157-A161 WeakPolarHBondContact O-CB 3.41Å; K157-A161 PolarHBondContact O-N 2.87Å; K157-A161 VanDerWaalsContact O-N 3.08Å; R158-A161 PolarHBondContact O-N 3.5Å; I159-A161 VanDerWaalsContact C-N 3.34Å; I159-A161 PolarHBondContact O-N 2.85Å; A161-K165 VanDerWaalsContact O-CB 3.29Å; A161-K165 WeakPolarHBondContact O-CB 3.42Å; A161-K165 PolarHBondContact O-N 3.42Å
162	L	98.1	Very high	98.1	Very high	54 Å²	54	50.3 Å²	50.3	28%	0.283	24%	0.243	S	C	.	.	H	α-helix	trans	-62.9	-52.9	173.3	177.4	65.2	0	0	0	110.9	N131 R158 I159 Y160 E164 K165 D166	N131-L162 HydrophobicContact CB-CD2 4.03Å; R158-L162 PolarHBondContact O-N 3.26Å; I159-L162 HydrophobicContact CD1-CD2 4.1Å; I159-L162 WeakPolarHBondContact O-CB 3.47Å; I159-L162 PolarHBondContact O-N 3.45Å; Y160-L162 VanDerWaalsContact C-N 3.29Å; Y160-L162 PolarHBondContact O-N 3.38Å; L162-E164 VanDerWaalsContact C-N 3.32Å; L162-E164 PolarHBondContact O-N 3.4Å; L162-K165 PolarHBondContact O-N 3.36Å; L162-D166 WeakPolarHBondContact O-CB 3.48Å; L162-D166 PolarHBondContact O-N 3Å
163	M	98.4	Very high	98	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.7	-42.5	178.2	-70.2	-172.6	-63.6	0	0	111.7	L66 F79 L83 N91 I92 W95 I159 Y160 K165 S167 F168	L66-M163 HydrophobicContact CD2-CB 3.79Å; F79-M163 HydrophobicContact CE1-CB 4.32Å; F79-M163 HydrophobicContact CE1-SD 3.91Å; F79-M163 HydrophobicContact CZ-CB 4.21Å; L83-M163 HydrophobicContact CD1-SD 4Å; N91-M163 HydrophobicContact CB-CG 3.62Å; N91-M163 HydrophobicContact CB-SD 3.66Å; I92-M163 HydrophobicContact CB-SD 3.98Å; I92-M163 HydrophobicContact CD1-CE 4.24Å; I92-M163 HydrophobicContact CD1-SD 4.25Å; W95-M163 HydrophobicContact CB-CE 4.03Å; W95-M163 HydrophobicContact CG-CE 4.22Å; I159-M163 HydrophobicContact CG2-CE 4.23Å; I159-M163 WeakPolarHBondContact O-CG 3.48Å; I159-M163 PolarHBondContact O-N 3.22Å; Y160-M163 PolarHBondContact O-N 3.33Å; M163-K165 VanDerWaalsContact C-N 3.34Å; M163-K165 PolarHBondContact O-N 3.43Å; M163-S167 PolarHBondContact O-N 3.15Å; M163-F168 WeakPolarHBondContact O-CB 3.45Å; M163-F168 PolarHBondContact O-N 3.22Å
164	E	98.2	Very high	97.9	Very high	78 Å²	78	56 Å²	56	36%	0.364	26%	0.262	S	S	.	.	I	π-helix	trans	-63.3	-39.5	179.4	-173.6	171	-118.1	0	0	112.1	L66 Y160 L162 F168	L66-E164 HydrophobicContact CB-CB 4.35Å; L66-E164 HydrophobicContact CB-CG 4.29Å; L66-E164 HydrophobicContact CD2-CB 3.96Å; Y160-E164 HydrophobicContact CE1-CB 4.31Å; Y160-E164 WeakPolarHBondContact O-CB 3.4Å; Y160-E164 PolarHBondContact O-N 3.04Å; Y160-E164 PolarHBondContact OH-OE1 2.96Å; L162-E164 VanDerWaalsContact C-N 3.32Å; L162-E164 PolarHBondContact O-N 3.4Å; E164-F168 HydrophobicContact CG-CD1 4.4Å
