A0A096LVF7_POEFO Loading...

Annexin

AlphaFold DB , UniProt , Accession A0A096LVF7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 338 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	46.9	Very low	44	Very low	222 Å²	222	111 Å²	111	100%	1.094	61%	0.61	S	S	*	*				0	-15.3	0	-71.7	-141	-78.3	0	0	114.4
2	A	54.3	Low	43.4	Very low	78 Å²	78	108 Å²	108	65%	0.645	60%	0.603	S	S	*	*	H	α-helix	trans	-76.8	-37.8	179.4	0	0	0	0	0	114.8	V4 S5 E6	A2-V4 VanDerWaalsContact C-N 3.34Å; A2-V4 PolarHBondContact O-N 3.21Å; A2-S5 WeakPolarHBondContact O-CB 3.44Å; A2-S5 PolarHBondContact O-N 3.36Å; A2-E6 PolarHBondContact O-N 3.07Å
3	L	42	Very low	43	Very low	128 Å²	128	110 Å²	110	67%	0.67	61%	0.611	S	S	*	*	H	α-helix	trans	-66.6	-30.3	-178.2	-105.1	150	0	0	0	114.3	F7	L3-F7 PolarHBondContact O-N 2.84Å
4	V	48.8	Very low	42.3	Very low	97 Å²	97	112.1 Å²	112.1	59%	0.588	62%	0.62	S	S	*	*	H	α-helix	trans	-76.1	-32.4	176.6	-176.8	0	0	0	0	110.8	A2 L8	A2-V4 VanDerWaalsContact C-N 3.34Å; A2-V4 PolarHBondContact O-N 3.21Å; V4-L8 HydrophobicContact CG1-CD1 3.88Å; V4-L8 HydrophobicContact CG1-CG 4.3Å; V4-L8 VanDerWaalsContact O-CB 3.24Å; V4-L8 WeakPolarHBondContact O-CB 3.24Å; V4-L8 WeakPolarHBondContact O-CG 3.19Å; V4-L8 PolarHBondContact O-N 3.03Å
5	S	48.2	Very low	41.7	Very low	84 Å²	84	111.9 Å²	111.9	59%	0.587	62%	0.623	S	S	*	*	H	α-helix	trans	-68.2	-36.8	172.3	176.8	0	0	0	0	112	A2 G9	A2-S5 WeakPolarHBondContact O-CB 3.44Å; A2-S5 PolarHBondContact O-N 3.36Å; S5-G9 PolarHBondContact O-N 3.39Å
6	E	46.7	Very low	41.2	Very low	127 Å²	127	109.7 Å²	109.7	59%	0.593	62%	0.624	S	S	*	*	H	α-helix	trans	-69.6	-41.4	175.1	-114.5	173.4	169.9	0	0	111.6	A2 G9 Q10	A2-E6 PolarHBondContact O-N 3.07Å; E6-G9 PolarHBondContact O-N 2.88Å; E6-Q10 WeakPolarHBondContact O-CG 3.48Å; E6-Q10 PolarHBondContact O-N 3.32Å
7	F	41.3	Very low	41	Very low	125 Å²	125	108.7 Å²	108.7	55%	0.548	62%	0.62	S	S	.	*	H	α-helix	trans	-70	-36.2	174.8	-115.1	-90	0	0	0	112.9	L3 Q10 L11	L3-F7 PolarHBondContact O-N 2.84Å; F7-Q10 CarbonylContact O-C 3.58Å; F7-Q10 PolarHBondContact O-N 3.34Å; F7-L11 HydrophobicContact CD1-CD1 4.32Å; F7-L11 WeakPolarHBondContact O-CB 3.41Å; F7-L11 WeakPolarHBondContact O-CD1 3.44Å; F7-L11 VanDerWaalsContact O-CG 3.32Å; F7-L11 WeakPolarHBondContact O-CG 3.33Å; F7-L11 PolarHBondContact O-N 2.97Å
8	L	42.1	Very low	41.1	Very low	105 Å²	105	110.3 Å²	110.3	55%	0.55	62%	0.622	S	S	.	*	H	α-helix	trans	-70	-34.4	173.6	-74.2	169.6	0	0	0	111.7	V4 Q10 L11 S12	V4-L8 HydrophobicContact CG1-CD1 3.88Å; V4-L8 HydrophobicContact CG1-CG 4.3Å; V4-L8 VanDerWaalsContact O-CB 3.24Å; V4-L8 WeakPolarHBondContact O-CB 3.24Å; V4-L8 WeakPolarHBondContact O-CG 3.19Å; V4-L8 PolarHBondContact O-N 3.03Å; L8-Q10 VanDerWaalsContact C-N 3.33Å; L8-L11 PolarHBondContact O-N 2.93Å; L8-S12 WeakPolarHBondContact O-CB 3.32Å; L8-S12 PolarHBondContact O-N 2.8Å; L8-S12 PolarHBondContact O-OG 2.9Å
