A0A087XZ45_POEFO Loading...

F-box protein 48

AlphaFold DB , UniProt , Accession A0A087XZ45, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 153 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.7	Very low	38	Very low	221 Å²	221	132.6 Å²	132.6	100%	1.089	80%	0.795	S	S	*	*				0	106.4	0	-86.1	-85.7	-172.7	0	0	107.9
2	Q	33.5	Very low	38.4	Very low	161 Å²	161	136.6 Å²	136.6	75%	0.752	79%	0.794	S	S	*	*			trans	66.7	110.6	144.1	-56.6	-179.2	14.1	0	0	118.1
3	H	31.2	Very low	38.7	Very low	170 Å²	170	139 Å²	139	79%	0.787	80%	0.801	S	S	*	*				76.8	141.7	101.3	-99.9	-104.7	0	0	0	113
4	E	33.2	Very low	39	Very low	155 Å²	155	139.9 Å²	139.9	72%	0.724	80%	0.8	S	S	*	*			cis	-179.6	172.8	-17.7	-160.3	-173.6	124.8	0	0	105.2
5	S	36.7	Very low	38.8	Very low	106 Å²	106	139.1 Å²	139.1	74%	0.741	80%	0.804	S	S	*	*			trans	104.7	97	159.3	-140.3	0	0	0	0	114.8
6	A	39	Very low	39	Very low	98 Å²	98	141.8 Å²	141.8	81%	0.81	81%	0.808	S	S	*	*				62.9	123.3	61.3	0	0	0	0	0	112.8
7	G	37.6	Very low	39.2	Very low	75 Å²	75	146.7 Å²	146.7	77%	0.773	81%	0.81	S	S	*	*			cis	-172.8	-152	6.2	0	0	0	0	0	108
8	P	45.3	Very low	39.2	Very low	130 Å²	130	149.6 Å²	149.6	84%	0.844	82%	0.817	S	S	*	*			cis	-119.5	154.6	-10.7	37.2	-21.5	0	0	0	114
9	S	41	Very low	39.5	Very low	106 Å²	106	146.4 Å²	146.4	74%	0.741	81%	0.812	S	S	*	*			trans	-83.4	148.5	170.3	-158.7	0	0	0	0	110.3	V11	S9-V11 PolarHBondContact O-N 3.13Å
10	P	43.2	Very low	39.3	Very low	102 Å²	102	142.5 Å²	142.5	66%	0.662	81%	0.806	S	S	*	*			trans	-70.8	128.3	-178.8	27.2	-31.2	0	0	0	111	F12	P10-F12 PolarHBondContact O-N 3.43Å; P10-F12 VanDerWaalsContact O-N 3.13Å
11	V	40.3	Very low	39.6	Very low	135 Å²	135	144.3 Å²	144.3	82%	0.818	81%	0.813	S	S	*	*			trans	-71	107.1	173	-179.7	0	0	0	0	108.3	S9 L13	S9-V11 PolarHBondContact O-N 3.13Å; V11-L13 PolarHBondContact O-N 3.44Å
12	F	43.4	Very low	39.5	Very low	180 Å²	180	140.1 Å²	140.1	79%	0.789	80%	0.8	S	S	*	*			trans	-62.1	117.8	161.6	-87.2	-101.9	0	0	0	109.2	P10	P10-F12 PolarHBondContact O-N 3.43Å; P10-F12 VanDerWaalsContact O-N 3.13Å
13	L	42.1	Very low	39.9	Very low	168 Å²	168	136.7 Å²	136.7	88%	0.88	79%	0.794	S	S	*	*			trans	-94	100	159.8	-91.4	161.8	0	0	0	108.1	V11 C15	V11-L13 PolarHBondContact O-N 3.44Å; L13-C15 PolarHBondContact O-N 3.39Å
14	L	43.4	Very low	40.5	Very low	151 Å²	151	137.3 Å²	137.3	79%	0.791	80%	0.802	S	S	*	*			trans	-65.3	117.7	166.7	-78	154.1	0	0	0	108.9
15	C	35	Very low	41.2	Very low	128 Å²	128	137.4 Å²	137.4	87%	0.865	80%	0.803	S	S	*	*			trans	-102.6	103.1	160.3	-167.3	0	0	0	0	106.9	L13	L13-C15 PolarHBondContact O-N 3.39Å
16	E	42.8	Very low	41.6	Very low	183 Å²	183	136.7 Å²	136.7	86%	0.855	80%	0.803	S	S	*	*			trans	-71	142.9	176.6	-76.5	-159.3	119.6	0	0	111.8
17	R	42	Very low	42	Very low	225 Å²	225	138.4 Å²	138.4	85%	0.849	81%	0.808	S	S	*	*			trans	-77.9	131.6	-169	178.3	-179.7	-175.7	173.2	0.6	111.4
18	Q	38.8	Very low	43.1	Very low	199 Å²	199	137.2 Å²	137.2	93%	0.93	80%	0.795	S	S	*	*			trans	-119.3	111.4	149.9	-129.5	161.8	14.7	0	0	109.1	G20	Q18-G20 PolarHBondContact O-N 3.38Å
19	A	44.6	Very low	44.3	Very low	89 Å²	89	136.7 Å²	136.7	74%	0.736	80%	0.795	S	S	*	*			trans	-76.6	110.4	179.4	0	0	0	0	0	109.5
20	G	35.9	Very low	46.3	Very low	67 Å²	67	139.7 Å²	139.7	69%	0.691	80%	0.797	S	S	*	*			trans	-124.4	114.9	159.3	0	0	0	0	0	108.1	Q18 T22	Q18-G20 PolarHBondContact O-N 3.38Å; G20-T22 PolarHBondContact O-N 3.14Å; G20-T22 VanDerWaalsContact O-N 3.14Å
21	L	45.8	Very low	48.6	Very low	181 Å²	181	136.1 Å²	136.1	95%	0.948	77%	0.772	S	S	*	*			trans	-57.6	107.7	171.2	-90.9	148.3	0	0	0	110.3
22	T	35.5	Very low	51.1	Low	133 Å²	133	132.1 Å²	132.1	82%	0.816	74%	0.744	S	S	*	*			trans	-156	115.5	145.7	42.4	0	0	0	0	108.4	G20	G20-T22 PolarHBondContact O-N 3.14Å; G20-T22 VanDerWaalsContact O-N 3.14Å
23	S	40.1	Very low	53.6	Low	90 Å²	90	124 Å²	124	63%	0.629	71%	0.711	S	S	*	*			trans	48.4	111.2	154.5	-154.6	0	0	0	0	116.4	E25	S23-E25 PolarHBondContact O-N 2.71Å; S23-E25 VanDerWaalsContact OG-CG 3.27Å; S23-E25 WeakPolarHBondContact OG-CG 3.27Å; S23-E25 PolarHBondContact OG-N 2.99Å
24	L	44.4	Very low	56	Low	183 Å²	183	122.7 Å²	122.7	96%	0.958	70%	0.7	S	S	*	*			trans	-62.8	68	147	-151.4	92.9	0	0	0	106.5	A26	L24-A26 PolarHBondContact O-N 2.59Å
25	E	47.2	Very low	58.4	Low	156 Å²	156	119.8 Å²	119.8	73%	0.729	69%	0.689	S	S	*	*			trans	-54.9	127.4	166.7	-65.9	-159.9	154.2	0	0	104.2	S23 C27	S23-E25 PolarHBondContact O-N 2.71Å; S23-E25 VanDerWaalsContact OG-CG 3.27Å; S23-E25 WeakPolarHBondContact OG-CG 3.27Å; S23-E25 PolarHBondContact OG-N 2.99Å; E25-C27 PolarHBondContact O-N 3.37Å
26	A	46.8	Very low	61.3	Low	91 Å²	91	117 Å²	117	75%	0.752	66%	0.664	S	S	*	*			trans	-36.7	121.4	172.7	0	0	0	0	0	107.3	L24 G28	L24-A26 PolarHBondContact O-N 2.59Å; A26-G28 PolarHBondContact O-N 3.18Å
27	C	47	Very low	63.8	Low	134 Å²	134	111.9 Å²	111.9	91%	0.905	65%	0.648	S	S	*	*			trans	-63.8	77.8	174.1	-174.7	0	0	0	0	106.1	E25 S29	E25-C27 PolarHBondContact O-N 3.37Å; C27-S29 PolarHBondContact O-N 2.78Å
28	G	61.1	Low	66.3	Low	50 Å²	50	105.4 Å²	105.4	52%	0.515	63%	0.628	S	S	.	*			trans	-61.5	121.6	176.7	0	0	0	0	0	103.8	A26 Q30	A26-G28 PolarHBondContact O-N 3.18Å; G28-Q30 PolarHBondContact O-N 3.19Å
29	S	70.7	Confident	69	Low	119 Å²	119	101.9 Å²	101.9	83%	0.832	61%	0.612	S	S	*	*			trans	-48.8	104.8	174.4	54.7	0	0	0	0	107.8	C27 N31	C27-S29 PolarHBondContact O-N 2.78Å; S29-N31 PolarHBondContact O-N 2.91Å
30	Q	82.6	Confident	71.5	Confident	169 Å²	169	101.5 Å²	101.5	79%	0.79	60%	0.596	S	S	*	*			trans	-63	130.6	-177.7	-83.3	-178	-43.5	0	0	108	G28 F32	G28-Q30 PolarHBondContact O-N 3.19Å; Q30-F32 PolarHBondContact O-N 3.1Å; Q30-F32 VanDerWaalsContact O-N 3.1Å
31	N	90.4	Very high	74.4	Confident	27 Å²	27	98.3 Å²	98.3	14%	0.144	56%	0.563	C	S	.	*			trans	-65.6	111.7	176	175.3	5.6	0	0	0	108.7	S29 A33 E34 W63	S29-N31 PolarHBondContact O-N 2.91Å; N31-A33 PolarHBondContact O-N 3.14Å; N31-A33 WeakPolarHBondContact OD1-CB 3.46Å; N31-A33 PolarHBondContact OD1-N 3.06Å; N31-E34 HydrophobicContact CB-CG 4.13Å; N31-E34 WeakPolarHBondContact CB-OE1 3.43Å; N31-E34 PolarHBondContact ND2-OE1 3.29Å; N31-E34 WeakPolarHBondContact O-CB 3.48Å; N31-E34 PolarHBondContact O-N 3.19Å; N31-W63 PolarHBondContact OD1-NE1 3.02Å
32	F	94.3	Very high	76.8	Confident	51 Å²	51	90.4 Å²	90.4	22%	0.224	52%	0.522	C	S	.	.	H	α-helix	trans	-57	-28.7	-178.1	73.7	-100.7	0	0	0	112.8	Q30 E34 T35 L36 I44 F45 W63	Q30-F32 PolarHBondContact O-N 3.1Å; Q30-F32 VanDerWaalsContact O-N 3.1Å; F32-E34 PolarHBondContact O-N 3.01Å; F32-T35 PolarHBondContact O-N 3.2Å; F32-T35 PolarHBondContact O-OG1 3.48Å; F32-T35 VanDerWaalsContact O-OG1 3.14Å; F32-L36 HydrophobicContact CB-CD1 4.25Å; F32-L36 HydrophobicContact CD2-CD1 3.95Å; F32-L36 WeakPolarHBondContact O-CB 3.37Å; F32-L36 WeakPolarHBondContact O-CG 3.44Å; F32-L36 PolarHBondContact O-N 2.96Å; F32-I44 HydrophobicContact CD2-CD1 3.86Å; F32-I44 HydrophobicContact CE2-CB 4.41Å; F32-I44 HydrophobicContact CE2-CD1 3.79Å; F32-I44 HydrophobicContact CE2-CG2 4.34Å; F32-I44 HydrophobicContact CZ-CD1 4.44Å; F32-I44 HydrophobicContact CZ-CG2 4.01Å; F32-F45 HydrophobicContact CE2-CE2 4.5Å; F32-F45 HydrophobicContact CE2-CZ 4.33Å; F32-F45 AromaticContact CZ-CE1 3.97Å; F32-F45 HydrophobicContact CZ-CE1 3.97Å; F32-F45 HydrophobicContact CZ-CE2 4.26Å; F32-F45 AromaticContact CZ-CZ 3.69Å; F32-F45 HydrophobicContact CZ-CZ 3.69Å; F32-W63 AromaticContact CD1-CZ2 3.83Å; F32-W63 HydrophobicContact CD1-CZ2 3.83Å; F32-W63 AromaticContact CE1-CE2 3.88Å; F32-W63 AromaticContact CE1-CH2 3.7Å; F32-W63 HydrophobicContact CE1-CH2 3.7Å; F32-W63 AromaticContact CE1-CZ2 3.23Å; F32-W63 HydrophobicContact CE1-CZ2 3.23Å; F32-W63 HydrophobicContact CZ-CH2 4.45Å; F32-W63 AromaticContact CZ-CZ2 3.96Å; F32-W63 HydrophobicContact CZ-CZ2 3.96Å
33	A	94.3	Very high	79.7	Confident	10 Å²	10	91.4 Å²	91.4	8%	0.083	51%	0.51	C	S	.	.	H	α-helix	trans	-71	-15.1	-177.6	0	0	0	0	0	112.7	N31 L62 I66	N31-A33 PolarHBondContact O-N 3.14Å; N31-A33 WeakPolarHBondContact OD1-CB 3.46Å; N31-A33 PolarHBondContact OD1-N 3.06Å; A33-L62 HydrophobicContact CB-CD2 3.82Å; A33-L62 HydrophobicContact CB-CG 4.24Å; A33-I66 HydrophobicContact CB-CD1 3.83Å
34	E	94.1	Very high	82.4	Confident	140 Å²	140	90.5 Å²	90.5	65%	0.654	50%	0.498	S	S	*	.	H	α-helix	trans	-86.7	-20.8	175.4	-67.9	165.8	-157.9	0	0	112.2	N31 F32 L62	N31-E34 HydrophobicContact CB-CG 4.13Å; N31-E34 WeakPolarHBondContact CB-OE1 3.43Å; N31-E34 PolarHBondContact ND2-OE1 3.29Å; N31-E34 WeakPolarHBondContact O-CB 3.48Å; N31-E34 PolarHBondContact O-N 3.19Å; F32-E34 PolarHBondContact O-N 3.01Å; E34-L62 HydrophobicContact CG-CD2 3.57Å
35	T	93.5	Very high	84.9	Confident	91 Å²	91	81.9 Å²	81.9	56%	0.558	45%	0.453	S	S	*	.	H	α-helix	trans	-106.8	-32.4	-175.7	57.1	0	0	0	0	112.9	F32	F32-T35 PolarHBondContact O-N 3.2Å; F32-T35 PolarHBondContact O-OG1 3.48Å; F32-T35 VanDerWaalsContact O-OG1 3.14Å
36	L	95.2	Very high	87.2	Confident	68 Å²	68	77.8 Å²	77.8	36%	0.356	43%	0.431	S	S	.	.	S	Bend	trans	-85.5	147.8	179.9	-64.2	-177.4	0	0	0	111.9	F32 M40 I44	F32-L36 HydrophobicContact CB-CD1 4.25Å; F32-L36 HydrophobicContact CD2-CD1 3.95Å; F32-L36 WeakPolarHBondContact O-CB 3.37Å; F32-L36 WeakPolarHBondContact O-CG 3.44Å; F32-L36 PolarHBondContact O-N 2.96Å; L36-M40 HydrophobicContact CB-CB 4.25Å; L36-M40 HydrophobicContact CD1-CB 4.48Å; L36-I44 HydrophobicContact CD1-CD1 3.67Å
37	P	95.6	Very high	89.5	Confident	77 Å²	77	81.1 Å²	81.1	50%	0.5	43%	0.431	S	S	.	.			trans	-53.5	147.6	166.2	-24.9	34.3	0	0	0	111.9	E39 M40 S41	P37-E39 PolarHBondContact O-N 3.3Å; P37-M40 WeakPolarHBondContact O-CB 3.45Å; P37-M40 PolarHBondContact O-N 3.26Å; P37-S41 PolarHBondContact O-N 2.97Å
38	M	94.4	Very high	91.8	Very high	88 Å²	88	77.4 Å²	77.4	43%	0.433	40%	0.402	S	S	.	.	H	α-helix	trans	-53	-42	-177.1	175.2	55.5	175.9	0	0	112.5	M40 S41 V42 I66	M38-M40 VanDerWaalsContact C-N 3.25Å; M38-M40 PolarHBondContact O-N 2.73Å; M38-S41 WeakPolarHBondContact O-CB 3.39Å; M38-S41 PolarHBondContact O-N 3.18Å; M38-V42 HydrophobicContact CE-CG2 3.73Å; M38-V42 WeakPolarHBondContact O-CG2 3.4Å; M38-V42 PolarHBondContact O-N 3.18Å; M38-V42 HydrophobicContact SD-CG2 4.13Å; M38-I66 HydrophobicContact CE-CB 4.07Å; M38-I66 HydrophobicContact CE-CG1 3.95Å; M38-I66 HydrophobicContact CE-CG2 3.75Å; M38-I66 HydrophobicContact SD-CB 4.2Å; M38-I66 HydrophobicContact SD-CD1 4.02Å; M38-I66 HydrophobicContact SD-CG1 3.6Å; M38-I66 HydrophobicContact SD-CG2 3.82Å
39	E	95.5	Very high	93.4	Very high	126 Å²	126	78.7 Å²	78.7	59%	0.589	40%	0.397	S	S	*	.	H	α-helix	trans	-61.4	-35.9	-179.6	-62.4	71	-155.3	0	0	111.8	P37 R43	P37-E39 PolarHBondContact O-N 3.3Å; E39-R43 WeakPolarHBondContact O-CG 3.47Å; E39-R43 PolarHBondContact O-N 3.02Å