165	K	96.9	Very high	97.8	Very high	192 Å²	192	59.8 Å²	59.8	84%	0.835	28%	0.283	S	S	*	.	I	π-helix	trans	-78.5	-39	-178.9	-174.2	178.4	176.6	-175.1	0	113.3	A161 L162 M163	A161-K165 VanDerWaalsContact O-CB 3.29Å; A161-K165 WeakPolarHBondContact O-CB 3.42Å; A161-K165 PolarHBondContact O-N 3.42Å; L162-K165 PolarHBondContact O-N 3.36Å; M163-K165 VanDerWaalsContact C-N 3.34Å; M163-K165 PolarHBondContact O-N 3.43Å
166	D	95.2	Very high	97.5	Very high	83 Å²	83	63.2 Å²	63.2	44%	0.444	30%	0.298	S	S	.	.	I	π-helix	trans	-102.9	-49.3	-167	-169.1	71.9	0	0	0	113.5	L162 R170	L162-D166 WeakPolarHBondContact O-CB 3.48Å; L162-D166 PolarHBondContact O-N 3Å; D166-R170 PolarHBondContact O-NE 2.84Å; D166-R170 IonicContact OD2-CZ 3.81Å; D166-R170 IonicContact OD2-NH2 3.1Å; D166-R170 PolarHBondContact OD2-NH2 3.19Å
167	S	97.6	Very high	97.4	Very high	3 Å²	3	63.1 Å²	63.1	2%	0.021	30%	0.298	C	S	.	.	I	π-helix	trans	-97.6	-36.7	-170.7	-44.8	0	0	0	0	112.7	F82 L83 M163 G169 R170 F171	F82-S167 WeakPolarHBondContact CE1-O 3.49Å; L83-S167 WeakPolarHBondContact CD2-OG 3.44Å; M163-S167 PolarHBondContact O-N 3.15Å; S167-G169 PolarHBondContact O-N 3.43Å; S167-R170 CarbonylContact O-C 3.17Å; S167-R170 WeakPolarHBondContact O-CA 3.36Å; S167-R170 WeakPolarHBondContact O-CB 3.32Å; S167-R170 PolarHBondContact O-N 3.43Å; S167-F171 PolarHBondContact O-N 3.23Å
168	F	98.3	Very high	97.3	Very high	15 Å²	15	59.9 Å²	59.9	7%	0.066	29%	0.285	C	S	.	.	I	π-helix	trans	-62.5	-44.1	-173.6	176.1	-125.3	0	0	0	112.5	W62 L66 V69 M163 E164 R170 F171 L172	W62-F168 VanDerWaalsContact O-CZ 3.27Å; W62-F168 WeakPolarHBondContact O-CZ 3.46Å; L66-F168 HydrophobicContact CB-CD1 4.13Å; L66-F168 HydrophobicContact CB-CD2 4.19Å; L66-F168 HydrophobicContact CB-CE1 4.39Å; L66-F168 HydrophobicContact CB-CE2 4.45Å; L66-F168 HydrophobicContact CB-CG 4.03Å; L66-F168 HydrophobicContact CD1-CB 4.34Å; L66-F168 HydrophobicContact CD1-CD2 3.83Å; L66-F168 HydrophobicContact CD1-CE2 4.45Å; L66-F168 HydrophobicContact CD1-CG 4.19Å; V69-F168 HydrophobicContact CG2-CE2 3.76Å; M163-F168 WeakPolarHBondContact O-CB 3.45Å; M163-F168 PolarHBondContact O-N 3.22Å; E164-F168 HydrophobicContact CG-CD1 4.4Å; F168-R170 PolarHBondContact O-N 2.97Å; F168-F171 HydrophobicContact CD2-CD1 4.21Å; F168-F171 HydrophobicContact CE2-CD1 4.4Å; F168-F171 WeakPolarHBondContact O-CB 3.47Å; F168-F171 PolarHBondContact O-N 3.03Å; F168-L172 HydrophobicContact CD1-CD1 4.47Å; F168-L172 HydrophobicContact CD2-CG 4.26Å; F168-L172 HydrophobicContact CE1-CD1 3.94Å; F168-L172 HydrophobicContact CE2-CD1 4.02Å; F168-L172 HydrophobicContact CE2-CD2 3.81Å; F168-L172 HydrophobicContact CE2-CG 3.85Å; F168-L172 HydrophobicContact CZ-CD1 3.69Å; F168-L172 HydrophobicContact CZ-CD2 4.1Å; F168-L172 HydrophobicContact CZ-CG 4.05Å; F168-L172 WeakPolarHBondContact O-CG 3.11Å; F168-L172 PolarHBondContact O-N 3.02Å