9	G	40	Very low	41.9	Very low	33 Å²	33	110.8 Å²	110.8	34%	0.34	62%	0.618	S	S	.	*	H	α-helix	trans	-63.3	-36.8	170	0	0	0	0	0	113	S5 E6 S12	S5-G9 PolarHBondContact O-N 3.39Å; E6-G9 PolarHBondContact O-N 2.88Å; G9-S12 WeakPolarHBondContact CA-OG 3.43Å; G9-S12 PolarHBondContact O-OG 3Å
10	Q	38.1	Very low	43.1	Very low	118 Å²	118	110.6 Å²	110.6	55%	0.551	61%	0.612	S	S	*	*	H	α-helix	trans	-78.4	-28.2	173.9	-72	-178.8	-7.9	0	0	113.6	E6 F7 L8 L13	E6-Q10 WeakPolarHBondContact O-CG 3.48Å; E6-Q10 PolarHBondContact O-N 3.32Å; F7-Q10 CarbonylContact O-C 3.58Å; F7-Q10 PolarHBondContact O-N 3.34Å; L8-Q10 VanDerWaalsContact C-N 3.33Å; Q10-L13 WeakPolarHBondContact O-CB 3.33Å; Q10-L13 PolarHBondContact O-N 3.14Å
11	L	35.5	Very low	44.8	Very low	104 Å²	104	109.4 Å²	109.4	55%	0.545	61%	0.609	S	S	.	*	H	α-helix	trans	-77	-27.3	172.9	-78.8	158.5	0	0	0	112.1	F7 L8 L13 N14	F7-L11 HydrophobicContact CD1-CD1 4.32Å; F7-L11 WeakPolarHBondContact O-CB 3.41Å; F7-L11 WeakPolarHBondContact O-CD1 3.44Å; F7-L11 VanDerWaalsContact O-CG 3.32Å; F7-L11 WeakPolarHBondContact O-CG 3.33Å; F7-L11 PolarHBondContact O-N 2.97Å; L8-L11 PolarHBondContact O-N 2.93Å; L11-L13 VanDerWaalsContact C-N 3.26Å; L11-L13 PolarHBondContact O-N 3.12Å; L11-N14 PolarHBondContact O-N 2.98Å
12	S	36.6	Very low	46.7	Very low	75 Å²	75	104.5 Å²	104.5	52%	0.524	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-73.3	-13.3	169.8	51.3	0	0	0	0	114.1	L8 G9 N14	L8-S12 WeakPolarHBondContact O-CB 3.32Å; L8-S12 PolarHBondContact O-N 2.8Å; L8-S12 PolarHBondContact O-OG 2.9Å; G9-S12 WeakPolarHBondContact CA-OG 3.43Å; G9-S12 PolarHBondContact O-OG 3Å; S12-N14 PolarHBondContact O-N 2.96Å
13	L	38.7	Very low	48.6	Very low	134 Å²	134	105.1 Å²	105.1	70%	0.702	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-77.3	-4.2	172	-84.7	159	0	0	0	113.4	Q10 L11	Q10-L13 WeakPolarHBondContact O-CB 3.33Å; Q10-L13 PolarHBondContact O-N 3.14Å; L11-L13 VanDerWaalsContact C-N 3.26Å; L11-L13 PolarHBondContact O-N 3.12Å
14	N	33	Very low	51.3	Low	140 Å²	140	100.7 Å²	100.7	75%	0.749	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-105.4	4.8	175.1	-78.3	-17.2	0	0	0	114.2	L11 S12 A16	L11-N14 PolarHBondContact O-N 2.98Å; S12-N14 PolarHBondContact O-N 2.96Å; N14-A16 PolarHBondContact O-N 2.8Å