40	M	96.7	Very high	94.4	Very high	81 Å²	81	73.3 Å²	73.3	40%	0.399	36%	0.359	S	S	.	.	H	α-helix	trans	-72.9	-40	177.8	-66.7	-58.5	-67.7	0	0	111	L36 P37 M38 V42 R43 I44	L36-M40 HydrophobicContact CB-CB 4.25Å; L36-M40 HydrophobicContact CD1-CB 4.48Å; P37-M40 WeakPolarHBondContact O-CB 3.45Å; P37-M40 PolarHBondContact O-N 3.26Å; M38-M40 VanDerWaalsContact C-N 3.25Å; M38-M40 PolarHBondContact O-N 2.73Å; M40-V42 VanDerWaalsContact C-N 3.35Å; M40-V42 PolarHBondContact O-N 3.06Å; M40-R43 WeakPolarHBondContact O-CB 3.32Å; M40-R43 PolarHBondContact O-N 2.88Å; M40-I44 WeakPolarHBondContact O-CG1 3.27Å; M40-I44 PolarHBondContact O-N 3.24Å
41	S	96.6	Very high	94.9	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-60.3	-44.5	173.1	-63.1	0	0	0	0	111.6	P37 M38 R43 I44 F45	P37-S41 PolarHBondContact O-N 2.97Å; M38-S41 WeakPolarHBondContact O-CB 3.39Å; M38-S41 PolarHBondContact O-N 3.18Å; S41-R43 VanDerWaalsContact C-N 3.34Å; S41-R43 PolarHBondContact O-N 3.45Å; S41-I44 PolarHBondContact O-N 3.17Å; S41-F45 WeakPolarHBondContact O-CD2 3.38Å; S41-F45 PolarHBondContact O-N 3.47Å
42	V	96.4	Very high	95.2	Very high	15 Å²	15	69.2 Å²	69.2	9%	0.091	34%	0.344	C	S	.	.	H	α-helix	trans	-62.6	-39.6	175	173.5	0	0	0	0	111.6	M38 M40 F45 R46 I66 L73	M38-V42 HydrophobicContact CE-CG2 3.73Å; M38-V42 WeakPolarHBondContact O-CG2 3.4Å; M38-V42 PolarHBondContact O-N 3.18Å; M38-V42 HydrophobicContact SD-CG2 4.13Å; M40-V42 VanDerWaalsContact C-N 3.35Å; M40-V42 PolarHBondContact O-N 3.06Å; V42-F45 PolarHBondContact O-N 3.15Å; V42-R46 WeakPolarHBondContact O-CB 3.27Å; V42-R46 PolarHBondContact O-N 3.3Å; V42-I66 HydrophobicContact CG2-CG2 3.94Å; V42-L73 HydrophobicContact CG1-CD2 4.27Å; V42-L73 HydrophobicContact CG1-CG 4.23Å
43	R	96.3	Very high	95.2	Very high	153 Å²	153	66.8 Å²	66.8	58%	0.577	33%	0.333	S	S	*	.	H	α-helix	trans	-62.1	-42	174.8	-76.9	175.1	-177.2	-170.1	0.9	112.1	E39 M40 S41 R46	E39-R43 WeakPolarHBondContact O-CG 3.47Å; E39-R43 PolarHBondContact O-N 3.02Å; M40-R43 WeakPolarHBondContact O-CB 3.32Å; M40-R43 PolarHBondContact O-N 2.88Å; S41-R43 VanDerWaalsContact C-N 3.34Å; S41-R43 PolarHBondContact O-N 3.45Å; R43-R46 VanDerWaalsContact O-CB 3.27Å; R43-R46 WeakPolarHBondContact O-CB 3.44Å; R43-R46 PolarHBondContact O-N 2.93Å
44	I	96.9	Very high	95.2	Very high	72 Å²	72	68.6 Å²	68.6	37%	0.369	35%	0.345	S	S	.	.	H	α-helix	trans	-62.3	-48.2	176.4	-67.4	163.7	0	0	0	110.4	F32 L36 M40 S41 R46 E47	F32-I44 HydrophobicContact CD2-CD1 3.86Å; F32-I44 HydrophobicContact CE2-CB 4.41Å; F32-I44 HydrophobicContact CE2-CD1 3.79Å; F32-I44 HydrophobicContact CE2-CG2 4.34Å; F32-I44 HydrophobicContact CZ-CD1 4.44Å; F32-I44 HydrophobicContact CZ-CG2 4.01Å; L36-I44 HydrophobicContact CD1-CD1 3.67Å; M40-I44 WeakPolarHBondContact O-CG1 3.27Å; M40-I44 PolarHBondContact O-N 3.24Å; S41-I44 PolarHBondContact O-N 3.17Å; I44-R46 PolarHBondContact O-N 3.23Å; I44-E47 PolarHBondContact O-N 3.22Å
45	F	97.3	Very high	95.3	Very high	1 Å²	1	69.1 Å²	69.1	0%	0.004	34%	0.341	C	S	.	.	H	α-helix	trans	-64.2	-24.6	178.6	-68.4	-51.6	0	0	0	113.2	F32 S41 V42 E47 L48 L53 A56 W63 I66 I67 L73	F32-F45 HydrophobicContact CE2-CE2 4.5Å; F32-F45 HydrophobicContact CE2-CZ 4.33Å; F32-F45 AromaticContact CZ-CE1 3.97Å; F32-F45 HydrophobicContact CZ-CE1 3.97Å; F32-F45 HydrophobicContact CZ-CE2 4.26Å; F32-F45 AromaticContact CZ-CZ 3.69Å; F32-F45 HydrophobicContact CZ-CZ 3.69Å; S41-F45 WeakPolarHBondContact O-CD2 3.38Å; S41-F45 PolarHBondContact O-N 3.47Å; V42-F45 PolarHBondContact O-N 3.15Å; F45-E47 PolarHBondContact O-N 2.99Å; F45-L48 HydrophobicContact CD1-CD1 3.93Å; F45-L48 WeakPolarHBondContact O-CB 3.07Å; F45-L48 PolarHBondContact O-N 3.4Å; F45-L48 VanDerWaalsContact O-N 3.15Å; F45-L53 HydrophobicContact CB-CD2 3.97Å; F45-L53 WeakPolarHBondContact O-CD2 3.23Å; F45-A56 HydrophobicContact CD1-CB 4.47Å; F45-A56 HydrophobicContact CE1-CB 4.2Å; F45-W63 AromaticContact CE1-CD2 3.95Å; F45-W63 HydrophobicContact CE1-CD2 3.95Å; F45-W63 AromaticContact CE1-CE3 3.67Å; F45-W63 HydrophobicContact CE1-CE3 3.67Å; F45-W63 HydrophobicContact CE1-CG 4.46Å; F45-W63 HydrophobicContact CE1-CZ3 4.05Å; F45-W63 HydrophobicContact CZ-CB 4.17Å; F45-W63 AromaticContact CZ-CD2 3.6Å; F45-W63 HydrophobicContact CZ-CD2 3.6Å; F45-W63 AromaticContact CZ-CE3 3.83Å; F45-W63 HydrophobicContact CZ-CE3 3.83Å; F45-W63 AromaticContact CZ-CG 3.73Å; F45-W63 HydrophobicContact CZ-CG 3.73Å; F45-I66 HydrophobicContact CD2-CG2 3.64Å; F45-I66 HydrophobicContact CE2-CB 4.16Å; F45-I66 HydrophobicContact CE2-CG2 3.62Å; F45-I67 HydrophobicContact CB-CG1 4.4Å; F45-I67 HydrophobicContact CD1-CD1 3.86Å; F45-I67 HydrophobicContact CD1-CG1 4.05Å; F45-I67 HydrophobicContact CD2-CD1 4.43Å; F45-I67 HydrophobicContact CD2-CG1 3.84Å; F45-I67 HydrophobicContact CE1-CD1 3.82Å; F45-I67 HydrophobicContact CE1-CG1 4.28Å; F45-I67 HydrophobicContact CE2-CD1 4.38Å; F45-I67 HydrophobicContact CE2-CG1 4.08Å; F45-I67 HydrophobicContact CG-CD1 4.19Å; F45-I67 HydrophobicContact CG-CG1 3.84Å; F45-I67 HydrophobicContact CZ-CD1 4.09Å; F45-I67 HydrophobicContact CZ-CG1 4.29Å; F45-L73 HydrophobicContact CB-CD1 3.84Å; F45-L73 HydrophobicContact CB-CD2 4.35Å
46	R	95.3	Very high	95.5	Very high	71 Å²	71	65.1 Å²	65.1	27%	0.268	32%	0.317	S	S	.	.	H	α-helix	trans	-64.3	-25.9	177.8	-167.6	172.2	-69.4	179.4	-3.2	113.9	V42 R43 I44 L48 L73 Q76	V42-R46 WeakPolarHBondContact O-CB 3.27Å; V42-R46 PolarHBondContact O-N 3.3Å; R43-R46 VanDerWaalsContact O-CB 3.27Å; R43-R46 WeakPolarHBondContact O-CB 3.44Å; R43-R46 PolarHBondContact O-N 2.93Å; I44-R46 PolarHBondContact O-N 3.23Å; R46-L48 PolarHBondContact O-N 3.01Å; R46-L73 VanDerWaalsContact CA-CD2 3.42Å; R46-L73 HydrophobicContact CB-CD2 3.72Å; R46-L73 HydrophobicContact CG-CD2 4.19Å; R46-Q76 PolarHBondContact O-NE2 2.68Å
47	E	96	Very high	95.5	Very high	160 Å²	160	62.6 Å²	62.6	75%	0.748	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-10	178.2	-58	-54.7	132.7	0	0	112.8	I44 F45	I44-E47 PolarHBondContact O-N 3.22Å; F45-E47 PolarHBondContact O-N 2.99Å
48	L	95.6	Very high	95.6	Very high	57 Å²	57	68.2 Å²	68.2	30%	0.298	32%	0.316	S	S	.	.	S	Bend	trans	-85.3	145.7	179.7	-60.7	-176.3	0	0	0	111.7	F45 R46 L53 A56 Q77	F45-L48 HydrophobicContact CD1-CD1 3.93Å; F45-L48 WeakPolarHBondContact O-CB 3.07Å; F45-L48 PolarHBondContact O-N 3.4Å; F45-L48 VanDerWaalsContact O-N 3.15Å; R46-L48 PolarHBondContact O-N 3.01Å; L48-L53 HydrophobicContact CB-CD2 4.11Å; L48-L53 HydrophobicContact CB-CG 3.87Å; L48-L53 HydrophobicContact CD1-CD2 4.34Å; L48-A56 HydrophobicContact CD1-CB 4.11Å; L48-Q77 PolarHBondContact O-NE2 3.25Å
49	D	93.3	Very high	95.7	Very high	77 Å²	77	68.1 Å²	68.1	41%	0.412	32%	0.32	S	S	.	.			trans	-73.4	164.7	168.2	76.5	-39.3	0	0	0	111.3	E51 S52 L53	D49-E51 PolarHBondContact O-N 2.99Å; D49-E51 VanDerWaalsContact O-N 3.16Å; D49-S52 PolarHBondContact O-N 2.89Å; D49-S52 VanDerWaalsContact O-N 3.14Å; D49-S52 WeakPolarHBondContact OD1-CB 3.49Å; D49-S52 PolarHBondContact OD1-N 3.27Å; D49-S52 PolarHBondContact OD1-OG 3.37Å; D49-L53 WeakPolarHBondContact O-CG 3.41Å; D49-L53 PolarHBondContact O-N 2.98Å
50	A	92.4	Very high	95.7	Very high	6 Å²	6	64.1 Å²	64.1	5%	0.05	31%	0.306	C	S	.	.	H	α-helix	trans	-55.3	-35.5	-178.2	0	0	0	0	0	113.4	C54 L103 Y107	A50-C54 PolarHBondContact O-N 2.65Å; A50-C54 VanDerWaalsContact O-N 3.1Å; A50-C54 PolarHBondContact O-SG 3.05Å; A50-L103 HydrophobicContact CB-CD2 4.18Å; A50-Y107 HydrophobicContact CB-CD2 4.17Å; A50-Y107 HydrophobicContact CB-CE2 3.65Å
51	E	93	Very high	95.7	Very high	67 Å²	67	69 Å²	69	31%	0.313	33%	0.325	S	S	.	.	H	α-helix	trans	-71.3	-44.6	178	-170.5	169.1	163.2	0	0	111.7	D49 L53 C54 R55 R111	D49-E51 PolarHBondContact O-N 2.99Å; D49-E51 VanDerWaalsContact O-N 3.16Å; E51-L53 VanDerWaalsContact C-N 3.34Å; E51-L53 PolarHBondContact O-N 2.97Å; E51-C54 WeakPolarHBondContact O-CB 3.46Å; E51-C54 PolarHBondContact O-N 3.07Å; E51-R55 WeakPolarHBondContact O-CG 3.33Å; E51-R55 PolarHBondContact O-N 3.37Å; E51-R55 IonicContact OE1-CZ 2.68Å; E51-R55 IonicContact OE1-NE 2.68Å; E51-R55 IonicContact OE1-NH2 3.59Å; E51-R55 PolarHBondContact OE1-NH2 3.46Å; E51-R111 IonicContact OE2-NH1 3.47Å
52	S	95.9	Very high	95.7	Very high	42 Å²	42	71.9 Å²	71.9	29%	0.294	34%	0.34	S	S	.	.	H	α-helix	trans	-66.1	-35.2	175.8	-59.1	0	0	0	0	112.3	D49 R55 A56	D49-S52 PolarHBondContact O-N 2.89Å; D49-S52 VanDerWaalsContact O-N 3.14Å; D49-S52 WeakPolarHBondContact OD1-CB 3.49Å; D49-S52 PolarHBondContact OD1-N 3.27Å; D49-S52 PolarHBondContact OD1-OG 3.37Å; S52-R55 PolarHBondContact O-N 3.07Å; S52-A56 VanDerWaalsContact O-CB 3.27Å; S52-A56 WeakPolarHBondContact O-CB 2.96Å; S52-A56 PolarHBondContact O-N 3.41Å
53	L	95.4	Very high	95.7	Very high	0 Å²	0	73.7 Å²	73.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-60	-45.4	171.1	-79.1	171	0	0	0	111.9	F45 L48 D49 E51 R55 A56 S57 I67 Q77	F45-L53 HydrophobicContact CB-CD2 3.97Å; F45-L53 WeakPolarHBondContact O-CD2 3.23Å; L48-L53 HydrophobicContact CB-CD2 4.11Å; L48-L53 HydrophobicContact CB-CG 3.87Å; L48-L53 HydrophobicContact CD1-CD2 4.34Å; D49-L53 WeakPolarHBondContact O-CG 3.41Å; D49-L53 PolarHBondContact O-N 2.98Å; E51-L53 VanDerWaalsContact C-N 3.34Å; E51-L53 PolarHBondContact O-N 2.97Å; L53-R55 VanDerWaalsContact C-N 3.27Å; L53-R55 PolarHBondContact O-N 2.86Å; L53-A56 PolarHBondContact O-N 3.16Å; L53-S57 PolarHBondContact O-N 3.37Å; L53-I67 HydrophobicContact CD2-CD1 4.47Å; L53-I67 HydrophobicContact CD2-CG1 4.37Å; L53-I67 HydrophobicContact CD2-CG2 4.16Å; L53-Q77 HydrophobicContact CD1-CG 3.87Å
54	C	93.4	Very high	95.8	Very high	48 Å²	48	71.7 Å²	71.7	32%	0.324	34%	0.338	S	S	.	.	H	α-helix	trans	-62.3	-34.3	175.4	-69.3	0	0	0	0	112.6	A50 E51 S57 R58	A50-C54 PolarHBondContact O-N 2.65Å; A50-C54 VanDerWaalsContact O-N 3.1Å; A50-C54 PolarHBondContact O-SG 3.05Å; E51-C54 WeakPolarHBondContact O-CB 3.46Å; E51-C54 PolarHBondContact O-N 3.07Å; C54-S57 PolarHBondContact O-OG 2.56Å; C54-R58 WeakPolarHBondContact O-CD 3.37Å; C54-R58 WeakPolarHBondContact O-CG 3.44Å
55	R	96.6	Very high	95.8	Very high	152 Å²	152	70.6 Å²	70.6	57%	0.574	34%	0.337	S	S	*	.	H	α-helix	trans	-72.4	-43.8	174.5	-67.2	172.1	-175.3	-169.5	1.8	110.8	E51 S52 L53 S57 R58	E51-R55 WeakPolarHBondContact O-CG 3.33Å; E51-R55 PolarHBondContact O-N 3.37Å; E51-R55 IonicContact OE1-CZ 2.68Å; E51-R55 IonicContact OE1-NE 2.68Å; E51-R55 IonicContact OE1-NH2 3.59Å; E51-R55 PolarHBondContact OE1-NH2 3.46Å; S52-R55 PolarHBondContact O-N 3.07Å; L53-R55 VanDerWaalsContact C-N 3.27Å; L53-R55 PolarHBondContact O-N 2.86Å; R55-S57 PolarHBondContact O-N 3.4Å; R55-R58 WeakPolarHBondContact O-CB 3.41Å; R55-R58 PolarHBondContact O-N 3.49Å; R55-R58 VanDerWaalsContact O-N 3.14Å