169	G	97.2	Very high	97	Very high	24 Å²	24	60 Å²	60	25%	0.247	29%	0.291	C	S	.	.	H	α-helix	trans	-60.4	-34.9	174.4	0	0	0	0	0	112.9	S167 R173	S167-G169 PolarHBondContact O-N 3.43Å; G169-R173 PolarHBondContact O-NH1 2.9Å
170	R	98.1	Very high	96.7	Very high	88 Å²	88	60.3 Å²	60.3	33%	0.332	29%	0.292	S	S	.	.	H	α-helix	trans	-73.5	-40.9	175.8	-68.1	-172.1	-79.9	160.5	-7.8	111.8	F82 E86 D166 S167 F168 L172 R173 S174	F82-R170 HydrophobicContact CE1-CB 4.29Å; F82-R170 HydrophobicContact CZ-CB 3.64Å; E86-R170 IonicContact OE1-CZ 3.44Å; E86-R170 IonicContact OE1-NE 3.79Å; E86-R170 IonicContact OE1-NH1 2.75Å; E86-R170 PolarHBondContact OE1-NH1 3.02Å; E86-R170 IonicContact OE2-CZ 3.13Å; E86-R170 IonicContact OE2-NE 3.68Å; E86-R170 IonicContact OE2-NH1 3.05Å; E86-R170 PolarHBondContact OE2-NH1 2.86Å; E86-R170 IonicContact OE2-NH2 2.71Å; E86-R170 PolarHBondContact OE2-NH2 3.29Å; D166-R170 PolarHBondContact O-NE 2.84Å; D166-R170 IonicContact OD2-CZ 3.81Å; D166-R170 IonicContact OD2-NH2 3.1Å; D166-R170 PolarHBondContact OD2-NH2 3.19Å; S167-R170 CarbonylContact O-C 3.17Å; S167-R170 WeakPolarHBondContact O-CA 3.36Å; S167-R170 WeakPolarHBondContact O-CB 3.32Å; S167-R170 PolarHBondContact O-N 3.43Å; F168-R170 PolarHBondContact O-N 2.97Å; R170-L172 VanDerWaalsContact C-N 3.3Å; R170-L172 PolarHBondContact O-N 3.48Å; R170-R173 CarbonylContact O-C 3.54Å; R170-R173 WeakPolarHBondContact O-CA 3.34Å; R170-R173 PolarHBondContact O-N 2.83Å; R170-S174 PolarHBondContact O-N 3.25Å
171	F	98.3	Very high	96.5	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-54.5	-46.5	172.6	169.3	-109	0	0	0	111.5	W62 V69 A78 F79 F82 S167 F168 R173 S174 Y177	W62-F171 HydrophobicContact CE3-CE1 4.47Å; V69-F171 HydrophobicContact CG1-CE1 4.18Å; V69-F171 HydrophobicContact CG2-CE1 4.12Å; A78-F171 HydrophobicContact CB-CE2 4.19Å; A78-F171 HydrophobicContact CB-CZ 4.24Å; F79-F171 HydrophobicContact CB-CE2 4.43Å; F79-F171 HydrophobicContact CB-CZ 4.48Å; F79-F171 HydrophobicContact CD2-CB 3.79Å; F79-F171 AromaticContact CD2-CD1 3.9Å; F79-F171 HydrophobicContact CD2-CD1 3.9Å; F79-F171 AromaticContact CD2-CD2 3.9Å; F79-F171 HydrophobicContact CD2-CD2 3.9Å; F79-F171 HydrophobicContact CD2-CE1 4.46Å; F79-F171 HydrophobicContact CD2-CE2 4.45Å; F79-F171 AromaticContact CD2-CG 3.58Å; F79-F171 HydrophobicContact CD2-CG 3.58Å; F79-F171 HydrophobicContact CE2-CB 3.82Å; F79-F171 HydrophobicContact CE2-CD1 4.48Å; F79-F171 HydrophobicContact CE2-CG 4.12Å; F82-F171 HydrophobicContact CB-CD2 3.74Å; F82-F171 HydrophobicContact CB-CE2 4.36Å; F82-F171 HydrophobicContact CD1-CB 3.72Å; F82-F171 HydrophobicContact CD1-CD2 4.16Å; F82-F171 HydrophobicContact CD1-CG 4.4Å; F82-F171 HydrophobicContact CD2-CB 4.46Å; F82-F171 HydrophobicContact CD2-CD2 4.25Å; F82-F171 HydrophobicContact CE1-CB 3.82Å; F82-F171 HydrophobicContact CG-CB 4.07Å; F82-F171 AromaticContact CG-CD2 