15	V	33	Very low	53.6	Low	108 Å²	108	97.8 Å²	97.8	66%	0.655	54%	0.535	S	S	*	.	S	Bend	trans	-82.2	87.2	152.2	-175.6	0	0	0	0	104.7	T17	V15-T17 PolarHBondContact O-N 3.35Å
16	A	34.7	Very low	55.9	Low	77 Å²	77	94.2 Å²	94.2	64%	0.636	51%	0.509	S	S	*	.			trans	-56.6	92.4	163.5	0	0	0	0	0	106.8	N14 Q18	N14-A16 PolarHBondContact O-N 2.8Å; A16-Q18 VanDerWaalsContact C-N 3.3Å; A16-Q18 PolarHBondContact O-N 3.46Å
17	T	37.1	Very low	58.3	Low	93 Å²	93	92.1 Å²	92.1	57%	0.571	51%	0.505	S	S	*	.			trans	-54.2	112.4	146.9	47.9	0	0	0	0	103.3	V15 H19	V15-T17 PolarHBondContact O-N 3.35Å; T17-H19 WeakPolarHBondContact CB-NE2 3.48Å; T17-H19 PolarHBondContact O-N 3.41Å; T17-H19 PolarHBondContact OG1-CD2 3.37Å; T17-H19 PolarHBondContact OG1-NE2 3Å
18	Q	43.7	Very low	60.9	Low	137 Å²	137	90.1 Å²	90.1	64%	0.64	51%	0.505	S	S	*	.			trans	-70.2	58.8	-178.5	-67.5	-175.5	-11.9	0	0	108.9	A16 E20	A16-Q18 VanDerWaalsContact C-N 3.3Å; A16-Q18 PolarHBondContact O-N 3.46Å; Q18-E20 PolarHBondContact O-N 3.41Å
19	H	56.1	Low	63.4	Low	121 Å²	121	87.6 Å²	87.6	56%	0.56	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-65.8	125.4	168.5	-67.8	-61.9	0	0	0	106.8	T17 D137	T17-H19 WeakPolarHBondContact CB-NE2 3.48Å; T17-H19 PolarHBondContact O-N 3.41Å; T17-H19 PolarHBondContact OG1-CD2 3.37Å; T17-H19 PolarHBondContact OG1-NE2 3Å; H19-D137 IonicContact CE1-OD2 3.73Å; H19-D137 PolarHBondContact CE1-OD2 2.81Å; H19-D137 VanDerWaalsContact CE1-OD2 3.26Å; H19-D137 IonicContact ND1-OD2 2.77Å
20	E	65.8	Low	66	Low	106 Å²	106	97.4 Å²	97.4	50%	0.495	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-52.8	133.4	175.9	-76.4	-176.4	155.8	0	0	109.2	Q18 L22	Q18-E20 PolarHBondContact O-N 3.41Å; E20-L22 PolarHBondContact O-N 2.79Å
21	P	77.6	Confident	68.6	Low	85 Å²	85	98.5 Å²	98.5	55%	0.552	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-58.8	129.9	-180	20.4	-29.3	0	0	0	109.9	Y23	P21-Y23 HydrophobicContact CB-CE2 4.02Å; P21-Y23 HydrophobicContact CG-CE2 3.77Å; P21-Y23 WeakPolarHBondContact O-CD2 3.45Å; P21-Y23 WeakPolarHBondContact O-CE2 3.42Å
22	L	87.2	Confident	71.5	Confident	120 Å²	120	95.6 Å²	95.6	63%	0.628	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-73.5	137.8	175.5	-58	-178.4	0	0	0	109.6	E20 P24 V297	E20-L22 PolarHBondContact O-N 2.79Å; L22-P24 WeakPolarHBondContact O-CD 3.32Å; L22-V297 CarbonylContact C-O 3.49Å; L22-V297 WeakPolarHBondContact CA-O 3.26Å; L22-V297 HydrophobicContact CD2-CG1 4.06Å