56	A	97	Very high	95.7	Very high	7 Å²	7	70.9 Å²	70.9	6%	0.058	34%	0.338	C	S	.	.	H	α-helix	trans	-61	-42.9	178.8	0	0	0	0	0	112	F45 L48 S52 L53 R58 T59 W63 I67	F45-A56 HydrophobicContact CD1-CB 4.47Å; F45-A56 HydrophobicContact CE1-CB 4.2Å; L48-A56 HydrophobicContact CD1-CB 4.11Å; S52-A56 VanDerWaalsContact O-CB 3.27Å; S52-A56 WeakPolarHBondContact O-CB 2.96Å; S52-A56 PolarHBondContact O-N 3.41Å; L53-A56 PolarHBondContact O-N 3.16Å; A56-R58 PolarHBondContact O-N 3.14Å; A56-T59 WeakPolarHBondContact O-CB 3.44Å; A56-T59 WeakPolarHBondContact O-CG2 3.24Å; A56-T59 PolarHBondContact O-N 2.93Å; A56-T59 PolarHBondContact O-OG1 3.39Å; A56-W63 HydrophobicContact CB-CE3 3.87Å; A56-W63 HydrophobicContact CB-CZ3 4.1Å; A56-I67 HydrophobicContact CB-CD1 3.61Å
57	S	96.3	Very high	95.8	Very high	14 Å²	14	67.5 Å²	67.5	10%	0.098	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-11.3	177.9	71.7	0	0	0	0	114.1	L53 C54 R55 R64	L53-S57 PolarHBondContact O-N 3.37Å; C54-S57 PolarHBondContact O-OG 2.56Å; R55-S57 PolarHBondContact O-N 3.4Å; S57-R64 VanDerWaalsContact O-CB 3.29Å; S57-R64 WeakPolarHBondContact O-CB 3.49Å; S57-R64 PolarHBondContact O-NE 2.9Å
58	R	96.9	Very high	95.7	Very high	196 Å²	196	62 Å²	62	74%	0.74	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-7.5	177	-65.5	173.3	64.5	-162.8	-1.3	113.6	C54 R55 A56	C54-R58 WeakPolarHBondContact O-CD 3.37Å; C54-R58 WeakPolarHBondContact O-CG 3.44Å; R55-R58 WeakPolarHBondContact O-CB 3.41Å; R55-R58 PolarHBondContact O-N 3.49Å; R55-R58 VanDerWaalsContact O-N 3.14Å; A56-R58 PolarHBondContact O-N 3.14Å
59	T	96.3	Very high	95.7	Very high	85 Å²	85	65.5 Å²	65.5	52%	0.521	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-54	-175.9	58.7	0	0	0	0	112.5	A56 W63	A56-T59 WeakPolarHBondContact O-CB 3.44Å; A56-T59 WeakPolarHBondContact O-CG2 3.24Å; A56-T59 PolarHBondContact O-N 2.93Å; A56-T59 PolarHBondContact O-OG1 3.39Å; T59-W63 HydrophobicContact CG2-CE3 3.98Å; T59-W63 HydrophobicContact CG2-CZ3 4Å; T59-W63 VanDerWaalsContact OG1-CD2 3.25Å
60	C	95.5	Very high	95.7	Very high	43 Å²	43	62.6 Å²	62.6	29%	0.291	31%	0.306	S	S	.	.			trans	-149.8	168.8	178.2	77.4	0	0	0	0	111.8	L62 W63 R64	C60-L62 VanDerWaalsContact C-N 3.34Å; C60-L62 PolarHBondContact O-N 3.46Å; C60-W63 PolarHBondContact SG-N 2.78Å; C60-W63 VanDerWaalsContact SG-N 3.37Å; C60-R64 WeakPolarHBondContact O-CB 3.32Å; C60-R64 PolarHBondContact O-N 3.48Å; C60-R64 VanDerWaalsContact O-N 3.07Å
61	K	96.7	Very high	95.8	Very high	182 Å²	182	66.3 Å²	66.3	79%	0.791	32%	0.322	S	S	*	.	H	α-helix	trans	-63.6	-38.3	-178.8	-67.6	-178	-178.8	177.1	0	112.5	R64 S65	K61-R64 WeakPolarHBondContact O-CB 3.15Å; K61-R64 PolarHBondContact O-N 3.25Å; K61-S65 PolarHBondContact O-N 3.25Å; K61-S65 PolarHBondContact O-OG 3.38Å
62	L	96.3	Very high	95.8	Very high	61 Å²	61	69.1 Å²	69.1	32%	0.319	34%	0.335	S	S	.	.	H	α-helix	trans	-65.6	-47.6	179.4	179.3	61.5	0	0	0	111.4	A33 E34 C60 R64 S65 I66	A33-L62 HydrophobicContact CB-CD2 3.82Å; A33-L62 HydrophobicContact CB-CG 4.24Å; E34-L62 HydrophobicContact CG-CD2 3.57Å; C60-L62 VanDerWaalsContact C-N 3.34Å; C60-L62 PolarHBondContact O-N 3.46Å; L62-R64 VanDerWaalsContact C-N 3.26Å; L62-R64 PolarHBondContact O-N 3.02Å; L62-S65 PolarHBondContact O-N 2.98Å; L62-S65 PolarHBondContact O-OG 2.81Å; L62-I66 HydrophobicContact CD1-CD1 3.97Å; L62-I66 HydrophobicContact CD1-CG1 4.26Å; L62-I66 HydrophobicContact CG-CD1 3.91Å; L62-I66 VanDerWaalsContact O-CG1 3.23Å; L62-I66 WeakPolarHBondContact O-CG1 3.46Å; L62-I66 PolarHBondContact O-N 2.67Å
63	W	97.7	Very high	95.7	Very high	53 Å²	53	67.2 Å²	67.2	20%	0.201	32%	0.322	C	S	.	.	H	α-helix	trans	-62.4	-39.5	176.8	-74.4	26.3	0	0	0	111.2	N31 F32 F45 A56 T59 C60 I66 I67	N31-W63 PolarHBondContact OD1-NE1 3.02Å; F32-W63 AromaticContact CD1-CZ2 3.83Å; F32-W63 HydrophobicContact CD1-CZ2 3.83Å; F32-W63 AromaticContact CE1-CE2 3.88Å; F32-W63 AromaticContact CE1-CH2 3.7Å; F32-W63 HydrophobicContact CE1-CH2 3.7Å; F32-W63 AromaticContact CE1-CZ2 3.23Å; F32-W63 HydrophobicContact CE1-CZ2 3.23Å; F32-W63 HydrophobicContact CZ-CH2 4.45Å; F32-W63 AromaticContact CZ-CZ2 3.96Å; F32-W63 HydrophobicContact CZ-CZ2 3.96Å; F45-W63 AromaticContact CE1-CD2 3.95Å; F45-W63 HydrophobicContact CE1-CD2 3.95Å; F45-W63 AromaticContact CE1-CE3 3.67Å; F45-W63 HydrophobicContact CE1-CE3 3.67Å; F45-W63 HydrophobicContact CE1-CG 4.46Å; F45-W63 HydrophobicContact CE1-CZ3 4.05Å; F45-W63 HydrophobicContact CZ-CB 4.17Å; F45-W63 AromaticContact CZ-CD2 3.6Å; F45-W63 HydrophobicContact CZ-CD2 3.6Å; F45-W63 AromaticContact CZ-CE3 3.83Å; F45-W63 HydrophobicContact CZ-CE3 3.83Å; F45-W63 AromaticContact CZ-CG 3.73Å; F45-W63 HydrophobicContact CZ-CG 3.73Å; A56-W63 HydrophobicContact CB-CE3 3.87Å; A56-W63 HydrophobicContact CB-CZ3 4.1Å; T59-W63 HydrophobicContact CG2-CE3 3.98Å; T59-W63 HydrophobicContact CG2-CZ3 4Å; T59-W63 VanDerWaalsContact OG1-CD2 3.25Å; C60-W63 PolarHBondContact SG-N 2.78Å; C60-W63 VanDerWaalsContact SG-N 3.37Å; W63-I66 PolarHBondContact O-N 3.2Å; W63-I67 HydrophobicContact CB-CD1 4.45Å; W63-I67 WeakPolarHBondContact O-CB 3.38Å; W63-I67 WeakPolarHBondContact O-CD1 3.29Å; W63-I67 VanDerWaalsContact O-CG1 3.24Å; W63-I67 WeakPolarHBondContact O-CG1 3.32Å; W63-I67 PolarHBondContact O-N 2.95Å
64	R	97.3	Very high	95.8	Very high	112 Å²	112	67.4 Å²	67.4	42%	0.423	32%	0.322	S	S	.	.	H	α-helix	trans	-57.9	-50.7	175	-168.6	174.6	-60.4	152.9	5.5	111.9	S57 C60 K61 L62 I66 I67 D68	S57-R64 VanDerWaalsContact O-CB 3.29Å; S57-R64 WeakPolarHBondContact O-CB 3.49Å; S57-R64 PolarHBondContact O-NE 2.9Å; C60-R64 WeakPolarHBondContact O-CB 3.32Å; C60-R64 PolarHBondContact O-N 3.48Å; C60-R64 VanDerWaalsContact O-N 3.07Å; K61-R64 WeakPolarHBondContact O-CB 3.15Å; K61-R64 PolarHBondContact O-N 3.25Å; L62-R64 VanDerWaalsContact C-N 3.26Å; L62-R64 PolarHBondContact O-N 3.02Å; R64-I66 VanDerWaalsContact C-N 3.35Å; R64-I66 PolarHBondContact O-N 3.15Å; R64-I67 PolarHBondContact O-N 3.39Å; R64-D68 WeakPolarHBondContact CG-OD2 3.47Å; R64-D68 WeakPolarHBondContact O-CB 3.39Å; R64-D68 VanDerWaalsContact O-CG 3.32Å; R64-D68 PolarHBondContact O-N 3.48Å
65	S	96.8	Very high	95.9	Very high	49 Å²	49	72 Å²	72	34%	0.343	33%	0.333	S	S	.	.	H	α-helix	trans	-62.7	-43.7	179.9	59.3	0	0	0	0	111.2	K61 L62 I67 D69	K61-S65 PolarHBondContact O-N 3.25Å; K61-S65 PolarHBondContact O-OG 3.38Å; L62-S65 PolarHBondContact O-N 2.98Å; L62-S65 PolarHBondContact O-OG 2.81Å; S65-I67 VanDerWaalsContact C-N 3.34Å; S65-I67 PolarHBondContact O-N 3.13Å; S65-D69 WeakPolarHBondContact O-CB 3.36Å; S65-D69 PolarHBondContact O-N 3.14Å; S65-D69 VanDerWaalsContact O-OD2 3.14Å
66	I	96.7	Very high	95.8	Very high	7 Å²	7	68.4 Å²	68.4	4%	0.036	32%	0.323	C	S	.	.	H	α-helix	trans	-60.3	-44.9	179.3	-64.8	173.1	0	0	0	111.9	A33 M38 V42 F45 L62 W63 R64 S70	A33-I66 HydrophobicContact CB-CD1 3.83Å; M38-I66 HydrophobicContact CE-CB 4.07Å; M38-I66 HydrophobicContact CE-CG1 3.95Å; M38-I66 HydrophobicContact CE-CG2 3.75Å; M38-I66 HydrophobicContact SD-CB 4.2Å; M38-I66 HydrophobicContact SD-CD1 4.02Å; M38-I66 HydrophobicContact SD-CG1 3.6Å; M38-I66 HydrophobicContact SD-CG2 3.82Å; V42-I66 HydrophobicContact CG2-CG2 3.94Å; F45-I66 HydrophobicContact CD2-CG2 3.64Å; F45-I66 HydrophobicContact CE2-CB 4.16Å; F45-I66 HydrophobicContact CE2-CG2 3.62Å; L62-I66 HydrophobicContact CD1-CD1 3.97Å; L62-I66 HydrophobicContact CD1-CG1 4.26Å; L62-I66 HydrophobicContact CG-CD1 3.91Å; L62-I66 VanDerWaalsContact O-CG1 3.23Å; L62-I66 WeakPolarHBondContact O-CG1 3.46Å; L62-I66 PolarHBondContact O-N 2.67Å; W63-I66 PolarHBondContact O-N 3.2Å; R64-I66 VanDerWaalsContact C-N 3.35Å; R64-I66 PolarHBondContact O-N 3.15Å; I66-S70 WeakPolarHBondContact O-CB 3.46Å
67	I	96.8	Very high	95.7	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-75.3	-47	-177	-67.7	165.4	0	0	0	110.7	F45 L53 A56 W63 R64 S65 S70 W74	F45-I67 HydrophobicContact CB-CG1 4.4Å; F45-I67 HydrophobicContact CD1-CD1 3.86Å; F45-I67 HydrophobicContact CD1-CG1 4.05Å; F45-I67 HydrophobicContact CD2-CD1 4.43Å; F45-I67 HydrophobicContact CD2-CG1 3.84Å; F45-I67 HydrophobicContact CE1-CD1 3.82Å; F45-I67 HydrophobicContact CE1-CG1 4.28Å; F45-I67 HydrophobicContact CE2-CD1 4.38Å; F45-I67 HydrophobicContact CE2-CG1 4.08Å; F45-I67 HydrophobicContact CG-CD1 4.19Å; F45-I67 HydrophobicContact CG-CG1 3.84Å; F45-I67 HydrophobicContact CZ-CD1 4.09Å; F45-I67 HydrophobicContact CZ-CG1 4.29Å; L53-I67 HydrophobicContact CD2-CD1 4.47Å; L53-I67 HydrophobicContact CD2-CG1 4.37Å; L53-I67 HydrophobicContact CD2-CG2 4.16Å; A56-I67 HydrophobicContact CB-CD1 3.61Å; W63-I67 HydrophobicContact CB-CD1 4.45Å; W63-I67 WeakPolarHBondContact O-CB 3.38Å; W63-I67 WeakPolarHBondContact O-CD1 3.29Å; W63-I67 VanDerWaalsContact O-CG1 3.24Å; W63-I67 WeakPolarHBondContact O-CG1 3.32Å; W63-I67 PolarHBondContact O-N 2.95Å; R64-I67 PolarHBondContact O-N 3.39Å; S65-I67 VanDerWaalsContact C-N 3.34Å; S65-I67 PolarHBondContact O-N 3.13Å; I67-S70 PolarHBondContact O-N 3.49Å; I67-W74 HydrophobicContact CG2-CH2 4.05Å; I67-W74 HydrophobicContact CG2-CZ2 3.6Å; I67-W74 PolarHBondContact O-NE1 3.24Å
68	D	94.7	Very high	95.6	Very high	45 Å²	45	68.2 Å²	68.2	24%	0.241	32%	0.319	C	S	.	.	H	α-helix	trans	-69.5	-36.2	-173.9	-74.4	-10.2	0	0	0	112.4	R64 S70 W74 K100	R64-D68 WeakPolarHBondContact CG-OD2 3.47Å; R64-D68 WeakPolarHBondContact O-CB 3.39Å; R64-D68 VanDerWaalsContact O-CG 3.32Å; R64-D68 PolarHBondContact O-N 3.48Å; D68-S70 VanDerWaalsContact C-N 3.3Å; D68-S70 PolarHBondContact O-N 3.07Å; D68-W74 PolarHBondContact O-NE1 3.45Å; D68-K100 IonicContact OD1-NZ 3.65Å; D68-K100 PolarHBondContact OD1-NZ 3.43Å; D68-K100 IonicContact OD2-NZ 2.67Å; D68-K100 PolarHBondContact OD2-NZ 2.85Å
69	D	93.9	Very high	95.6	Very high	129 Å²	129	63.1 Å²	63.1	69%	0.69	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-8.2	-177.6	-59.2	-24.6	0	0	0	112.8	S65 E71	S65-D69 WeakPolarHBondContact O-CB 3.36Å; S65-D69 PolarHBondContact O-N 3.14Å; S65-D69 VanDerWaalsContact O-OD2 3.14Å; D69-E71 PolarHBondContact O-N 3.46Å
70	S	94.9	Very high	95.5	Very high	17 Å²	17	64.6 Å²	64.6	12%	0.119	31%	0.309	C	S	.	.			trans	-90.5	89.7	-177.8	-170.2	0	0	0	0	112.6	I66 I67 D68 Q72 L73 W74	I66-S70 WeakPolarHBondContact O-CB 3.46Å; I67-S70 PolarHBondContact O-N 3.49Å; D68-S70 VanDerWaalsContact C-N 3.3Å; D68-S70 PolarHBondContact O-N 3.07Å; S70-Q72 PolarHBondContact O-N 3.1Å; S70-Q72 VanDerWaalsContact O-N 3.12Å; S70-L73 PolarHBondContact O-N 3.12Å; S70-L73 VanDerWaalsContact O-N 3.1Å; S70-L73 WeakPolarHBondContact OG-CG 3.19Å; S70-W74 PolarHBondContact O-N 3.35Å
71	E	93.5	Very high	95.5	Very high	83 Å²	83	63 Å²	63	39%	0.388	30%	0.298	S	S	.	.	H	α-helix	trans	-56.2	-29.3	174.7	-77	-68.7	99.3	0	0	112.9	D69 R75	D69-E71 PolarHBondContact O-N 3.46Å; E71-R75 WeakPolarHBondContact O-CB 3.49Å; E71-R75 PolarHBondContact O-N 3.32Å
72	Q	93.3	Very high	95.5	Very high	126 Å²	126	58 Å²	58	59%	0.589	27%	0.274	S	S	*	.	H	α-helix	trans	-67.2	-38.7	178.3	-65.3	-176.8	8.7	0	0	112.5	S70 Q76	S70-Q72 PolarHBondContact O-N 3.1Å; S70-Q72 VanDerWaalsContact O-N 3.12Å; Q72-Q76 PolarHBondContact O-N 3.48Å; Q72-Q76 VanDerWaalsContact O-N 3.07Å