3.77Å; F82-F171 HydrophobicContact CG-CD2 3.77Å; F82-F171 HydrophobicContact CG-CG 4.41Å; F82-F171 HydrophobicContact CZ-CB 4.26Å; S167-F171 PolarHBondContact O-N 3.23Å; F168-F171 HydrophobicContact CD2-CD1 4.21Å; F168-F171 HydrophobicContact CE2-CD1 4.4Å; F168-F171 WeakPolarHBondContact O-CB 3.47Å; F168-F171 PolarHBondContact O-N 3.03Å; F171-R173 PolarHBondContact O-N 3.01Å; F171-R173 VanDerWaalsContact O-N 3.12Å; F171-S174 WeakPolarHBondContact O-CB 3.42Å; F171-S174 PolarHBondContact O-N 3.42Å; F171-S174 PolarHBondContact O-OG 3.24Å; F171-Y177 AromaticContact CE1-CD2 3.94Å; F171-Y177 HydrophobicContact CE1-CD2 3.94Å; F171-Y177 HydrophobicContact CE1-CG 4.35Å; F171-Y177 HydrophobicContact CZ-CD2 4.04Å; F171-Y177 HydrophobicContact CZ-CG 4.46Å; F171-Y177 VanDerWaalsContact O-CB 3.3Å; F171-Y177 WeakPolarHBondContact O-CB 3.25Å
172	L	97.5	Very high	95.9	Very high	32 Å²	32	63.6 Å²	63.6	17%	0.168	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-18.3	177.7	-65.7	178.4	0	0	0	113.7	R63 F168 R170 Y177 Q178	R63-L172 HydrophobicContact CB-CD1 4.14Å; R63-L172 HydrophobicContact CB-CD2 4.25Å; F168-L172 HydrophobicContact CD1-CD1 4.47Å; F168-L172 HydrophobicContact CD2-CG 4.26Å; F168-L172 HydrophobicContact CE1-CD1 3.94Å; F168-L172 HydrophobicContact CE2-CD1 4.02Å; F168-L172 HydrophobicContact CE2-CD2 3.81Å; F168-L172 HydrophobicContact CE2-CG 3.85Å; F168-L172 HydrophobicContact CZ-CD1 3.69Å; F168-L172 HydrophobicContact CZ-CD2 4.1Å; F168-L172 HydrophobicContact CZ-CG 4.05Å; F168-L172 WeakPolarHBondContact O-CG 3.11Å; F168-L172 PolarHBondContact O-N 3.02Å; R170-L172 VanDerWaalsContact C-N 3.3Å; R170-L172 PolarHBondContact O-N 3.48Å; L172-Y177 HydrophobicContact CB-CD1 4.32Å; L172-Y177 HydrophobicContact CB-CE1 4.32Å; L172-Y177 HydrophobicContact CD2-CD1 4.01Å; L172-Y177 HydrophobicContact CD2-CD2 4.47Å; L172-Y177 HydrophobicContact CD2-CE1 3.54Å; L172-Y177 HydrophobicContact CD2-CE2 4.11Å; L172-Y177 HydrophobicContact CD2-CG 4.42Å; L172-Y177 VanDerWaalsContact O-CD1 3.23Å; L172-Y177 WeakPolarHBondContact O-CD1 3.41Å; L172-Q178 PolarHBondContact O-NE2 3.03Å
173	R	97.3	Very high	93.9	Very high	169 Å²	169	68 Å²	68	64%	0.638	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-6.1	175.1	-67	-174.8	-63.9	-87.4	2	113.4	G169 R170 F171	G169-R173 PolarHBondContact O-NH1 2.9Å; R170-R173 CarbonylContact O-C 3.54Å; R170-R173 WeakPolarHBondContact O-CA 3.34Å; R170-R173 PolarHBondContact O-N 2.83Å; F171-R173 PolarHBondContact O-N 3.01Å; F171-R173 VanDerWaalsContact O-N 3.12Å
174	S	97.1	Very high	93.7	Very high	20 Å²	20	71.4 Å²	71.4	14%	0.14	35%	0.35	C	S	.	.	S	Bend	trans	-71.5	146.8	-178.5	71.2	0	0	0	0	110.9	R170 F171 Q176 Y177 Q178	R170-S174 PolarHBondContact O-N 3.25Å; F171-S174 WeakPolarHBondContact O-CB 3.42Å; F171-S174 PolarHBondContact O-N 3.42Å; F171-S174 PolarHBondContact O-OG 3.24Å; S174-Q176 PolarHBondContact O-N 3.42Å; S174-Y177 PolarHBondContact O-N 2.94Å; S174-Y177 PolarHBondContact OG-N 2.87Å; S174-Q178 WeakPolarHBondContact O-CG 3.32Å; S174-Q178 PolarHBondContact O-N 3.01Å