23	Y	95.4	Very high	74.5	Confident	90 Å²	90	95.1 Å²	95.1	35%	0.353	50%	0.504	S	S	.	.			trans	-123.1	62.2	174.3	-61.7	-86.3	0	0	0	110.6	P21 V297 D298 L299 K300 K301	P21-Y23 HydrophobicContact CB-CE2 4.02Å; P21-Y23 HydrophobicContact CG-CE2 3.77Å; P21-Y23 WeakPolarHBondContact O-CD2 3.45Å; P21-Y23 WeakPolarHBondContact O-CE2 3.42Å; Y23-V297 CarbonylContact C-O 3.35Å; Y23-V297 PolarHBondContact N-O 2.92Å; Y23-D298 CarbonylContact O-C 3.23Å; Y23-D298 VanDerWaalsContact O-C 3.23Å; Y23-D298 VanDerWaalsContact O-CA 3.24Å; Y23-D298 WeakPolarHBondContact O-CA 3.49Å; Y23-L299 PolarHBondContact O-N 3.38Å; Y23-K300 WeakPolarHBondContact O-CB 3.4Å; Y23-K300 PolarHBondContact O-N 3.12Å; Y23-K301 HydrophobicContact CD1-CD 4.46Å; Y23-K301 HydrophobicContact CD1-CG 3.99Å; Y23-K301 HydrophobicContact CD2-CD 4.27Å; Y23-K301 HydrophobicContact CD2-CG 3.39Å; Y23-K301 VanDerWaalsContact CE1-CE 3.47Å; Y23-K301 HydrophobicContact CE2-CD 4.41Å; Y23-K301 HydrophobicContact CE2-CG 3.98Å; Y23-K301 HydrophobicContact CG-CD 4.29Å; Y23-K301 HydrophobicContact CG-CG 3.39Å; Y23-K301 VanDerWaalsContact CZ-CE 3.4Å
24	P	97.1	Very high	77.3	Confident	35 Å²	35	90.1 Å²	90.1	23%	0.227	48%	0.48	C	S	.	.			trans	-71	154.8	-178.5	32	-37.6	0	0	0	111.6	L22 V26 V27 C295	L22-P24 WeakPolarHBondContact O-CD 3.32Å; P24-V26 WeakPolarHBondContact CB-O 3.15Å; P24-V27 HydrophobicContact CB-CG1 4.25Å; P24-V27 HydrophobicContact CG-CG1 3.6Å; P24-C295 WeakPolarHBondContact CA-O 3.42Å; P24-C295 WeakPolarHBondContact CB-O 3.37Å
25	T	97.8	Very high	80.4	Confident	37 Å²	37	87 Å²	87	23%	0.227	46%	0.464	C	S	.	.	S	Bend	trans	-95.4	-27.8	165.4	50.2	0	0	0	0	111.3	C295 L299 K300 L333 C334	T25-C295 PolarHBondContact N-O 3.26Å; T25-C295 PolarHBondContact OG1-O 3.44Å; T25-L299 HydrophobicContact CG2-CB 3.99Å; T25-L299 HydrophobicContact CG2-CD2 4.36Å; T25-L299 HydrophobicContact CG2-CG 4.06Å; T25-K300 HydrophobicContact CG2-CB 3.97Å; T25-L333 WeakPolarHBondContact CB-O 3.39Å; T25-L333 PolarHBondContact OG1-O 3.47Å; T25-C334 WeakPolarHBondContact CG2-O 3.37Å
26	V	97.5	Very high	83.5	Confident	8 Å²	8	87.8 Å²	87.8	5%	0.048	46%	0.455	C	S	.	.	S	Bend	trans	-102.6	116.7	174.2	-179	0	0	0	0	109	P24 T60 C295 E296 L333	P24-V26 WeakPolarHBondContact CB-O 3.15Å; V26-T60 WeakPolarHBondContact CG2-O 3.43Å; V26-C295 HydrophobicContact CG2-CB 3.97Å; V26-C295 PolarHBondContact N-O 3.47Å; V26-E296 HydrophobicContact CB-CG 3.93Å; V26-E296 HydrophobicContact CG1-CG 4.12Å; V26-L333 HydrophobicContact CG2-CD2 3.8Å
27	V	95.8	Very high	86.6	Confident	83 Å²	83	84.1 Å²	84.1	50%	0.503	43%	0.425	S	S	.	.			trans	-123.3	156.8	178.9	-68.4	0	0	0	0	110.5	P24 V29	P24-V27 HydrophobicContact CB-CG1 4.25Å; P24-V27 HydrophobicContact CG-CG1 3.6Å; V27-V29 PolarHBondContact O-N 3.46Å
28	P	95.9	Very high	89.5	Confident	83 Å²	83	79.7 Å²	79.7	54%	0.539	40%	0.397	S	S	.	.			trans	-56.5	128.7	173.9	-24	33.4	0	0	0	112.1