73	L	94.9	Very high	95.5	Very high	3 Å²	3	59.2 Å²	59.2	2%	0.016	29%	0.293	C	S	.	.	H	α-helix	trans	-62.4	-50.6	176.8	-70.9	178.8	0	0	0	110.1	V42 F45 R46 S70 R75 Q76 Q77	V42-L73 HydrophobicContact CG1-CD2 4.27Å; V42-L73 HydrophobicContact CG1-CG 4.23Å; F45-L73 HydrophobicContact CB-CD1 3.84Å; F45-L73 HydrophobicContact CB-CD2 4.35Å; R46-L73 VanDerWaalsContact CA-CD2 3.42Å; R46-L73 HydrophobicContact CB-CD2 3.72Å; R46-L73 HydrophobicContact CG-CD2 4.19Å; S70-L73 PolarHBondContact O-N 3.12Å; S70-L73 VanDerWaalsContact O-N 3.1Å; S70-L73 WeakPolarHBondContact OG-CG 3.19Å; L73-R75 PolarHBondContact O-N 2.88Å; L73-Q76 PolarHBondContact O-N 3.43Å; L73-Q77 WeakPolarHBondContact O-CG 3.21Å; L73-Q77 PolarHBondContact O-N 3.03Å
74	W	95.6	Very high	95.3	Very high	3 Å²	3	58.5 Å²	58.5	1%	0.011	29%	0.294	C	S	.	.	H	α-helix	trans	-65.3	-39.4	-179.8	-58.9	116.5	0	0	0	112.3	I67 D68 S70 Q76 Q77 C78 W99 K100 L103	I67-W74 HydrophobicContact CG2-CH2 4.05Å; I67-W74 HydrophobicContact CG2-CZ2 3.6Å; I67-W74 PolarHBondContact O-NE1 3.24Å; D68-W74 PolarHBondContact O-NE1 3.45Å; S70-W74 PolarHBondContact O-N 3.35Å; W74-Q76 PolarHBondContact O-N 3.15Å; W74-Q77 PolarHBondContact O-N 3.41Å; W74-C78 WeakPolarHBondContact O-CB 3.43Å; W74-C78 PolarHBondContact O-N 3.21Å; W74-W99 HydrophobicContact CB-CB 3.68Å; W74-K100 HydrophobicContact CB-CB 4.26Å; W74-K100 HydrophobicContact CD2-CB 3.86Å; W74-K100 HydrophobicContact CD2-CD 4.34Å; W74-K100 HydrophobicContact CD2-CG 3.88Å; W74-K100 HydrophobicContact CE3-CB 4.5Å; W74-K100 HydrophobicContact CE3-CG 4.25Å; W74-K100 HydrophobicContact CG-CB 3.72Å; W74-K100 HydrophobicContact CG-CG 4.28Å; W74-K100 HydrophobicContact CH2-CG 4.42Å; W74-K100 HydrophobicContact CZ2-CD 3.8Å; W74-K100 HydrophobicContact CZ2-CG 4.05Å; W74-L103 HydrophobicContact CE3-CD2 3.63Å; W74-L103 HydrophobicContact CZ3-CD2 3.96Å
75	R	95.8	Very high	95.3	Very high	145 Å²	145	53.2 Å²	53.2	55%	0.547	27%	0.274	S	S	.	.	H	α-helix	trans	-58.5	-47.1	175.3	-179.7	175.9	175.6	-172.4	-1.4	111.7	E71 L73 Q77 C78 M79 W99	E71-R75 WeakPolarHBondContact O-CB 3.49Å; E71-R75 PolarHBondContact O-N 3.32Å; L73-R75 PolarHBondContact O-N 2.88Å; R75-Q77 PolarHBondContact O-N 3.46Å; R75-C78 WeakPolarHBondContact O-CB 3.46Å; R75-C78 PolarHBondContact O-N 3.28Å; R75-M79 WeakPolarHBondContact O-CG 3.38Å; R75-M79 PolarHBondContact O-N 3.37Å; R75-W99 HydrophobicContact CB-CB 4.45Å; R75-W99 HydrophobicContact CB-CD2 3.79Å; R75-W99 HydrophobicContact CB-CE3 4.37Å; R75-W99 HydrophobicContact CB-CG 3.8Å; R75-W99 HydrophobicContact CG-CD2 3.91Å; R75-W99 HydrophobicContact CG-CE3 4.29Å; R75-W99 HydrophobicContact CG-CG 4.42Å; R75-W99 HydrophobicContact CG-CH2 4.2Å; R75-W99 HydrophobicContact CG-CZ2 3.82Å; R75-W99 HydrophobicContact CG-CZ3 4.41Å
76	Q	94.9	Very high	95.2	Very high	77 Å²	77	58.6 Å²	58.6	36%	0.36	29%	0.287	S	S	.	.	H	α-helix	trans	-58.8	-47.5	179.2	176.3	177	-31.8	0	0	111.6	R46 Q72 L73 W74 C78 M79 L80	R46-Q76 PolarHBondContact O-NE2 2.68Å; Q72-Q76 PolarHBondContact O-N 3.48Å; Q72-Q76 VanDerWaalsContact O-N 3.07Å; L73-Q76 PolarHBondContact O-N 3.43Å; W74-Q76 PolarHBondContact O-N 3.15Å; Q76-C78 VanDerWaalsContact C-N 3.3Å; Q76-C78 PolarHBondContact O-N 3.1Å; Q76-M79 WeakPolarHBondContact O-CB 3.46Å; Q76-M79 PolarHBondContact O-N 3.4Å; Q76-M79 VanDerWaalsContact O-N 3.13Å; Q76-L80 PolarHBondContact O-N 2.9Å
77	Q	94.6	Very high	95.1	Very high	16 Å²	16	63.2 Å²	63.2	8%	0.075	30%	0.304	C	S	.	.	H	α-helix	trans	-63.9	-37.5	177.9	-61.8	-60.2	-38.3	0	0	111.6	L48 L53 L73 W74 R75 M79 L80 V81 L103	L48-Q77 PolarHBondContact O-NE2 3.25Å; L53-Q77 HydrophobicContact CD1-CG 3.87Å; L73-Q77 WeakPolarHBondContact O-CG 3.21Å; L73-Q77 PolarHBondContact O-N 3.03Å; W74-Q77 PolarHBondContact O-N 3.41Å; R75-Q77 PolarHBondContact O-N 3.46Å; Q77-M79 VanDerWaalsContact C-N 3.28Å; Q77-M79 PolarHBondContact O-N 3.03Å; Q77-L80 WeakPolarHBondContact O-CB 3.36Å; Q77-L80 PolarHBondContact O-N 3.4Å; Q77-V81 PolarHBondContact O-N 3.25Å; Q77-L103 HydrophobicContact CB-CD1 4Å; Q77-L103 HydrophobicContact CB-CD2 3.61Å; Q77-L103 HydrophobicContact CB-CG 4.47Å; Q77-L103 HydrophobicContact CG-CD2 4.45Å
78	C	95.8	Very high	95.1	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.5	-35.8	173.5	-97.3	0	0	0	0	112.9	W74 R75 Q76 L80 V81 R82 W99 L103	W74-C78 WeakPolarHBondContact O-CB 3.43Å; W74-C78 PolarHBondContact O-N 3.21Å; R75-C78 WeakPolarHBondContact O-CB 3.46Å; R75-C78 PolarHBondContact O-N 3.28Å; Q76-C78 VanDerWaalsContact C-N 3.3Å; Q76-C78 PolarHBondContact O-N 3.1Å; C78-L80 VanDerWaalsContact C-N 3.27Å; C78-L80 PolarHBondContact O-N 2.89Å; C78-V81 PolarHBondContact O-N 3.25Å; C78-R82 VanDerWaalsContact O-CB 3.28Å; C78-R82 WeakPolarHBondContact O-CB 3.24Å; C78-R82 PolarHBondContact O-N 3.3Å; C78-W99 HydrophobicContact CB-CE3 3.47Å; C78-W99 VanDerWaalsContact CB-CE3 3.47Å; C78-W99 HydrophobicContact CB-CZ3 3.79Å; C78-W99 PolarHBondContact SG-O 3.47Å; C78-L103 VanDerWaalsContact SG-CA 3.59Å; C78-L103 VanDerWaalsContact SG-CB 3.56Å; C78-L103 PolarHBondContact SG-N 3.46Å; C78-L103 VanDerWaalsContact SG-N 3.41Å
79	M	95.6	Very high	95.2	Very high	90 Å²	90	61.8 Å²	61.8	44%	0.443	30%	0.296	S	S	.	.	H	α-helix	trans	-64.9	-33.6	178.3	-64.7	-57.7	-76.6	0	0	112.1	R75 Q76 Q77 R82 A83	R75-M79 WeakPolarHBondContact O-CG 3.38Å; R75-M79 PolarHBondContact O-N 3.37Å; Q76-M79 WeakPolarHBondContact O-CB 3.46Å; Q76-M79 PolarHBondContact O-N 3.4Å; Q76-M79 VanDerWaalsContact O-N 3.13Å; Q77-M79 VanDerWaalsContact C-N 3.28Å; Q77-M79 PolarHBondContact O-N 3.03Å; M79-R82 PolarHBondContact O-N 3.2Å; M79-A83 PolarHBondContact O-N 3.45Å
80	L	94.1	Very high	95.3	Very high	115 Å²	115	58.2 Å²	58.2	60%	0.602	28%	0.277	S	S	*	.	H	α-helix	trans	-66.1	-45.2	173.6	-59.9	176.2	0	0	0	111.1	Q76 Q77 C78 R82 A83	Q76-L80 PolarHBondContact O-N 2.9Å; Q77-L80 WeakPolarHBondContact O-CB 3.36Å; Q77-L80 PolarHBondContact O-N 3.4Å; C78-L80 VanDerWaalsContact C-N 3.27Å; C78-L80 PolarHBondContact O-N 2.89Å; L80-R82 VanDerWaalsContact C-N 3.33Å; L80-R82 PolarHBondContact O-N 3.25Å; L80-A83 WeakPolarHBondContact O-CB 3.23Å; L80-A83 PolarHBondContact O-N 3.47Å
81	V	95.8	Very high	95.4	Very high	10 Å²	10	60.1 Å²	60.1	6%	0.061	29%	0.29	C	S	.	.	H	α-helix	trans	-63.8	-39.1	176.2	168.9	0	0	0	0	111.7	Q77 C78 A83 V84 C85 V89 L103 N106 Y107	Q77-V81 PolarHBondContact O-N 3.25Å; C78-V81 PolarHBondContact O-N 3.25Å; V81-A83 PolarHBondContact O-N 3.41Å; V81-V84 PolarHBondContact O-N 3.3Å; V81-V84 VanDerWaalsContact O-N 3.07Å; V81-C85 HydrophobicContact CG1-CB 4.36Å; V81-C85 PolarHBondContact O-N 3.19Å; V81-V89 HydrophobicContact CG1-CG2 3.85Å; V81-L103 HydrophobicContact CB-CD1 4.26Å; V81-L103 HydrophobicContact CG2-CD1 3.54Å; V81-N106 HydrophobicContact CG1-CB 3.79Å; V81-Y107 HydrophobicContact CG2-CD2 4.43Å
82	R	96.4	Very high	95.6	Very high	77 Å²	77	56.8 Å²	56.8	29%	0.291	28%	0.275	S	S	.	.	H	α-helix	trans	-62.6	-27.9	179.1	-170.6	179	-178.8	-100.1	-5.5	113.3	C78 M79 L80 V84 R86 V89 D90	C78-R82 VanDerWaalsContact O-CB 3.28Å; C78-R82 WeakPolarHBondContact O-CB 3.24Å; C78-R82 PolarHBondContact O-N 3.3Å; M79-R82 PolarHBondContact O-N 3.2Å; L80-R82 VanDerWaalsContact C-N 3.33Å; L80-R82 PolarHBondContact O-N 3.25Å; R82-V84 PolarHBondContact O-N 3.47Å; R82-R86 HydrophobicContact CG-CG 4.47Å; R82-R86 VanDerWaalsContact O-CA 3.28Å; R82-R86 WeakPolarHBondContact O-CA 3.4Å; R82-R86 WeakPolarHBondContact O-CB 3.39Å; R82-R86 PolarHBondContact O-N 2.81Å; R82-V89 HydrophobicContact CB-CB 4.2Å; R82-V89 HydrophobicContact CB-CG1 3.99Å; R82-V89 HydrophobicContact CB-CG2 4.29Å; R82-V89 HydrophobicContact CG-CB 4.15Å; R82-V89 HydrophobicContact CG-CG1 3.99Å; R82-D90 IonicContact CZ-OD1 2.68Å; R82-D90 VanDerWaalsContact CZ-OD1 3.26Å; R82-D90 IonicContact CZ-OD2 3.65Å; R82-D90 IonicContact NE-OD1 3.03Å; R82-D90 PolarHBondContact NE-OD1 2.88Å; R82-D90 IonicContact NE-OD2 3.53Å; R82-D90 VanDerWaalsContact NH2-CG 3.34Å; R82-D90 IonicContact NH2-OD1 2.94Å; R82-D90 PolarHBondContact NH2-OD1 3.25Å; R82-D90 IonicContact NH2-OD2 2.68Å; R82-D90 PolarHBondContact NH2-OD2 2.9Å
83	A	95.8	Very high	95.7	Very high	87 Å²	87	54.2 Å²	54.2	72%	0.719	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-24	175.6	0	0	0	0	0	112.4	M79 L80 V81	M79-A83 PolarHBondContact O-N 3.45Å; L80-A83 WeakPolarHBondContact O-CB 3.23Å; L80-A83 PolarHBondContact O-N 3.47Å; V81-A83 PolarHBondContact O-N 3.41Å
84	V	95.4	Very high	95.9	Very high	38 Å²	38	58.6 Å²	58.6	23%	0.23	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-43.4	-177.8	178.4	0	0	0	0	111.7	V81 R82 K113 A114 L117	V81-V84 PolarHBondContact O-N 3.3Å; V81-V84 VanDerWaalsContact O-N 3.07Å; R82-V84 PolarHBondContact O-N 3.47Å; V84-K113 HydrophobicContact CG1-CB 3.88Å; V84-K113 HydrophobicContact CG1-CD 3.77Å; V84-K113 HydrophobicContact CG1-CG 3.75Å; V84-K113 WeakPolarHBondContact O-CE 3.48Å; V84-K113 PolarHBondContact O-NZ 2.99Å; V84-A114 HydrophobicContact CG1-CB 4.18Å; V84-A114 HydrophobicContact CG2-CB 4.15Å; V84-L117 HydrophobicContact CG1-CD1 4.42Å
85	C	95.4	Very high	95.9	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.317	C	S	.	.			trans	-111.4	59.1	-178.9	-73.3	0	0	0	0	110.7	V81 E88 V89 S110	V81-C85 HydrophobicContact CG1-CB 4.36Å; V81-C85 PolarHBondContact O-N 3.19Å; C85-E88 VanDerWaalsContact C-OE2 3.23Å; C85-E88 WeakPolarHBondContact CA-OE2 3.48Å; C85-E88 HydrophobicContact CB-CB 4.49Å; C85-E88 VanDerWaalsContact CB-OE2 3.28Å; C85-E88 WeakPolarHBondContact CB-OE2 3.21Å; C85-V89 WeakPolarHBondContact O-CB 3.32Å; C85-V89 VanDerWaalsContact O-CG2 3.25Å; C85-V89 WeakPolarHBondContact O-CG2 3.3Å; C85-V89 PolarHBondContact O-N 3.15Å; C85-V89 VanDerWaalsContact O-N 3.11Å; C85-S110 VanDerWaalsContact SG-CA 3.52Å
86	R	95.4	Very high	96	Very high	163 Å²	163	59.6 Å²	59.6	62%	0.615	32%	0.322	S	S	*	.	H	α-helix	trans	-61.1	-49.5	-175.6	-178.1	177.8	173.2	178.7	-3.7	112.1	R82 E88 V89 D90	R82-R86 HydrophobicContact CG-CG 4.47Å; R82-R86 VanDerWaalsContact O-CA 3.28Å; R82-R86 WeakPolarHBondContact O-CA 3.4Å; R82-R86 WeakPolarHBondContact O-CB 3.39Å; R82-R86 PolarHBondContact O-N 2.81Å; R86-E88 PolarHBondContact O-N 3.28Å; R86-V89 PolarHBondContact O-N 2.89Å; R86-D90 WeakPolarHBondContact CG-OD2 3.43Å; R86-D90 IonicContact NE-OD2 3.74Å; R86-D90 PolarHBondContact NE-OD2 3.39Å; R86-D90 VanDerWaalsContact O-CB 3.27Å; R86-D90 WeakPolarHBondContact O-CB 3.46Å; R86-D90 VanDerWaalsContact O-CG 3.26Å; R86-D90 PolarHBondContact O-N 3.41Å
87	R	95.6	Very high	96.1	Very high	103 Å²	103	58.2 Å²	58.2	39%	0.389	32%	0.317	S	S	.	.	H	α-helix	trans	-61.5	-45.6	-175.4	-176.6	-177.2	59	120.8	15.4	111.4	S91 D139 E141	R87-S91 WeakPolarHBondContact O-CB 3.35Å; R87-S91 PolarHBondContact O-N 2.79Å; R87-D139 IonicContact CZ-OD2 2.62Å; R87-D139 IonicContact NH1-OD2 3.18Å; R87-D139 IonicContact NH2-OD1 3.65Å; R87-D139 IonicContact NH2-OD2 3.81Å; R87-D139 PolarHBondContact NH2-OD2 3.03Å; R87-E141 IonicContact CZ-OE2 2.97Å; R87-E141 IonicContact NE-OE2 3.6Å; R87-E141 PolarHBondContact NE-OE2 3.36Å; R87-E141 IonicContact NH1-OE2 2.72Å; R87-E141 PolarHBondContact NH1-OE2 3.13Å