175	D	95.3	Very high	93.4	Very high	129 Å²	129	71 Å²	71	69%	0.69	35%	0.349	S	S	*	.	H	α-helix	trans	-54.2	-40	176.1	-61.9	-26.4	0	0	0	111.1	Y177 Q178 E179	D175-Y177 VanDerWaalsContact C-N 3.28Å; D175-Y177 PolarHBondContact O-N 3.42Å; D175-Q178 PolarHBondContact O-N 2.69Å; D175-Q178 VanDerWaalsContact O-N 3.16Å; D175-E179 WeakPolarHBondContact O-CB 3.48Å; D175-E179 VanDerWaalsContact O-CG 3.32Å; D175-E179 WeakPolarHBondContact O-CG 3.45Å; D175-E179 PolarHBondContact O-N 2.9Å
176	Q	92.7	Very high	93.3	Very high	71 Å²	71	64.3 Å²	64.3	33%	0.332	32%	0.322	S	S	.	.	H	α-helix	trans	-54.5	-40.5	177.4	-173.4	-174.1	-0.3	0	0	113.1	A78 S174	A78-Q176 PolarHBondContact O-NE2 3.32Å; S174-Q176 PolarHBondContact O-N 3.42Å
177	Y	95.9	Very high	93.1	Very high	5 Å²	5	63.2 Å²	63.2	2%	0.02	32%	0.315	C	S	.	.	H	α-helix	trans	-80.8	-40.7	176.9	176.1	-106.4	0	0	0	111.9	A59 W62 F171 L172 S174 D175 E179 L180 L181	A59-Y177 WeakPolarHBondContact O-CE2 3.23Å; A59-Y177 PolarHBondContact O-OH 3.34Å; W62-Y177 HydrophobicContact CB-CE2 4.1Å; W62-Y177 HydrophobicContact CD2-CE2 4.42Å; W62-Y177 AromaticContact CE3-CD2 3.98Å; W62-Y177 HydrophobicContact CE3-CD2 3.98Å; W62-Y177 AromaticContact CE3-CE2 3.71Å; W62-Y177 HydrophobicContact CE3-CE2 3.71Å; W62-Y177 HydrophobicContact CZ3-CD2 4.44Å; F171-Y177 AromaticContact CE1-CD2 3.94Å; F171-Y177 HydrophobicContact CE1-CD2 3.94Å; F171-Y177 HydrophobicContact CE1-CG 4.35Å; F171-Y177 HydrophobicContact CZ-CD2 4.04Å; F171-Y177 HydrophobicContact CZ-CG 4.46Å; F171-Y177 VanDerWaalsContact O-CB 3.3Å; F171-Y177 WeakPolarHBondContact O-CB 3.25Å; L172-Y177 HydrophobicContact CB-CD1 4.32Å; L172-Y177 HydrophobicContact CB-CE1 4.32Å; L172-Y177 HydrophobicContact CD2-CD1 4.01Å; L172-Y177 HydrophobicContact CD2-CD2 4.47Å; L172-Y177 HydrophobicContact CD2-CE1 3.54Å; L172-Y177 HydrophobicContact CD2-CE2 4.11Å; L172-Y177 HydrophobicContact CD2-CG 4.42Å; L172-Y177 VanDerWaalsContact O-CD1 3.23Å; L172-Y177 WeakPolarHBondContact O-CD1 3.41Å; S174-Y177 PolarHBondContact O-N 2.94Å; S174-Y177 PolarHBondContact OG-N 2.87Å; D175-Y177 VanDerWaalsContact C-N 3.28Å; D175-Y177 PolarHBondContact O-N 3.42Å; Y177-E179 VanDerWaalsContact C-N 3.27Å; Y177-E179 PolarHBondContact O-N 3.34Å; Y177-L180 HydrophobicContact CD2-CD1 4.33Å; Y177-L180 VanDerWaalsContact O-CB 3.31Å; Y177-L180 WeakPolarHBondContact O-CB 3.25Å; Y177-L180 PolarHBondContact O-N 3.41Å; Y177-L181 HydrophobicContact CD1-CD1 4.4Å; Y177-L181 HydrophobicContact CE1-CD1 3.85Å; Y177-L181 HydrophobicContact CE1-CD2 4.48Å; Y177-L181 HydrophobicContact CE1-CG 4.36Å