29	V	95.8	Very high	92.1	Very high	53 Å²	53	74.2 Å²	74.2	32%	0.321	38%	0.376	S	S	.	.			trans	-74.7	135.7	172.5	176.6	0	0	0	0	109.7	V27 F32 K61 Q66	V27-V29 PolarHBondContact O-N 3.46Å; V29-F32 WeakPolarHBondContact O-CB 3.39Å; V29-K61 VanDerWaalsContact CG2-O 3.27Å; V29-K61 WeakPolarHBondContact CG2-O 3.4Å; V29-Q66 VanDerWaalsContact N-NE2 3.15Å; V29-Q66 PolarHBondContact O-NE2 3.12Å
30	R	93.2	Very high	94.1	Very high	239 Å²	239	73 Å²	73	90%	0.902	37%	0.366	S	S	*	.	S	Bend	trans	-71.2	-50.7	-176.9	-66.6	-177.5	179.1	176.8	-1.1	112.9	F32	R30-F32 PolarHBondContact O-N 3.32Å
31	D	93.1	Very high	95.7	Very high	141 Å²	141	68 Å²	68	75%	0.754	34%	0.343	S	S	*	.	S	Bend	trans	-87.4	53.4	-179.2	-53.6	-44.3	0	0	0	111.2	R36	D31-R36 PolarHBondContact O-NH2 3.46Å
32	F	97.5	Very high	96.7	Very high	42 Å²	42	65.2 Å²	65.2	18%	0.184	32%	0.322	C	S	.	.			trans	-81	129.8	-175.6	173.1	-119.9	0	0	0	111.6	V29 R30 P34 Q66 E69 I70	V29-F32 WeakPolarHBondContact O-CB 3.39Å; R30-F32 PolarHBondContact O-N 3.32Å; F32-P34 HydrophobicContact CE1-CB 3.97Å; F32-P34 HydrophobicContact CE1-CG 4.15Å; F32-P34 HydrophobicContact CE2-CB 4.33Å; F32-P34 HydrophobicContact CZ-CB 3.6Å; F32-P34 HydrophobicContact CZ-CG 4.26Å; F32-Q66 VanDerWaalsContact CB-NE2 3.34Å; F32-Q66 HydrophobicContact CD1-CB 4.39Å; F32-Q66 HydrophobicContact CD1-CG 3.8Å; F32-Q66 HydrophobicContact CD2-CB 4.28Å; F32-Q66 HydrophobicContact CD2-CG 4.21Å; F32-Q66 HydrophobicContact CE1-CB 3.99Å; F32-Q66 HydrophobicContact CE1-CG 3.83Å; F32-Q66 HydrophobicContact CE2-CB 3.91Å; F32-Q66 HydrophobicContact CE2-CG 4.27Å; F32-Q66 HydrophobicContact CG-CG 3.99Å; F32-Q66 HydrophobicContact CZ-CB 3.73Å; F32-Q66 HydrophobicContact CZ-CG 4.06Å; F32-Q66 WeakPolarHBondContact CZ-O 3.49Å; F32-E69 HydrophobicContact CE1-CB 3.9Å; F32-E69 HydrophobicContact CE1-CG 4.5Å; F32-E69 WeakPolarHBondContact CE1-OE2 3.49Å; F32-E69 HydrophobicContact CZ-CB 3.97Å; F32-I70 HydrophobicContact CE2-CD1 3.95Å; F32-I70 HydrophobicContact CE2-CG1 3.76Å; F32-I70 HydrophobicContact CZ-CD1 4.41Å; F32-I70 HydrophobicContact CZ-CG1 3.84Å
33	D	98.1	Very high	97.2	Very high	65 Å²	65	63.8 Å²	63.8	35%	0.348	32%	0.318	S	S	.	.			trans	-129.8	103.6	175	178.5	-18.3	0	0	0	108.1	D35 R36 D37	D33-D35 VanDerWaalsContact C-N 3.31Å; D33-D35 PolarHBondContact O-N 2.88Å; D33-D35 WeakPolarHBondContact OD1-CB 3.27Å; D33-D35 PolarHBondContact OD1-N 2.98Å; D33-R36 HydrophobicContact CB-CB 3.9Å; D33-R36 VanDerWaalsContact CG-CB 3.46Å; D33-R36 PolarHBondContact O-N 2.87Å; D33-R36 PolarHBondContact OD1-N 3.36Å; D33-R36 WeakPolarHBondContact OD2-CB 2.89Å; D33-D37 PolarHBondContact O-N 3.29Å; D33-D37 VanDerWaalsContact O-N 3.12Å