88	E	95.6	Very high	96.1	Very high	15 Å²	15	59.7 Å²	59.7	7%	0.07	33%	0.329	C	S	.	.	H	α-helix	trans	-69.1	-43.1	-178.4	-57.5	73.3	-165	0	0	111.5	C85 R86 D92 N106	C85-E88 VanDerWaalsContact C-OE2 3.23Å; C85-E88 WeakPolarHBondContact CA-OE2 3.48Å; C85-E88 HydrophobicContact CB-CB 4.49Å; C85-E88 VanDerWaalsContact CB-OE2 3.28Å; C85-E88 WeakPolarHBondContact CB-OE2 3.21Å; R86-E88 PolarHBondContact O-N 3.28Å; E88-D92 WeakPolarHBondContact O-CB 3.5Å; E88-D92 PolarHBondContact O-N 3.46Å; E88-N106 WeakPolarHBondContact CB-OD1 3.13Å
89	V	96.8	Very high	96.1	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.006	34%	0.337	C	S	.	.	H	α-helix	trans	-64.6	-48.1	176.7	172	0	0	0	0	110.5	V81 R82 C85 R86 S91 D92 R93 T102 N106	V81-V89 HydrophobicContact CG1-CG2 3.85Å; R82-V89 HydrophobicContact CB-CB 4.2Å; R82-V89 HydrophobicContact CB-CG1 3.99Å; R82-V89 HydrophobicContact CB-CG2 4.29Å; R82-V89 HydrophobicContact CG-CB 4.15Å; R82-V89 HydrophobicContact CG-CG1 3.99Å; C85-V89 WeakPolarHBondContact O-CB 3.32Å; C85-V89 VanDerWaalsContact O-CG2 3.25Å; C85-V89 WeakPolarHBondContact O-CG2 3.3Å; C85-V89 PolarHBondContact O-N 3.15Å; C85-V89 VanDerWaalsContact O-N 3.11Å; R86-V89 PolarHBondContact O-N 2.89Å; V89-S91 VanDerWaalsContact C-N 3.3Å; V89-S91 PolarHBondContact O-N 3.33Å; V89-D92 PolarHBondContact O-N 3.41Å; V89-R93 HydrophobicContact CG1-CG 4.34Å; V89-R93 VanDerWaalsContact O-CG 3.27Å; V89-R93 WeakPolarHBondContact O-CG 3.28Å; V89-R93 PolarHBondContact O-N 3.17Å; V89-T102 HydrophobicContact CB-CG2 4.35Å; V89-T102 HydrophobicContact CG1-CG2 3.95Å; V89-T102 HydrophobicContact CG2-CG2 4.32Å; V89-N106 HydrophobicContact CG2-CB 4.37Å
90	D	97.2	Very high	96.1	Very high	54 Å²	54	59.9 Å²	59.9	29%	0.289	33%	0.327	S	S	.	.	H	α-helix	trans	-61.8	-38.6	-178.9	-73.9	-12.9	0	0	0	111.5	R82 R86 R93 S94	R82-D90 IonicContact CZ-OD1 2.68Å; R82-D90 VanDerWaalsContact CZ-OD1 3.26Å; R82-D90 IonicContact CZ-OD2 3.65Å; R82-D90 IonicContact NE-OD1 3.03Å; R82-D90 PolarHBondContact NE-OD1 2.88Å; R82-D90 IonicContact NE-OD2 3.53Å; R82-D90 VanDerWaalsContact NH2-CG 3.34Å; R82-D90 IonicContact NH2-OD1 2.94Å; R82-D90 PolarHBondContact NH2-OD1 3.25Å; R82-D90 IonicContact NH2-OD2 2.68Å; R82-D90 PolarHBondContact NH2-OD2 2.9Å; R86-D90 WeakPolarHBondContact CG-OD2 3.43Å; R86-D90 IonicContact NE-OD2 3.74Å; R86-D90 PolarHBondContact NE-OD2 3.39Å; R86-D90 VanDerWaalsContact O-CB 3.27Å; R86-D90 WeakPolarHBondContact O-CB 3.46Å; R86-D90 VanDerWaalsContact O-CG 3.26Å; R86-D90 PolarHBondContact O-N 3.41Å; D90-R93 PolarHBondContact O-N 3.38Å; D90-S94 PolarHBondContact O-N 2.94Å; D90-S94 PolarHBondContact O-OG 3.04Å
91	S	96.9	Very high	96.1	Very high	56 Å²	56	57.4 Å²	57.4	39%	0.392	32%	0.316	S	S	.	.	H	α-helix	trans	-64.2	-49	173.9	-169.3	0	0	0	0	112.3	R87 V89 R93 S94 D95	R87-S91 WeakPolarHBondContact O-CB 3.35Å; R87-S91 PolarHBondContact O-N 2.79Å; V89-S91 VanDerWaalsContact C-N 3.3Å; V89-S91 PolarHBondContact O-N 3.33Å; S91-R93 PolarHBondContact O-N 3.37Å; S91-S94 WeakPolarHBondContact CA-OG 3.27Å; S91-S94 PolarHBondContact O-N 2.94Å; S91-S94 VanDerWaalsContact O-N 3.09Å; S91-S94 PolarHBondContact O-OG 3.34Å; S91-D95 PolarHBondContact O-N 3.25Å
92	D	97.2	Very high	96.2	Very high	13 Å²	13	56.9 Å²	56.9	7%	0.07	31%	0.313	C	S	.	.	H	α-helix	trans	-59.6	-32.6	177.2	-85.8	-15.4	0	0	0	111.8	E88 V89 L97 T102 R105 N106	E88-D92 WeakPolarHBondContact O-CB 3.5Å; E88-D92 PolarHBondContact O-N 3.46Å; V89-D92 PolarHBondContact O-N 3.41Å; D92-L97 HydrophobicContact CB-CD1 3.92Å; D92-L97 WeakPolarHBondContact O-CB 3.42Å; D92-L97 WeakPolarHBondContact O-CG 3.28Å; D92-L97 PolarHBondContact O-N 2.84Å; D92-L97 WeakPolarHBondContact OD1-CD1 3.43Å; D92-T102 HydrophobicContact CB-CG2 3.62Å; D92-R105 IonicContact OD1-CZ 3.5Å; D92-R105 IonicContact OD1-NH1 2.85Å; D92-R105 PolarHBondContact OD1-NH1 3.04Å; D92-N106 PolarHBondContact OD2-ND2 3.14Å
93	R	96.1	Very high	96.1	Very high	72 Å²	72	53.4 Å²	53.4	27%	0.272	30%	0.3	S	S	.	.	H	α-helix	trans	-72	-41	174.8	-66.8	-44.2	-59.7	165.9	8.1	112.2	V89 D90 S91 D95 G96 L97 W99	V89-R93 HydrophobicContact CG1-CG 4.34Å; V89-R93 VanDerWaalsContact O-CG 3.27Å; V89-R93 WeakPolarHBondContact O-CG 3.28Å; V89-R93 PolarHBondContact O-N 3.17Å; D90-R93 PolarHBondContact O-N 3.38Å; S91-R93 PolarHBondContact O-N 3.37Å; R93-D95 PolarHBondContact O-N 3.05Å; R93-G96 PolarHBondContact O-N 3.26Å; R93-G96 VanDerWaalsContact O-N 3.16Å; R93-L97 VanDerWaalsContact CZ-O 3.24Å; R93-L97 PolarHBondContact NH1-O 3.25Å; R93-L97 PolarHBondContact NH2-O 3.39Å; R93-W99 HydrophobicContact CG-CH2 4.06Å; R93-W99 HydrophobicContact CG-CZ3 3.99Å; R93-W99 VanDerWaalsContact NH1-N 3.15Å
94	S	97.3	Very high	96	Very high	95 Å²	95	53.7 Å²	53.7	66%	0.664	29%	0.289	S	S	*	.	H	α-helix	trans	-65.3	-30.8	175.3	58	0	0	0	0	112.2	D90 S91 G96	D90-S94 PolarHBondContact O-N 2.94Å; D90-S94 PolarHBondContact O-OG 3.04Å; S91-S94 WeakPolarHBondContact CA-OG 3.27Å; S91-S94 PolarHBondContact O-N 2.94Å; S91-S94 VanDerWaalsContact O-N 3.09Å; S91-S94 PolarHBondContact O-OG 3.34Å; S94-G96 PolarHBondContact O-N 3.29Å
95	D	97.4	Very high	96	Very high	105 Å²	105	58.9 Å²	58.9	56%	0.561	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-0.4	176.5	-62.9	-13.9	0	0	0	113	S91 R93 L97	S91-D95 PolarHBondContact O-N 3.25Å; R93-D95 PolarHBondContact O-N 3.05Å; D95-L97 HydrophobicContact CB-CG 4.44Å
96	G	96.4	Very high	96	Very high	64 Å²	64	59 Å²	59	66%	0.66	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	16.7	174.4	0	0	0	0	0	114.9	R93 S94	R93-G96 PolarHBondContact O-N 3.26Å; R93-G96 VanDerWaalsContact O-N 3.16Å; S94-G96 PolarHBondContact O-N 3.29Å
97	L	96.6	Very high	95.9	Very high	48 Å²	48	53.8 Å²	53.8	25%	0.251	29%	0.286	S	S	.	.			trans	-67.7	157.4	177.6	-56.6	-179.4	0	0	0	111.3	D92 R93 D95 V101	D92-L97 HydrophobicContact CB-CD1 3.92Å; D92-L97 WeakPolarHBondContact O-CB 3.42Å; D92-L97 WeakPolarHBondContact O-CG 3.28Å; D92-L97 PolarHBondContact O-N 2.84Å; D92-L97 WeakPolarHBondContact OD1-CD1 3.43Å; R93-L97 VanDerWaalsContact CZ-O 3.24Å; R93-L97 PolarHBondContact NH1-O 3.25Å; R93-L97 PolarHBondContact NH2-O 3.39Å; D95-L97 HydrophobicContact CB-CG 4.44Å; L97-V101 HydrophobicContact CB-CB 4.5Å; L97-V101 HydrophobicContact CB-CG1 4.3Å; L97-V101 HydrophobicContact CD1-CG1 4.21Å
98	S	95.6	Very high	95.8	Very high	47 Å²	47	52.3 Å²	52.3	33%	0.329	29%	0.291	S	S	.	.			trans	-74.6	158.6	173.3	71.9	0	0	0	0	111.5	K100 V101 T102	S98-K100 PolarHBondContact O-N 3.39Å; S98-V101 PolarHBondContact O-N 3.21Å; S98-V101 VanDerWaalsContact O-N 3.17Å; S98-V101 WeakPolarHBondContact OG-CG2 3.39Å; S98-V101 PolarHBondContact OG-N 3.07Å; S98-T102 PolarHBondContact O-N 2.68Å; S98-T102 PolarHBondContact O-OG1 3.06Å; S98-T102 VanDerWaalsContact O-OG1 3.06Å
99	W	96.1	Very high	95.8	Very high	43 Å²	43	55 Å²	55	16%	0.163	30%	0.301	C	S	.	.	H	α-helix	trans	-59.8	-38.6	-179.9	-72.9	111	0	0	0	111.8	W74 R75 C78 R93 T102 L103	W74-W99 HydrophobicContact CB-CB 3.68Å; R75-W99 HydrophobicContact CB-CB 4.45Å; R75-W99 HydrophobicContact CB-CD2 3.79Å; R75-W99 HydrophobicContact CB-CE3 4.37Å; R75-W99 HydrophobicContact CB-CG 3.8Å; R75-W99 HydrophobicContact CG-CD2 3.91Å; R75-W99 HydrophobicContact CG-CE3 4.29Å; R75-W99 HydrophobicContact CG-CG 4.42Å; R75-W99 HydrophobicContact CG-CH2 4.2Å; R75-W99 HydrophobicContact CG-CZ2 3.82Å; R75-W99 HydrophobicContact CG-CZ3 4.41Å; C78-W99 HydrophobicContact CB-CE3 3.47Å; C78-W99 VanDerWaalsContact CB-CE3 3.47Å; C78-W99 HydrophobicContact CB-CZ3 3.79Å; C78-W99 PolarHBondContact SG-O 3.47Å; R93-W99 HydrophobicContact CG-CH2 4.06Å; R93-W99 HydrophobicContact CG-CZ3 3.99Å; R93-W99 VanDerWaalsContact NH1-N 3.15Å; W99-T102 PolarHBondContact O-N 2.94Å; W99-L103 WeakPolarHBondContact O-CB 3.33Å; W99-L103 PolarHBondContact O-N 2.72Å
100	K	94.4	Very high	95.8	Very high	52 Å²	52	55.3 Å²	55.3	23%	0.226	30%	0.303	C	S	.	.	H	α-helix	trans	-60.4	-47.2	175.9	-175.8	176	175.1	176.5	0	112.1	D68 W74 S98 L103 L104	D68-K100 IonicContact OD1-NZ 3.65Å; D68-K100 PolarHBondContact OD1-NZ 3.43Å; D68-K100 IonicContact OD2-NZ 2.67Å; D68-K100 PolarHBondContact OD2-NZ 2.85Å; W74-K100 HydrophobicContact CB-CB 4.26Å; W74-K100 HydrophobicContact CD2-CB 3.86Å; W74-K100 HydrophobicContact CD2-CD 4.34Å; W74-K100 HydrophobicContact CD2-CG 3.88Å; W74-K100 HydrophobicContact CE3-CB 4.5Å; W74-K100 HydrophobicContact CE3-CG 4.25Å; W74-K100 HydrophobicContact CG-CB 3.72Å; W74-K100 HydrophobicContact CG-CG 4.28Å; W74-K100 HydrophobicContact CH2-CG 4.42Å; W74-K100 HydrophobicContact CZ2-CD 3.8Å; W74-K100 HydrophobicContact CZ2-CG 4.05Å; S98-K100 PolarHBondContact O-N 3.39Å; K100-L103 PolarHBondContact O-N 2.91Å; K100-L104 HydrophobicContact CG-CD1 4.12Å; K100-L104 VanDerWaalsContact O-CG 3.3Å; K100-L104 WeakPolarHBondContact O-CG 3.5Å; K100-L104 PolarHBondContact O-N 2.93Å
101	V	95.3	Very high	95.7	Very high	62 Å²	62	58.9 Å²	58.9	38%	0.376	31%	0.313	S	S	.	.	H	α-helix	trans	-65.3	-47.1	179.8	172.7	0	0	0	0	110.5	L97 S98 L103 L104 R105	L97-V101 HydrophobicContact CB-CB 4.5Å; L97-V101 HydrophobicContact CB-CG1 4.3Å; L97-V101 HydrophobicContact CD1-CG1 4.21Å; S98-V101 PolarHBondContact O-N 3.21Å; S98-V101 VanDerWaalsContact O-N 3.17Å; S98-V101 WeakPolarHBondContact OG-CG2 3.39Å; S98-V101 PolarHBondContact OG-N 3.07Å; V101-L103 VanDerWaalsContact C-N 3.3Å; V101-L103 PolarHBondContact O-N 3.17Å; V101-L104 PolarHBondContact O-N 2.89Å; V101-R105 HydrophobicContact CG1-CG 4.32Å; V101-R105 WeakPolarHBondContact O-CG 3.28Å; V101-R105 PolarHBondContact O-N 3.25Å
102	T	97	Very high	95.6	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-55.9	-43.9	175.9	-57.3	0	0	0	0	111.8	V89 D92 S98 W99 N106	V89-T102 HydrophobicContact CB-CG2 4.35Å; V89-T102 HydrophobicContact CG1-CG2 3.95Å; V89-T102 HydrophobicContact CG2-CG2 4.32Å; D92-T102 HydrophobicContact CB-CG2 3.62Å; S98-T102 PolarHBondContact O-N 2.68Å; S98-T102 PolarHBondContact O-OG1 3.06Å; S98-T102 VanDerWaalsContact O-OG1 3.06Å; W99-T102 PolarHBondContact O-N 2.94Å; T102-N106 PolarHBondContact O-N 3.4Å; T102-N106 PolarHBondContact O-ND2 2.87Å