178	Q	96.4	Very high	92.9	Very high	85 Å²	85	66.9 Å²	66.9	40%	0.397	33%	0.334	S	S	.	.	H	α-helix	trans	-60.8	-36.8	-179.5	-66.8	-61	-46.9	0	0	112.1	L172 S174 D175 L180 L181	L172-Q178 PolarHBondContact O-NE2 3.03Å; S174-Q178 WeakPolarHBondContact O-CG 3.32Å; S174-Q178 PolarHBondContact O-N 3.01Å; D175-Q178 PolarHBondContact O-N 2.69Å; D175-Q178 VanDerWaalsContact O-N 3.16Å; Q178-L180 PolarHBondContact O-N 3.1Å; Q178-L181 PolarHBondContact O-N 2.83Å
179	E	93.6	Very high	92.5	Very high	118 Å²	118	70.4 Å²	70.4	55%	0.551	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.5	174.7	-75.4	178.2	-173.3	0	0	114.3	D175 Y177 L181 N183	D175-E179 WeakPolarHBondContact O-CB 3.48Å; D175-E179 VanDerWaalsContact O-CG 3.32Å; D175-E179 WeakPolarHBondContact O-CG 3.45Å; D175-E179 PolarHBondContact O-N 2.9Å; Y177-E179 VanDerWaalsContact C-N 3.27Å; Y177-E179 PolarHBondContact O-N 3.34Å; E179-L181 VanDerWaalsContact C-N 3.34Å; E179-N183 PolarHBondContact O-ND2 3.41Å
180	L	92.7	Very high	92.2	Very high	6 Å²	6	73.7 Å²	73.7	3%	0.031	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-19.1	175.1	-57.1	179.2	0	0	0	112.6	K53 P56 A59 W62 Y74 Y177 Q178	K53-L180 HydrophobicContact CD-CD2 4.4Å; K53-L180 VanDerWaalsContact CE-CD2 3.42Å; K53-L180 HydrophobicContact CG-CD2 4.21Å; P56-L180 WeakPolarHBondContact CA-O 3.47Å; A59-L180 HydrophobicContact CB-CB 3.9Å; W62-L180 HydrophobicContact CE3-CD1 4.46Å; W62-L180 HydrophobicContact CH2-CD1 4.04Å; W62-L180 HydrophobicContact CZ3-CD1 3.55Å; Y74-L180 HydrophobicContact CE1-CD1 4.05Å; Y74-L180 HydrophobicContact CE1-CD2 3.84Å; Y177-L180 HydrophobicContact CD2-CD1 4.33Å; Y177-L180 VanDerWaalsContact O-CB 3.31Å; Y177-L180 WeakPolarHBondContact O-CB 3.25Å; Y177-L180 PolarHBondContact O-N 3.41Å; Q178-L180 PolarHBondContact O-N 3.1Å
181	L	92.6	Very high	91.7	Very high	53 Å²	53	72.6 Å²	72.6	28%	0.277	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-15.7	-174.9	-57.9	-177.6	0	0	0	113.5	A59 A60 Y177 Q178 E179	A59-L181 HydrophobicContact CB-CD2 3.99Å; A60-L181 HydrophobicContact CB-CD2 4.16Å; Y177-L181 HydrophobicContact CD1-CD1 4.4Å; Y177-L181 HydrophobicContact CE1-CD1 3.85Å; Y177-L181 HydrophobicContact CE1-CD2 4.48Å; Y177-L181 HydrophobicContact CE1-CG 4.36Å; Q178-L181 PolarHBondContact O-N 2.83Å; E179-L181 VanDerWaalsContact C-N 3.34Å
182	V	85.8	Confident	91.2	Very high	110 Å²	110	78.7 Å²	78.7	67%	0.667	39%	0.391	S	S	*	.			trans	-109.8	-4.5	-171.2	-67.6	0	0	0	0	114.3
183	N	57.2	Low	90.6	Very high	146 Å²	146	82.9 Å²	82.9	78%	0.781	41%	0.411	S	S	*	.			trans	-123.1	0	-174.1	-70.1	-58	0	0	0	112.9	P56 E179	P56-N183 WeakPolarHBondContact CG-O 3.41Å; E179-N183 PolarHBondContact O-ND2 3.41Å

Retrieved 183 of 183 residues in 59.7 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).