34	P	98.1	Very high	97.4	Very high	30 Å²	30	59.5 Å²	59.5	20%	0.195	30%	0.302	C	S	.	.	H	α-helix	trans	-65.4	-33.6	-178.2	24.1	-31.9	0	0	0	112.5	F32 A38 E69 A73	F32-P34 HydrophobicContact CE1-CB 3.97Å; F32-P34 HydrophobicContact CE1-CG 4.15Å; F32-P34 HydrophobicContact CE2-CB 4.33Å; F32-P34 HydrophobicContact CZ-CB 3.6Å; F32-P34 HydrophobicContact CZ-CG 4.26Å; P34-A38 WeakPolarHBondContact O-CB 3.48Å; P34-A38 PolarHBondContact O-N 3.04Å; P34-E69 HydrophobicContact CB-CB 4.04Å; P34-A73 HydrophobicContact CB-CB 4.19Å
35	D	98.4	Very high	97.4	Very high	75 Å²	75	59.2 Å²	59.2	40%	0.401	30%	0.298	S	S	.	.	H	α-helix	trans	-69.1	-41.6	-179.9	-85.2	-67.8	0	0	0	111.2	D33 A39 R77	D33-D35 VanDerWaalsContact C-N 3.31Å; D33-D35 PolarHBondContact O-N 2.88Å; D33-D35 WeakPolarHBondContact OD1-CB 3.27Å; D33-D35 PolarHBondContact OD1-N 2.98Å; D35-A39 WeakPolarHBondContact O-CB 3.27Å; D35-A39 PolarHBondContact O-N 3.42Å; D35-R77 PolarHBondContact O-NH2 3.32Å; D35-R77 IonicContact OD1-NH2 3.66Å
36	R	98.3	Very high	97.4	Very high	124 Å²	124	64.4 Å²	64.4	47%	0.468	32%	0.318	S	S	.	.	H	α-helix	trans	-63.7	-47.5	174.7	-177.3	-177.2	67.5	-168.4	-7.2	111.5	D31 D33 A39 R40	D31-R36 PolarHBondContact O-NH2 3.46Å; D33-R36 HydrophobicContact CB-CB 3.9Å; D33-R36 VanDerWaalsContact CG-CB 3.46Å; D33-R36 PolarHBondContact O-N 2.87Å; D33-R36 PolarHBondContact OD1-N 3.36Å; D33-R36 WeakPolarHBondContact OD2-CB 2.89Å; R36-A39 WeakPolarHBondContact O-CB 3.26Å; R36-A39 PolarHBondContact O-N 2.98Å; R36-R40 WeakPolarHBondContact O-CG 3.43Å; R36-R40 PolarHBondContact O-N 3.46Å; R36-R40 VanDerWaalsContact O-N 3.12Å
37	D	98.6	Very high	97.4	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-66.6	-38.4	179.7	-77.7	-22.1	0	0	0	111.4	D33 A39 R40 I41 V58 R62 I70	D33-D37 PolarHBondContact O-N 3.29Å; D33-D37 VanDerWaalsContact O-N 3.12Å; D37-A39 PolarHBondContact O-N 3.38Å; D37-R40 PolarHBondContact O-N 2.77Å; D37-R40 IonicContact OD1-NH1 3.66Å; D37-I41 WeakPolarHBondContact O-CG1 3.44Å; D37-I41 PolarHBondContact O-N 3.44Å; D37-V58 HydrophobicContact CB-CG1 3.97Å; D37-R62 IonicContact OD1-NH2 2.82Å; D37-R62 PolarHBondContact OD1-NH2 3.4Å; D37-R62 VanDerWaalsContact OD1-NH2 3.11Å; D37-R62 IonicContact OD2-CZ 2.73Å; D37-R62 IonicContact OD2-NE 3.11Å; D37-R62 PolarHBondContact OD2-NE 3.03Å; D37-R62 IonicContact OD2-NH2 2.63Å; D37-R62 PolarHBondContact OD2-NH2 3.41Å; D37-I70 HydrophobicContact CB-CD1 3.78Å; D37-I70 HydrophobicContact CB-CG1 3.83Å; D37-I70 HydrophobicContact CB-CG2 4.35Å