103	L	95.6	Very high	95.5	Very high	3 Å²	3	56.1 Å²	56.1	2%	0.016	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-52.9	177.9	-176.7	66.3	0	0	0	110.9	A50 W74 Q77 C78 V81 W99 K100 V101 R105 N106 Y107	A50-L103 HydrophobicContact CB-CD2 4.18Å; W74-L103 HydrophobicContact CE3-CD2 3.63Å; W74-L103 HydrophobicContact CZ3-CD2 3.96Å; Q77-L103 HydrophobicContact CB-CD1 4Å; Q77-L103 HydrophobicContact CB-CD2 3.61Å; Q77-L103 HydrophobicContact CB-CG 4.47Å; Q77-L103 HydrophobicContact CG-CD2 4.45Å; C78-L103 VanDerWaalsContact SG-CA 3.59Å; C78-L103 VanDerWaalsContact SG-CB 3.56Å; C78-L103 PolarHBondContact SG-N 3.46Å; C78-L103 VanDerWaalsContact SG-N 3.41Å; V81-L103 HydrophobicContact CB-CD1 4.26Å; V81-L103 HydrophobicContact CG2-CD1 3.54Å; W99-L103 WeakPolarHBondContact O-CB 3.33Å; W99-L103 PolarHBondContact O-N 2.72Å; K100-L103 PolarHBondContact O-N 2.91Å; V101-L103 VanDerWaalsContact C-N 3.3Å; V101-L103 PolarHBondContact O-N 3.17Å; L103-R105 VanDerWaalsContact C-N 3.32Å; L103-R105 PolarHBondContact O-N 2.94Å; L103-N106 PolarHBondContact O-N 2.62Å; L103-N106 VanDerWaalsContact O-N 3.17Å; L103-Y107 WeakPolarHBondContact O-CB 3.2Å; L103-Y107 PolarHBondContact O-N 2.82Å
104	L	92.9	Very high	95.5	Very high	93 Å²	93	54.5 Å²	54.5	49%	0.487	30%	0.295	S	S	.	.	H	α-helix	trans	-62.6	-38.5	-174.5	-69.9	174.2	0	0	0	112.3	K100 V101 N106	K100-L104 HydrophobicContact CG-CD1 4.12Å; K100-L104 VanDerWaalsContact O-CG 3.3Å; K100-L104 WeakPolarHBondContact O-CG 3.5Å; K100-L104 PolarHBondContact O-N 2.93Å; V101-L104 PolarHBondContact O-N 2.89Å; L104-N106 VanDerWaalsContact C-N 3.31Å; L104-N106 PolarHBondContact O-N 2.82Å
105	R	94.8	Very high	95.4	Very high	148 Å²	148	50.1 Å²	50.1	56%	0.558	27%	0.265	S	S	*	.	H	α-helix	trans	-63.8	-36.3	176.8	-69.9	-178.1	89.9	-170.4	11.3	112.6	D92 V101 L103	D92-R105 IonicContact OD1-CZ 3.5Å; D92-R105 IonicContact OD1-NH1 2.85Å; D92-R105 PolarHBondContact OD1-NH1 3.04Å; V101-R105 HydrophobicContact CG1-CG 4.32Å; V101-R105 WeakPolarHBondContact O-CG 3.28Å; V101-R105 PolarHBondContact O-N 3.25Å; L103-R105 VanDerWaalsContact C-N 3.32Å; L103-R105 PolarHBondContact O-N 2.94Å
106	N	95.9	Very high	95.3	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-101.8	-10.7	-172.1	-65.3	-64.2	0	0	0	114.3	V81 E88 V89 D92 T102 L103 L104 S108 R109 S110	V81-N106 HydrophobicContact CG1-CB 3.79Å; E88-N106 WeakPolarHBondContact CB-OD1 3.13Å; V89-N106 HydrophobicContact CG2-CB 4.37Å; D92-N106 PolarHBondContact OD2-ND2 3.14Å; T102-N106 PolarHBondContact O-N 3.4Å; T102-N106 PolarHBondContact O-ND2 2.87Å; L103-N106 PolarHBondContact O-N 2.62Å; L103-N106 VanDerWaalsContact O-N 3.17Å; L104-N106 VanDerWaalsContact C-N 3.31Å; L104-N106 PolarHBondContact O-N 2.82Å; N106-S108 PolarHBondContact O-N 2.88Å; N106-R109 PolarHBondContact O-N 3.27Å; N106-S110 WeakPolarHBondContact O-CB 3.25Å; N106-S110 PolarHBondContact O-N 3.48Å; N106-S110 PolarHBondContact O-OG 2.71Å
107	Y	94.3	Very high	95.3	Very high	52 Å²	52	46.6 Å²	46.6	20%	0.204	23%	0.228	C	C	.	.	H	α-helix	trans	-57.6	-56.5	-172.7	-174.7	-112.1	0	0	0	112.7	A50 V81 L103 R109 S110 R111	A50-Y107 HydrophobicContact CB-CD2 4.17Å; A50-Y107 HydrophobicContact CB-CE2 3.65Å; V81-Y107 HydrophobicContact CG2-CD2 4.43Å; L103-Y107 WeakPolarHBondContact O-CB 3.2Å; L103-Y107 PolarHBondContact O-N 2.82Å; Y107-R109 PolarHBondContact O-N 3.48Å; Y107-S110 PolarHBondContact O-N 3.39Å; Y107-S110 PolarHBondContact O-OG 3.32Å; Y107-R111 HydrophobicContact CE2-CG 4.37Å; Y107-R111 WeakPolarHBondContact O-CG 3.4Å; Y107-R111 PolarHBondContact O-N 3.45Å
108	S	93.6	Very high	95.2	Very high	73 Å²	73	47.7 Å²	47.7	51%	0.51	24%	0.244	S	C	.	.	H	α-helix	trans	-60.3	-45.2	-178.6	-58.7	0	0	0	0	112	N106 S110 R111 V112	N106-S108 PolarHBondContact O-N 2.88Å; S108-S110 PolarHBondContact O-N 2.85Å; S108-R111 PolarHBondContact O-N 3.02Å; S108-V112 WeakPolarHBondContact O-CG2 3.02Å; S108-V112 PolarHBondContact O-N 3.32Å; S108-V112 VanDerWaalsContact O-N 3.14Å
109	R	95	Very high	95.1	Very high	70 Å²	70	46.4 Å²	46.4	26%	0.264	24%	0.239	S	C	.	.	H	α-helix	trans	-58.3	-48.6	176.8	179.1	177.9	-67.3	134	-5.3	111.3	N106 Y107 R111 V112 K113 L138	N106-R109 PolarHBondContact O-N 3.27Å; Y107-R109 PolarHBondContact O-N 3.48Å; R109-R111 VanDerWaalsContact C-N 3.34Å; R109-R111 PolarHBondContact O-N 3.35Å; R109-V112 PolarHBondContact O-N 3.35Å; R109-K113 WeakPolarHBondContact O-CB 3.38Å; R109-K113 PolarHBondContact O-N 3.15Å; R109-L138 HydrophobicContact CG-CD2 3.65Å
110	S	95.8	Very high	94.9	Very high	8 Å²	8	52.5 Å²	52.5	6%	0.056	26%	0.262	C	S	.	.	H	α-helix	trans	-63.4	-38.4	-178.3	74.9	0	0	0	0	112.9	C85 N106 Y107 S108 A114	C85-S110 VanDerWaalsContact SG-CA 3.52Å; N106-S110 WeakPolarHBondContact O-CB 3.25Å; N106-S110 PolarHBondContact O-N 3.48Å; N106-S110 PolarHBondContact O-OG 2.71Å; Y107-S110 PolarHBondContact O-N 3.39Å; Y107-S110 PolarHBondContact O-OG 3.32Å; S108-S110 PolarHBondContact O-N 2.85Å; S110-A114 WeakPolarHBondContact O-CB 3.33Å; S110-A114 PolarHBondContact O-N 3.14Å
111	R	95.1	Very high	94.8	Very high	130 Å²	130	51.5 Å²	51.5	49%	0.491	26%	0.257	S	S	.	.	H	α-helix	trans	-64.9	-43	176.5	-73.8	-169.3	65.7	-178.1	4.6	112.2	E51 Y107 S108 R109 A115	E51-R111 IonicContact OE2-NH1 3.47Å; Y107-R111 HydrophobicContact CE2-CG 4.37Å; Y107-R111 WeakPolarHBondContact O-CG 3.4Å; Y107-R111 PolarHBondContact O-N 3.45Å; S108-R111 PolarHBondContact O-N 3.02Å; R109-R111 VanDerWaalsContact C-N 3.34Å; R109-R111 PolarHBondContact O-N 3.35Å; R111-A115 WeakPolarHBondContact O-CB 3.35Å; R111-A115 PolarHBondContact O-N 3.44Å
112	V	95.4	Very high	94.6	Very high	5 Å²	5	50.9 Å²	50.9	3%	0.03	26%	0.255	C	S	.	.	H	α-helix	trans	-66.2	-51.3	178.3	173.2	0	0	0	0	109.7	S108 R109 A114 A115 W116 K134 M135 A136 L138	S108-V112 WeakPolarHBondContact O-CG2 3.02Å; S108-V112 PolarHBondContact O-N 3.32Å; S108-V112 VanDerWaalsContact O-N 3.14Å; R109-V112 PolarHBondContact O-N 3.35Å; V112-A114 PolarHBondContact O-N 3.28Å; V112-A115 WeakPolarHBondContact O-CB 3.36Å; V112-A115 PolarHBondContact O-N 3.28Å; V112-A115 VanDerWaalsContact O-N 3.13Å; V112-W116 PolarHBondContact O-N 3.45Å; V112-K134 WeakPolarHBondContact CG2-O 3.3Å; V112-M135 HydrophobicContact CG1-SD 3.84Å; V112-M135 HydrophobicContact CG2-SD 4.48Å; V112-A136 HydrophobicContact CB-CB 4.41Å; V112-A136 HydrophobicContact CG2-CB 3.9Å; V112-L138 HydrophobicContact CG1-CD1 4.23Å
113	K	96.1	Very high	94.1	Very high	6 Å²	6	53.8 Å²	53.8	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-56.5	-47.3	176.9	-174.2	177.5	-178.4	-176.3	0	111.8	V84 R109 A115 W116 L117 T142 E145 I146	V84-K113 HydrophobicContact CG1-CB 3.88Å; V84-K113 HydrophobicContact CG1-CD 3.77Å; V84-K113 HydrophobicContact CG1-CG 3.75Å; V84-K113 WeakPolarHBondContact O-CE 3.48Å; V84-K113 PolarHBondContact O-NZ 2.99Å; R109-K113 WeakPolarHBondContact O-CB 3.38Å; R109-K113 PolarHBondContact O-N 3.15Å; K113-A115 VanDerWaalsContact C-N 3.31Å; K113-A115 PolarHBondContact O-N 3.17Å; K113-W116 PolarHBondContact O-N 3.32Å; K113-L117 HydrophobicContact CG-CD1 3.98Å; K113-L117 HydrophobicContact CG-CG 4.36Å; K113-L117 WeakPolarHBondContact O-CB 3.49Å; K113-L117 WeakPolarHBondContact O-CG 3.11Å; K113-L117 PolarHBondContact O-N 3.16Å; K113-T142 HydrophobicContact CD-CG2 3.69Å; K113-T142 HydrophobicContact CG-CG2 4.08Å; K113-E145 WeakPolarHBondContact CE-OE2 3.36Å; K113-E145 IonicContact NZ-OE1 3.94Å; K113-E145 IonicContact NZ-OE2 3.48Å; K113-E145 PolarHBondContact NZ-OE2 2.87Å; K113-I146 HydrophobicContact CG-CD1 4.39Å
114	A	95.8	Very high	93.8	Very high	38 Å²	38	56 Å²	56	31%	0.314	30%	0.298	S	S	.	.	H	α-helix	trans	-60.7	-38.8	177.4	0	0	0	0	0	112.6	V84 S110 V112 L117 A118	V84-A114 HydrophobicContact CG1-CB 4.18Å; V84-A114 HydrophobicContact CG2-CB 4.15Å; S110-A114 WeakPolarHBondContact O-CB 3.33Å; S110-A114 PolarHBondContact O-N 3.14Å; V112-A114 PolarHBondContact O-N 3.28Å; A114-L117 PolarHBondContact O-N 3.06Å; A114-A118 VanDerWaalsContact O-CB 3.24Å; A114-A118 WeakPolarHBondContact O-CB 3.17Å; A114-A118 PolarHBondContact O-N 3.5Å
115	A	95.3	Very high	93.5	Very high	3 Å²	3	62.4 Å²	62.4	3%	0.025	32%	0.316	C	S	.	.	H	α-helix	trans	-65.2	-42.7	177.2	0	0	0	0	0	112.1	R111 V112 K113 A118 G119 R120 Y121	R111-A115 WeakPolarHBondContact O-CB 3.35Å; R111-A115 PolarHBondContact O-N 3.44Å; V112-A115 WeakPolarHBondContact O-CB 3.36Å; V112-A115 PolarHBondContact O-N 3.28Å; V112-A115 VanDerWaalsContact O-N 3.13Å; K113-A115 VanDerWaalsContact C-N 3.31Å; K113-A115 PolarHBondContact O-N 3.17Å; A115-A118 PolarHBondContact O-N 2.85Å; A115-G119 PolarHBondContact O-N 2.88Å; A115-R120 HydrophobicContact CB-CB 4.29Å; A115-R120 VanDerWaalsContact CB-NH1 3.26Å; A115-R120 VanDerWaalsContact O-CB 3.23Å; A115-R120 WeakPolarHBondContact O-CB 3.12Å; A115-R120 PolarHBondContact O-N 2.95Å; A115-Y121 HydrophobicContact CB-CD2 4.17Å; A115-Y121 HydrophobicContact CB-CE2 3.46Å; A115-Y121 VanDerWaalsContact CB-CE2 3.46Å
116	W	95.2	Very high	93.2	Very high	33 Å²	33	57.6 Å²	57.6	13%	0.125	31%	0.305	C	S	.	.	H	α-helix	trans	-61.7	-49.5	172.8	-78.7	106	0	0	0	111.7	V112 K113 A118 G119 Y121 V124 L130 M135 W143 I146 R153	V112-W116 PolarHBondContact O-N 3.45Å; K113-W116 PolarHBondContact O-N 3.32Å; W116-A118 PolarHBondContact O-N 2.97Å; W116-G119 WeakPolarHBondContact O-CA 3.33Å; W116-G119 PolarHBondContact O-N 3.27Å; W116-Y121 AromaticContact CD1-CD2 3.83Å; W116-Y121 AromaticContact CD2-CD2 3.6Å; W116-Y121 HydrophobicContact CD2-CD2 3.6Å; W116-Y121 HydrophobicContact CD2-CG 4.22Å; W116-Y121 AromaticContact CE2-CD2 3.49Å; W116-Y121 VanDerWaalsContact CE2-CD2 3.49Å; W116-Y121 HydrophobicContact CE3-CD2 4.21Å; W116-Y121 HydrophobicContact CE3-CG 4.41Å; W116-Y121 AromaticContact CG-CD2 3.79Å; W116-Y121 HydrophobicContact CG-CD2 3.79Å; W116-Y121 HydrophobicContact CG-CE2 4.49Å; W116-Y121 HydrophobicContact CH2-CG 4.34Å; W116-Y121 AromaticContact CZ2-CD2 3.99Å; W116-Y121 HydrophobicContact CZ2-CD2 3.99Å; W116-Y121 HydrophobicContact CZ2-CG 4.16Å; W116-Y121 VanDerWaalsContact CZ3-CB 3.4Å; W116-Y121 HydrophobicContact CZ3-CG 4.47Å; W116-Y121 WeakPolarHBondContact CZ3-O 3.48Å; W116-Y121 AromaticContact NE1-CD2 3.64Å; W116-V124 HydrophobicContact CH2-CG2 4.26Å; W116-L130 HydrophobicContact CH2-CD1 4.1Å; W116-L130 HydrophobicContact CZ2-CD1 3.85Å; W116-L130 HydrophobicContact CZ2-CD2 4.41Å; W116-M135 HydrophobicContact CZ2-CE 4.39Å; W116-W143 HydrophobicContact CD2-CZ3 4.29Å; W116-W143 AromaticContact CE2-CH2 4Å; W116-W143 AromaticContact CE2-CZ3 3.96Å; W116-W143 HydrophobicContact CZ2-CH2 4.09Å; W116-W143 HydrophobicContact CZ2-CZ3 4.19Å; W116-W143 AromaticContact NE1-CH2 3.92Å; W116-I146 HydrophobicContact CB-CD1 3.82Å; W116-I146 HydrophobicContact CB-CG1 3.97Å; W116-I146 HydrophobicContact CB-CG2 3.76Å; W116-I146 HydrophobicContact CD2-CG2 4.18Å; W116-I146 HydrophobicContact CE3-CG2 4.03Å; W116-I146 HydrophobicContact CG-CD1 4Å; W116-I146 HydrophobicContact CG-CG2 4.1Å; W116-R153 PolarHBondContact O-NH2 3.32Å
117	L	95.4	Very high	92.7	Very high	61 Å²	61	61 Å²	61	32%	0.319	33%	0.334	S	S	.	.	H	α-helix	trans	-65.4	-23.8	178.8	-66.7	177.6	0	0	0	113.4	V84 K113 A114 G119 I146 A149 R153	V84-L117 HydrophobicContact CG1-CD1 4.42Å; K113-L117 HydrophobicContact CG-CD1 3.98Å; K113-L117 HydrophobicContact CG-CG 4.36Å; K113-L117 WeakPolarHBondContact O-CB 3.49Å; K113-L117 WeakPolarHBondContact O-CG 3.11Å; K113-L117 PolarHBondContact O-N 3.16Å; A114-L117 PolarHBondContact O-N 3.06Å; L117-G119 VanDerWaalsContact C-N 3.27Å; L117-I146 HydrophobicContact CD2-CG1 4.28Å; L117-A149 HydrophobicContact CD2-CB 3.62Å; L117-R153 VanDerWaalsContact C-NH2 3.29Å; L117-R153 PolarHBondContact O-NH2 3.37Å