38	A	98.8	Very high	97.3	Very high	0 Å²	0	73.1 Å²	73.1	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-61.1	-41.5	173.2	0	0	0	0	0	112.6	P34 R40 I41 E42 I70 A73	P34-A38 WeakPolarHBondContact O-CB 3.48Å; P34-A38 PolarHBondContact O-N 3.04Å; A38-R40 VanDerWaalsContact C-N 3.32Å; A38-R40 PolarHBondContact O-N 3.49Å; A38-I41 PolarHBondContact O-N 3.12Å; A38-E42 WeakPolarHBondContact O-CB 3.21Å; A38-E42 PolarHBondContact O-N 3.17Å; A38-I70 HydrophobicContact CB-CG2 4.31Å; A38-A73 HydrophobicContact CB-CB 3.79Å
39	A	98.6	Very high	97.2	Very high	22 Å²	22	72.2 Å²	72.2	18%	0.182	36%	0.359	C	S	.	.	H	α-helix	trans	-59.4	-42.5	174.9	0	0	0	0	0	112.5	D35 R36 D37 T43 R77	D35-A39 WeakPolarHBondContact O-CB 3.27Å; D35-A39 PolarHBondContact O-N 3.42Å; R36-A39 WeakPolarHBondContact O-CB 3.26Å; R36-A39 PolarHBondContact O-N 2.98Å; D37-A39 PolarHBondContact O-N 3.38Å; A39-T43 WeakPolarHBondContact O-CB 3.4Å; A39-T43 PolarHBondContact O-N 2.95Å; A39-T43 PolarHBondContact O-OG1 3.4Å; A39-R77 VanDerWaalsContact CB-CZ 3.49Å
40	R	98.5	Very high	97.3	Very high	96 Å²	96	71.1 Å²	71.1	36%	0.362	35%	0.353	S	S	.	.	H	α-helix	trans	-66.1	-44.9	179.1	-70.2	176.2	68.3	-158.1	0.3	110.9	R36 D37 A38 T43 A44 T54	R36-R40 WeakPolarHBondContact O-CG 3.43Å; R36-R40 PolarHBondContact O-N 3.46Å; R36-R40 VanDerWaalsContact O-N 3.12Å; D37-R40 PolarHBondContact O-N 2.77Å; D37-R40 IonicContact OD1-NH1 3.66Å; A38-R40 VanDerWaalsContact C-N 3.32Å; A38-R40 PolarHBondContact O-N 3.49Å; R40-T43 PolarHBondContact O-N 3.38Å; R40-A44 VanDerWaalsContact O-CB 3.29Å; R40-A44 WeakPolarHBondContact O-CB 3.21Å; R40-A44 PolarHBondContact O-N 2.81Å; R40-T54 HydrophobicContact CB-CG2 4.13Å
41	I	98.6	Very high	97.6	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-62.6	-44.9	176.7	-67.3	-70.5	0	0	0	111.4	D37 A38 T43 A44 I45 I55 V58 L59 I70 Y74 M82	D37-I41 WeakPolarHBondContact O-CG1 3.44Å; D37-I41 PolarHBondContact O-N 3.44Å; A38-I41 PolarHBondContact O-N 3.12Å; I41-T43 VanDerWaalsContact C-N 3.34Å; I41-T43 PolarHBondContact O-N 2.63Å; I41-A44 PolarHBondContact O-N 2.94Å; I41-I45 HydrophobicContact CG2-CD1 3.81Å; I41-I45 HydrophobicContact CG2-CG1 4.44Å; I41-I45 WeakPolarHBondContact O-CG1 3.36Å; I41-I45 PolarHBondContact O-N 3.16Å; I41-I55 HydrophobicContact CD1-CB 4.31Å; I41-I55 HydrophobicContact CD1-CG1 4.14Å; I41-I55 HydrophobicContact CD1-CG2 4.32Å; I41-V58 HydrophobicContact CD1-CB 3.98Å; I41-V58 HydrophobicContact CD1-CG1 4.08Å; I41-V58 HydrophobicContact CD1-CG2 4.45Å; I41-V58 HydrophobicContact CG1-CB 4.46Å; I41-V58 HydrophobicContact CG1-CG1 4.13Å; I41-L59 HydrophobicContact