118	A	94.6	Very high	92.5	Very high	71 Å²	71	64.1 Å²	64.1	59%	0.587	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-3.3	171.5	0	0	0	0	0	113.5	A114 A115 W116 R120	A114-A118 VanDerWaalsContact O-CB 3.24Å; A114-A118 WeakPolarHBondContact O-CB 3.17Å; A114-A118 PolarHBondContact O-N 3.5Å; A115-A118 PolarHBondContact O-N 2.85Å; W116-A118 PolarHBondContact O-N 2.97Å; A118-R120 VanDerWaalsContact C-N 3.33Å
119	G	93.9	Very high	92.2	Very high	21 Å²	21	65.6 Å²	65.6	22%	0.216	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	15	-178.7	0	0	0	0	0	114.2	A115 W116 L117 Y121 S122	A115-G119 PolarHBondContact O-N 2.88Å; W116-G119 WeakPolarHBondContact O-CA 3.33Å; W116-G119 PolarHBondContact O-N 3.27Å; L117-G119 VanDerWaalsContact C-N 3.27Å; G119-Y121 PolarHBondContact O-N 2.86Å; G119-Y121 VanDerWaalsContact O-N 3.15Å; G119-S122 WeakPolarHBondContact CA-OG 3.39Å; G119-S122 WeakPolarHBondContact O-CB 3.35Å; G119-S122 PolarHBondContact O-N 3.44Å; G119-S122 PolarHBondContact O-OG 3.49Å
120	R	92	Very high	91.9	Very high	171 Å²	171	63.9 Å²	63.9	65%	0.645	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-27	179.5	-175.5	176	-67.9	138	2.4	112.4	A115 A118	A115-R120 HydrophobicContact CB-CB 4.29Å; A115-R120 VanDerWaalsContact CB-NH1 3.26Å; A115-R120 VanDerWaalsContact O-CB 3.23Å; A115-R120 WeakPolarHBondContact O-CB 3.12Å; A115-R120 PolarHBondContact O-N 2.95Å; A118-R120 VanDerWaalsContact C-N 3.33Å
121	Y	91.8	Very high	91.3	Very high	31 Å²	31	69.9 Å²	69.9	12%	0.122	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	27.7	-178.2	-49.8	-55.9	0	0	0	111.4	A115 W116 G119 V124 L130 M135	A115-Y121 HydrophobicContact CB-CD2 4.17Å; A115-Y121 HydrophobicContact CB-CE2 3.46Å; A115-Y121 VanDerWaalsContact CB-CE2 3.46Å; W116-Y121 AromaticContact CD1-CD2 3.83Å; W116-Y121 AromaticContact CD2-CD2 3.6Å; W116-Y121 HydrophobicContact CD2-CD2 3.6Å; W116-Y121 HydrophobicContact CD2-CG 4.22Å; W116-Y121 AromaticContact CE2-CD2 3.49Å; W116-Y121 VanDerWaalsContact CE2-CD2 3.49Å; W116-Y121 HydrophobicContact CE3-CD2 4.21Å; W116-Y121 HydrophobicContact CE3-CG 4.41Å; W116-Y121 AromaticContact CG-CD2 3.79Å; W116-Y121 HydrophobicContact CG-CD2 3.79Å; W116-Y121 HydrophobicContact CG-CE2 4.49Å; W116-Y121 HydrophobicContact CH2-CG 4.34Å; W116-Y121 AromaticContact CZ2-CD2 3.99Å; W116-Y121 HydrophobicContact CZ2-CD2 3.99Å; W116-Y121 HydrophobicContact CZ2-CG 4.16Å; W116-Y121 VanDerWaalsContact CZ3-CB 3.4Å; W116-Y121 HydrophobicContact CZ3-CG 4.47Å; W116-Y121 WeakPolarHBondContact CZ3-O 3.48Å; W116-Y121 AromaticContact NE1-CD2 3.64Å; G119-Y121 PolarHBondContact O-N 2.86Å; G119-Y121 VanDerWaalsContact O-N 3.15Å; Y121-V124 WeakPolarHBondContact O-CG2 3.42Å; Y121-L130 HydrophobicContact CD1-CD2 3.74Å; Y121-L130 HydrophobicContact CE1-CD2 4.32Å; Y121-L130 HydrophobicContact CG-CD2 4.06Å; Y121-M135 HydrophobicContact CD1-CE 4.4Å; Y121-M135 HydrophobicContact CD2-CE 4.16Å; Y121-M135 HydrophobicContact CE1-CE 4.03Å; Y121-M135 HydrophobicContact CE2-CE 3.73Å; Y121-M135 HydrophobicContact CG-CE 4.46Å
122	S	90.9	Very high	90.6	Very high	48 Å²	48	67.6 Å²	67.6	34%	0.336	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	141.7	174.7	-69	0	0	0	0	110.9	G119 V124 E150	G119-S122 WeakPolarHBondContact CA-OG 3.39Å; G119-S122 WeakPolarHBondContact O-CB 3.35Å; G119-S122 PolarHBondContact O-N 3.44Å; G119-S122 PolarHBondContact O-OG 3.49Å; S122-V124 VanDerWaalsContact C-N 3.3Å; S122-V124 PolarHBondContact O-N 3.46Å; S122-E150 VanDerWaalsContact CA-OE1 3.3Å; S122-E150 WeakPolarHBondContact CA-OE1 3.47Å; S122-E150 WeakPolarHBondContact CB-OE1 3.46Å; S122-E150 VanDerWaalsContact OG-CD 3.27Å; S122-E150 PolarHBondContact OG-OE1 2.68Å; S122-E150 PolarHBondContact OG-OE2 3.48Å
123	G	86.8	Confident	90.1	Very high	61 Å²	61	69.4 Å²	69.4	63%	0.629	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	23.6	175.9	0	0	0	0	0	115.9	R125	G123-R125 WeakPolarHBondContact O-CG 3.47Å; G123-R125 PolarHBondContact O-N 3.09Å
124	V	89.3	Confident	89.6	Confident	50 Å²	50	78.6 Å²	78.6	30%	0.303	45%	0.449	S	S	.	.			trans	-56.9	124.1	176.1	169.8	0	0	0	0	110.4	W116 Y121 S122 S126 E129 L130	W116-V124 HydrophobicContact CH2-CG2 4.26Å; Y121-V124 WeakPolarHBondContact O-CG2 3.42Å; S122-V124 VanDerWaalsContact C-N 3.3Å; S122-V124 PolarHBondContact O-N 3.46Å; V124-S126 WeakPolarHBondContact CG1-O 3.37Å; V124-E129 WeakPolarHBondContact CA-OE2 3.02Å; V124-E129 HydrophobicContact CG1-CB 4.42Å; V124-L130 HydrophobicContact CG1-CD1 4.25Å; V124-L130 HydrophobicContact CG1-CD2 4.4Å; V124-L130 HydrophobicContact CG1-CG 4.13Å; V124-L130 HydrophobicContact CG2-CD2 3.81Å; V124-L130 HydrophobicContact CG2-CG 4.42Å
125	R	87.4	Confident	89.3	Confident	227 Å²	227	80.4 Å²	80.4	86%	0.857	45%	0.452	S	S	*	.			trans	-96.2	-22.2	-176.2	-59.4	-177.8	172.5	-170.8	-3.3	113.3	G123 E129	G123-R125 WeakPolarHBondContact O-CG 3.47Å; G123-R125 PolarHBondContact O-N 3.09Å; R125-E129 PolarHBondContact N-OE2 3.03Å; R125-E129 VanDerWaalsContact N-OE2 3.15Å
126	S	88.6	Confident	89.1	Confident	48 Å²	48	81.1 Å²	81.1	34%	0.336	46%	0.458	S	S	.	.	S	Bend	trans	-150.6	160.3	178.4	75.8	0	0	0	0	111.4	V124 D128 E129	V124-S126 WeakPolarHBondContact CG1-O 3.37Å; S126-D128 PolarHBondContact O-N 3.35Å; S126-D128 PolarHBondContact OG-N 3.16Å; S126-E129 PolarHBondContact O-N 3.44Å
127	A	85.1	Confident	88.9	Confident	75 Å²	75	84.9 Å²	84.9	62%	0.62	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-63.9	-24.8	175.9	0	0	0	0	0	112.8	E129 L130	A127-E129 VanDerWaalsContact C-N 3.25Å; A127-E129 PolarHBondContact O-N 3.5Å; A127-L130 WeakPolarHBondContact O-CB 3.48Å; A127-L130 PolarHBondContact O-N 3Å
128	D	89.1	Confident	88.8	Confident	116 Å²	116	82.9 Å²	82.9	62%	0.62	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-64.2	-31.5	-177.3	-63.3	-32.9	0	0	0	112.5	S126 L130 L131	S126-D128 PolarHBondContact O-N 3.35Å; S126-D128 PolarHBondContact OG-N 3.16Å; D128-L130 PolarHBondContact O-N 3.15Å; D128-L130 VanDerWaalsContact O-N 3.14Å; D128-L131 HydrophobicContact CB-CD1 4.17Å; D128-L131 WeakPolarHBondContact O-CB 3.27Å; D128-L131 PolarHBondContact O-N 3.48Å; D128-L131 VanDerWaalsContact O-N 3.16Å; D128-L131 WeakPolarHBondContact OD1-CD1 3.41Å
129	E	88.2	Confident	88.8	Confident	104 Å²	104	82.2 Å²	82.2	49%	0.486	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-62.1	-21.2	176.3	-65.6	175.2	-167.8	0	0	112.3	V124 R125 S126 A127	V124-E129 WeakPolarHBondContact CA-OE2 3.02Å; V124-E129 HydrophobicContact CG1-CB 4.42Å; R125-E129 PolarHBondContact N-OE2 3.03Å; R125-E129 VanDerWaalsContact N-OE2 3.15Å; S126-E129 PolarHBondContact O-N 3.44Å; A127-E129 VanDerWaalsContact C-N 3.25Å; A127-E129 PolarHBondContact O-N 3.5Å
130	L	88.3	Confident	88.9	Confident	34 Å²	34	85.4 Å²	85.4	18%	0.178	49%	0.487	C	S	.	.	G	3₁₀ helix	trans	-96.9	-11.5	-179.2	-57.8	-178.1	0	0	0	113.5	W116 Y121 V124 A127 D128 G132 S133 M135	W116-L130 HydrophobicContact CH2-CD1 4.1Å; W116-L130 HydrophobicContact CZ2-CD1 3.85Å; W116-L130 HydrophobicContact CZ2-CD2 4.41Å; Y121-L130 HydrophobicContact CD1-CD2 3.74Å; Y121-L130 HydrophobicContact CE1-CD2 4.32Å; Y121-L130 HydrophobicContact CG-CD2 4.06Å; V124-L130 HydrophobicContact CG1-CD1 4.25Å; V124-L130 HydrophobicContact CG1-CD2 4.4Å; V124-L130 HydrophobicContact CG1-CG 4.13Å; V124-L130 HydrophobicContact CG2-CD2 3.81Å; V124-L130 HydrophobicContact CG2-CG 4.42Å; A127-L130 WeakPolarHBondContact O-CB 3.48Å; A127-L130 PolarHBondContact O-N 3Å; D128-L130 PolarHBondContact O-N 3.15Å; D128-L130 VanDerWaalsContact O-N 3.14Å; L130-G132 PolarHBondContact O-N 3.2Å; L130-S133 WeakPolarHBondContact O-CB 3.12Å; L130-S133 PolarHBondContact O-N 3.16Å; L130-M135 HydrophobicContact CB-CE 3.88Å; L130-M135 HydrophobicContact CD1-CE 4.06Å; L130-M135 HydrophobicContact CD2-CE 3.65Å; L130-M135 HydrophobicContact CG-CE 4.05Å
131	L	82.6	Confident	89.1	Confident	135 Å²	135	82.3 Å²	82.3	71%	0.707	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-25.1	-174.4	-70.8	174.4	0	0	0	113.7	D128 S133	D128-L131 HydrophobicContact CB-CD1 4.17Å; D128-L131 WeakPolarHBondContact O-CB 3.27Å; D128-L131 PolarHBondContact O-N 3.48Å; D128-L131 VanDerWaalsContact O-N 3.16Å; D128-L131 WeakPolarHBondContact OD1-CD1 3.41Å; L131-S133 VanDerWaalsContact C-N 3.29Å
132	G	80.6	Confident	89.3	Confident	82 Å²	82	80.8 Å²	80.8	85%	0.845	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-9.3	174.6	0	0	0	0	0	114.5	L130	L130-G132 PolarHBondContact O-N 3.2Å
133	S	85.6	Confident	89.5	Confident	42 Å²	42	83.7 Å²	83.7	29%	0.294	48%	0.478	S	S	.	.	S	Bend	trans	-105.4	138.6	-174.5	-67.1	0	0	0	0	111.5	L130 L131 M135	L130-S133 WeakPolarHBondContact O-CB 3.12Å; L130-S133 PolarHBondContact O-N 3.16Å; L131-S133 VanDerWaalsContact C-N 3.29Å; S133-M135 PolarHBondContact O-N 3.03Å
134	K	85.7	Confident	89.9	Confident	199 Å²	199	82.6 Å²	82.6	87%	0.865	47%	0.466	S	S	*	.			trans	-70.6	96.2	172.2	-70.3	-176.3	-178.6	177.9	0	109.5	V112	V112-K134 WeakPolarHBondContact CG2-O 3.3Å
135	M	89.6	Confident	90.2	Very high	76 Å²	76	84 Å²	84	37%	0.374	47%	0.469	S	S	.	.			trans	-83.7	158.8	174.8	-68.7	-59.1	175.3	0	0	111.9	V112 W116 Y121 L130 S133	V112-M135 HydrophobicContact CG1-SD 3.84Å; V112-M135 HydrophobicContact CG2-SD 4.48Å; W116-M135 HydrophobicContact CZ2-CE 4.39Å; Y121-M135 HydrophobicContact CD1-CE 4.4Å; Y121-M135 HydrophobicContact CD2-CE 4.16Å; Y121-M135 HydrophobicContact CE1-CE 4.03Å; Y121-M135 HydrophobicContact CE2-CE 3.73Å; Y121-M135 HydrophobicContact CG-CE 4.46Å; L130-M135 HydrophobicContact CB-CE 3.88Å; L130-M135 HydrophobicContact CD1-CE 4.06Å; L130-M135 HydrophobicContact CD2-CE 3.65Å; L130-M135 HydrophobicContact CG-CE 4.05Å; S133-M135 PolarHBondContact O-N 3.03Å
136	A	90.1	Very high	90.6	Very high	18 Å²	18	73.7 Å²	73.7	15%	0.149	43%	0.431	C	S	.	.			trans	-135.5	145.6	177	0	0	0	0	0	108.3	V112 L138	V112-A136 HydrophobicContact CB-CB 4.41Å; V112-A136 HydrophobicContact CG2-CB 3.9Å; A136-L138 PolarHBondContact O-N 3.48Å
137	P	91.5	Very high	90.9	Very high	113 Å²	113	76.5 Å²	76.5	73%	0.734	44%	0.442	S	S	*	.			trans	-64.5	129	176.9	26.7	-33.3	0	0	0	110.3
138	L	93.9	Very high	91.4	Very high	19 Å²	19	77.7 Å²	77.7	10%	0.099	44%	0.435	C	S	.	.			trans	-113.5	147.3	173.8	-49.3	-179.8	0	0	0	108.7	R109 V112 A136 T142 W143 I146	R109-L138 HydrophobicContact CG-CD2 3.65Å; V112-L138 HydrophobicContact CG1-CD1 4.23Å; A136-L138 PolarHBondContact O-N 3.48Å; L138-T142 HydrophobicContact CB-CG2 4.01Å; L138-T142 HydrophobicContact CD1-CG2 4.02Å; L138-T142 HydrophobicContact CD2-CG2 4.18Å; L138-T142 HydrophobicContact CG-CG2 4.3Å; L138-W143 HydrophobicContact CB-CD2 4.35Å; L138-W143 HydrophobicContact CB-CG 4.42Å; L138-W143 HydrophobicContact CB-CZ2 4.31Å; L138-W143 HydrophobicContact CD1-CD2 4.25Å; L138-W143 HydrophobicContact CD1-CE3 4.37Å; L138-W143 HydrophobicContact CD1-CH2 4.06Å; L138-W143 HydrophobicContact CD1-CZ2 3.93Å; L138-W143 HydrophobicContact CD1-CZ3 4.28Å; L138-W143 HydrophobicContact CG-CZ2 4.25Å; L138-W143 PolarHBondContact O-NE1 3.38Å; L138-I146 HydrophobicContact CD1-CD1 3.5Å; L138-I146 VanDerWaalsContact CD1-CD1 3.5Å
139	D	94.4	Very high	91.7	Very high	57 Å²	57	73.6 Å²	73.6	31%	0.305	42%	0.417	S	S	.	.			trans	-83.5	171	175.8	59.9	27.4	0	0	0	112	R87 E141 T142 W143	R87-D139 IonicContact CZ-OD2 2.62Å; R87-D139 IonicContact NH1-OD2 3.18Å; R87-D139 IonicContact NH2-OD1 3.65Å; R87-D139 IonicContact NH2-OD2 3.81Å; R87-D139 PolarHBondContact NH2-OD2 3.03Å; D139-E141 VanDerWaalsContact C-N 3.26Å; D139-E141 PolarHBondContact O-N 3.32Å; D139-E141 PolarHBondContact OD1-N 2.99Å; D139-T142 PolarHBondContact O-N 3.11Å; D139-T142 VanDerWaalsContact OD1-CB 3.23Å; D139-T142 WeakPolarHBondContact OD1-CB 3.45Å; D139-T142 PolarHBondContact OD1-N 3.46Å; D139-T142 PolarHBondContact OD1-OG1 2.62Å; D139-W143 VanDerWaalsContact O-CD1 3.26Å; D139-W143 PolarHBondContact O-N 3.11Å
140	A	96.3	Very high	92	Very high	87 Å²	87	71.7 Å²	71.7	72%	0.719	41%	0.408	S	S	*	.	H	α-helix	trans	-59.1	-37.8	-176.9	0	0	0	0	0	112.7	W143 G144	A140-W143 PolarHBondContact O-N 2.99Å; A140-G144 PolarHBondContact O-N 2.99Å
141	E	95.3	Very high	92.3	Very high	106 Å²	106	75.7 Å²	75.7	50%	0.495	43%	0.429	S	S	.	.	H	α-helix	trans	-64.6	-47.2	177.9	-171.2	175.7	-175.6	0	0	110.8	R87 D139 W143 G144 E145	R87-E141 IonicContact CZ-OE2 2.97Å; R87-E141 IonicContact NE-OE2 3.6Å; R87-E141 PolarHBondContact NE-OE2 3.36Å; R87-E141 IonicContact NH1-OE2 2.72Å; R87-E141 PolarHBondContact NH1-OE2 3.13Å; D139-E141 VanDerWaalsContact C-N 3.26Å; D139-E141 PolarHBondContact O-N 3.32Å; D139-E141 PolarHBondContact OD1-N 2.99Å; E141-W143 VanDerWaalsContact C-N 3.34Å; E141-W143 PolarHBondContact O-N 3.5Å; E141-G144 WeakPolarHBondContact O-CA 3.34Å; E141-G144 PolarHBondContact O-N 3.34Å; E141-G144 VanDerWaalsContact O-N 3.08Å; E141-E145 PolarHBondContact O-N 3.2Å
142	T	95.4	Very high	92.9	Very high	0 Å²	0	74.8 Å²	74.8	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-61.9	-41.2	177.1	-55.6	0	0	0	0	112.1	K113 L138 D139 G144 E145 I146	K113-T142 HydrophobicContact CD-CG2 3.69Å; K113-T142 HydrophobicContact CG-CG2 4.08Å; L138-T142 HydrophobicContact CB-CG2 4.01Å; L138-T142 HydrophobicContact CD1-CG2 4.02Å; L138-T142 HydrophobicContact CD2-CG2 4.18Å; L138-T142 HydrophobicContact CG-CG2 4.3Å; D139-T142 PolarHBondContact O-N 3.11Å; D139-T142 VanDerWaalsContact OD1-CB 3.23Å; D139-T142 WeakPolarHBondContact OD1-CB 3.45Å; D139-T142 PolarHBondContact OD1-N 3.46Å; D139-T142 PolarHBondContact OD1-OG1 2.62Å; T142-G144 VanDerWaalsContact C-N 3.31Å; T142-E145 PolarHBondContact O-N 3.19Å; T142-I146 HydrophobicContact CG2-CD1 4.2Å; T142-I146 WeakPolarHBondContact O-CG1 3.41Å; T142-I146 PolarHBondContact O-N 2.72Å; T142-I146 VanDerWaalsContact O-N 3.11Å
143	W	95.6	Very high	93.3	Very high	109 Å²	109	79.1 Å²	79.1	41%	0.413	42%	0.416	S	S	.	.	H	α-helix	trans	-64.9	-36.3	174.1	-79	120.6	0	0	0	112.2	W116 L138 D139 A140 E141 I146 L147	W116-W143 HydrophobicContact CD2-CZ3 4.29Å; W116-W143 AromaticContact CE2-CH2 4Å; W116-W143 AromaticContact CE2-CZ3 3.96Å; W116-W143 HydrophobicContact CZ2-CH2 4.09Å; W116-W143 HydrophobicContact CZ2-CZ3 4.19Å; W116-W143 AromaticContact NE1-CH2 3.92Å; L138-W143 HydrophobicContact CB-CD2 4.35Å; L138-W143 HydrophobicContact CB-CG 4.42Å; L138-W143 HydrophobicContact CB-CZ2 4.31Å; L138-W143 HydrophobicContact CD1-CD2 4.25Å; L138-W143 HydrophobicContact CD1-CE3 4.37Å; L138-W143 HydrophobicContact CD1-CH2 4.06Å; L138-W143 HydrophobicContact CD1-CZ2 3.93Å; L138-W143 HydrophobicContact CD1-CZ3 4.28Å; L138-W143 HydrophobicContact CG-CZ2 4.25Å; L138-W143 PolarHBondContact O-NE1 3.38Å; D139-W143 VanDerWaalsContact O-CD1 3.26Å; D139-W143 PolarHBondContact O-N 3.11Å; A140-W143 PolarHBondContact O-N 2.99Å; E141-W143 VanDerWaalsContact C-N 3.34Å; E141-W143 PolarHBondContact O-N 3.5Å; W143-I146 HydrophobicContact CE3-CB 4.48Å; W143-I146 HydrophobicContact CE3-CD1 4.08Å; W143-I146 HydrophobicContact CE3-CG2 4.42Å; W143-I146 HydrophobicContact CZ3-CD1 4.24Å; W143-I146 HydrophobicContact CZ3-CG2 4.49Å; W143-I146 PolarHBondContact O-N 3.35Å; W143-L147 WeakPolarHBondContact O-CB 3.43Å; W143-L147 PolarHBondContact O-N 3.25Å
144	G	96.1	Very high	93.7	Very high	38 Å²	38	81 Å²	81	39%	0.392	42%	0.422	S	S	.	.	H	α-helix	trans	-60.3	-45	173.7	0	0	0	0	0	112.5	A140 E141 T142 I146 L147 Q148	A140-G144 PolarHBondContact O-N 2.99Å; E141-G144 WeakPolarHBondContact O-CA 3.34Å; E141-G144 PolarHBondContact O-N 3.34Å; E141-G144 VanDerWaalsContact O-N 3.08Å; T142-G144 VanDerWaalsContact C-N 3.31Å; G144-I146 PolarHBondContact O-N 2.77Å; G144-L147 PolarHBondContact O-N 2.97Å; G144-Q148 WeakPolarHBondContact O-CB 3.41Å; G144-Q148 PolarHBondContact O-N 2.96Å
145	E	94.9	Very high	94.1	Very high	79 Å²	79	74.7 Å²	74.7	37%	0.369	40%	0.398	S	S	.	.	H	α-helix	trans	-61.2	-44	174.9	-66.9	177.6	-163.1	0	0	112.4	K113 E141 T142 Q148 A149	K113-E145 WeakPolarHBondContact CE-OE2 3.36Å; K113-E145 IonicContact NZ-OE1 3.94Å; K113-E145 IonicContact NZ-OE2 3.48Å; K113-E145 PolarHBondContact NZ-OE2 2.87Å; E141-E145 PolarHBondContact O-N 3.2Å; T142-E145 PolarHBondContact O-N 3.19Å; E145-Q148 PolarHBondContact O-N 3.28Å; E145-A149 WeakPolarHBondContact O-CB 3.41Å; E145-A149 PolarHBondContact O-N 3.4Å
146	I	95.6	Very high	94.4	Very high	11 Å²	11	74.7 Å²	74.7	6%	0.056	40%	0.4	C	S	.	.	H	α-helix	trans	-64	-44.9	178.3	-71.2	166	0	0	0	110.8	K113 W116 L117 L138 T142 W143 G144 A149 E150	K113-I146 HydrophobicContact CG-CD1 4.39Å; W116-I146 HydrophobicContact CB-CD1 3.82Å; W116-I146 HydrophobicContact CB-CG1 3.97Å; W116-I146 HydrophobicContact CB-CG2 3.76Å; W116-I146 HydrophobicContact CD2-CG2 4.18Å; W116-I146 HydrophobicContact CE3-CG2 4.03Å; W116-I146 HydrophobicContact CG-CD1 4Å; W116-I146 HydrophobicContact CG-CG2 4.1Å; L117-I146 HydrophobicContact CD2-CG1 4.28Å; L138-I146 HydrophobicContact CD1-CD1 3.5Å; L138-I146 VanDerWaalsContact CD1-CD1 3.5Å; T142-I146 HydrophobicContact CG2-CD1 4.2Å; T142-I146 WeakPolarHBondContact O-CG1 3.41Å; T142-I146 PolarHBondContact O-N 2.72Å; T142-I146 VanDerWaalsContact O-N 3.11Å; W143-I146 HydrophobicContact CE3-CB 4.48Å; W143-I146 HydrophobicContact CE3-CD1 4.08Å; W143-I146 HydrophobicContact CE3-CG2 4.42Å; W143-I146 HydrophobicContact CZ3-CD1 4.24Å; W143-I146 HydrophobicContact CZ3-CG2 4.49Å; W143-I146 PolarHBondContact O-N 3.35Å; G144-I146 PolarHBondContact O-N 2.77Å; I146-A149 PolarHBondContact O-N 3.02Å; I146-E150 PolarHBondContact O-N 3.08Å
147	L	95.2	Very high	94.6	Very high	107 Å²	107	78 Å²	78	56%	0.56	41%	0.414	S	S	*	.	H	α-helix	trans	-61.4	-45.4	178.7	177.6	62.5	0	0	0	110.9	W143 G144 A149 E150 L151	W143-L147 WeakPolarHBondContact O-CB 3.43Å; W143-L147 PolarHBondContact O-N 3.25Å; G144-L147 PolarHBondContact O-N 2.97Å; L147-A149 VanDerWaalsContact C-N 3.35Å; L147-A149 PolarHBondContact O-N 3.39Å; L147-E150 PolarHBondContact O-N 3.41Å; L147-E150 VanDerWaalsContact O-N 3.16Å; L147-L151 HydrophobicContact CD1-CG 4.46Å; L147-L151 HydrophobicContact CG-CD1 4.29Å; L147-L151 WeakPolarHBondContact O-CG 3.35Å; L147-L151 PolarHBondContact O-N 2.94Å
148	Q	96.1	Very high	94.8	Very high	100 Å²	100	75.8 Å²	75.8	47%	0.467	39%	0.394	S	S	.	.	H	α-helix	trans	-60.3	-46.7	177	-172.7	60.1	54.5	0	0	111.2	G144 E145 E150 L151 D152	G144-Q148 WeakPolarHBondContact O-CB 3.41Å; G144-Q148 PolarHBondContact O-N 2.96Å; E145-Q148 PolarHBondContact O-N 3.28Å; Q148-E150 PolarHBondContact O-N 2.68Å; Q148-L151 PolarHBondContact O-N 2.92Å; Q148-L151 VanDerWaalsContact O-N 3.15Å; Q148-D152 PolarHBondContact NE2-OD1 2.66Å; Q148-D152 PolarHBondContact NE2-OD2 2.84Å; Q148-D152 VanDerWaalsContact O-CG 3.25Å; Q148-D152 PolarHBondContact O-N 3.45Å
149	A	95.3	Very high	94.9	Very high	30 Å²	30	79.6 Å²	79.6	25%	0.248	41%	0.414	C	S	.	.	H	α-helix	trans	-61.2	-27.1	177.4	0	0	0	0	0	113.4	L117 E145 I146 L147 R153	L117-A149 HydrophobicContact CD2-CB 3.62Å; E145-A149 WeakPolarHBondContact O-CB 3.41Å; E145-A149 PolarHBondContact O-N 3.4Å; I146-A149 PolarHBondContact O-N 3.02Å; L147-A149 VanDerWaalsContact C-N 3.35Å; L147-A149 PolarHBondContact O-N 3.39Å; A149-R153 WeakPolarHBondContact O-CG 3.23Å
150	E	94.5	Very high	94.9	Very high	64 Å²	64	81.2 Å²	81.2	30%	0.299	42%	0.422	S	S	.	.	H	α-helix	trans	-80.6	-36	175.7	-170	66.6	-178.2	0	0	112.4	S122 I146 L147 Q148 D152 R153	S122-E150 VanDerWaalsContact CA-OE1 3.3Å; S122-E150 WeakPolarHBondContact CA-OE1 3.47Å; S122-E150 WeakPolarHBondContact CB-OE1 3.46Å; S122-E150 VanDerWaalsContact OG-CD 3.27Å; S122-E150 PolarHBondContact OG-OE1 2.68Å; S122-E150 PolarHBondContact OG-OE2 3.48Å; I146-E150 PolarHBondContact O-N 3.08Å; L147-E150 PolarHBondContact O-N 3.41Å; L147-E150 VanDerWaalsContact O-N 3.16Å; Q148-E150 PolarHBondContact O-N 2.68Å; E150-D152 VanDerWaalsContact C-N 3.29Å; E150-D152 PolarHBondContact O-N 2.97Å; E150-R153 PolarHBondContact O-N 3.23Å; E150-R153 IonicContact OE2-CZ 3.26Å; E150-R153 IonicContact OE2-NE 3.69Å; E150-R153 PolarHBondContact OE2-NE 3.47Å
151	L	94.1	Very high	94.8	Very high	118 Å²	118	80.8 Å²	80.8	62%	0.618	40%	0.399	S	S	*	.	H	α-helix	trans	-67.9	-29.8	174.6	-69.1	173.4	0	0	0	112.7	L147 Q148 R153	L147-L151 HydrophobicContact CD1-CG 4.46Å; L147-L151 HydrophobicContact CG-CD1 4.29Å; L147-L151 WeakPolarHBondContact O-CG 3.35Å; L147-L151 PolarHBondContact O-N 2.94Å; Q148-L151 PolarHBondContact O-N 2.92Å; Q148-L151 VanDerWaalsContact O-N 3.15Å; L151-R153 VanDerWaalsContact C-N 3.31Å
152	D	94.7	Very high	94.7	Very high	116 Å²	116	78.7 Å²	78.7	62%	0.62	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-2.3	-178.9	-66.1	-22.5	0	0	0	113.9	Q148 E150	Q148-D152 PolarHBondContact NE2-OD1 2.66Å; Q148-D152 PolarHBondContact NE2-OD2 2.84Å; Q148-D152 VanDerWaalsContact O-CG 3.25Å; Q148-D152 PolarHBondContact O-N 3.45Å; E150-D152 VanDerWaalsContact C-N 3.29Å; E150-D152 PolarHBondContact O-N 2.97Å
153	R	89.6	Confident	94.7	Very high	172 Å²	172	85.8 Å²	85.8	65%	0.649	43%	0.427	S	S	*	.			trans	-80.5	0	177.2	-71.3	-175.7	-158.6	-71.1	-9.9	112.7	W116 L117 A149 E150 L151	W116-R153 PolarHBondContact O-NH2 3.32Å; L117-R153 VanDerWaalsContact C-NH2 3.29Å; L117-R153 PolarHBondContact O-NH2 3.37Å; A149-R153 WeakPolarHBondContact O-CG 3.23Å; E150-R153 PolarHBondContact O-N 3.23Å; E150-R153 IonicContact OE2-CZ 3.26Å; E150-R153 IonicContact OE2-NE 3.69Å; E150-R153 PolarHBondContact OE2-NE 3.47Å; L151-R153 VanDerWaalsContact C-N 3.31Å

Retrieved 153 of 153 residues in 322.8 ms (Link to these results)

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