CD1-CD1 4.2Å; I41-L59 HydrophobicContact CD1-CD2 4.37Å; I41-L59 HydrophobicContact CD1-CG 4Å; I41-I70 HydrophobicContact CG1-CG2 4.47Å; I41-Y74 HydrophobicContact CB-CD2 4.38Å; I41-Y74 HydrophobicContact CG2-CD2 3.93Å; I41-Y74 HydrophobicContact CG2-CE2 3.9Å; I41-M82 HydrophobicContact CB-CE 4.43Å; I41-M82 HydrophobicContact CD1-CE 4.39Å; I41-M82 HydrophobicContact CG1-CE 4.11Å; I41-M82 HydrophobicContact CG2-CE 3.77Å; I41-M82 HydrophobicContact CG2-SD 4.4Å
42	E	98.3	Very high	97.8	Very high	26 Å²	26	58 Å²	58	12%	0.121	30%	0.299	C	S	.	.	H	α-helix	trans	-60.1	-45.4	177	-172.9	-172	-175.1	0	0	111.9	A38 A44 I45 K46 Y74 R77 A78	A38-E42 WeakPolarHBondContact O-CB 3.21Å; A38-E42 PolarHBondContact O-N 3.17Å; E42-A44 VanDerWaalsContact C-N 3.32Å; E42-A44 PolarHBondContact O-N 2.73Å; E42-I45 PolarHBondContact O-N 2.74Å; E42-K46 HydrophobicContact CG-CD 4.11Å; E42-K46 WeakPolarHBondContact O-CB 3.48Å; E42-K46 WeakPolarHBondContact O-CG 3.33Å; E42-K46 PolarHBondContact O-N 3.3Å; E42-K46 WeakPolarHBondContact OE1-CE 3.27Å; E42-K46 IonicContact OE1-NZ 3.9Å; E42-K46 PolarHBondContact OE1-NZ 3.15Å; E42-Y74 HydrophobicContact CB-CD2 4.19Å; E42-Y74 HydrophobicContact CB-CE2 3.78Å; E42-Y74 HydrophobicContact CG-CE2 4.29Å; E42-R77 WeakPolarHBondContact OE2-CD 3.48Å; E42-R77 VanDerWaalsContact OE2-CG 3.26Å; E42-R77 WeakPolarHBondContact OE2-CG 3.17Å; E42-A78 HydrophobicContact CG-CB 4.28Å
43	T	98.4	Very high	97.9	Very high	90 Å²	90	59.4 Å²	59.4	55%	0.552	31%	0.306	S	S	*	.	H	α-helix	trans	-61.1	-44	176.5	-57.3	0	0	0	0	110.9	A39 R40 I41 I45 K46 T47	A39-T43 WeakPolarHBondContact O-CB 3.4Å; A39-T43 PolarHBondContact O-N 2.95Å; A39-T43 PolarHBondContact O-OG1 3.4Å; R40-T43 PolarHBondContact O-N 3.38Å; I41-T43 VanDerWaalsContact C-N 3.34Å; I41-T43 PolarHBondContact O-N 2.63Å; T43-I45 PolarHBondContact O-N 2.82Å; T43-K46 PolarHBondContact O-N 3.11Å; T43-T47 PolarHBondContact O-N 3.36Å; T43-T47 PolarHBondContact O-OG1 3.09Å
44	A	98.5	Very high	97.9	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-63.1	-42.7	179.6	0	0	0	0	0	112.5	R40 I41 E42 T47 D51 T54 I55	R40-A44 VanDerWaalsContact O-CB 3.29Å; R40-A44 WeakPolarHBondContact O-CB 3.21Å; R40-A44 PolarHBondContact O-N 2.81Å; I41-A44 PolarHBondContact O-N 2.94Å; E42-A44 VanDerWaalsContact C-N 3.32Å; E42-A44 PolarHBondContact O-N 2.73Å; A44-T47 PolarHBondContact O-N 3.41Å; A44-D51 HydrophobicContact CB-CB 3.94Å; A44-D51 PolarHBondContact O-N 3.15Å; A44-T54 HydrophobicContact CB-CG2 3.87Å; A44-I55 HydrophobicContact CB-CD1 4.36Å; A44-I55 HydrophobicContact CB-CG1 3.86Å
45	I	98	Very high	97.9	Very high	28 Å²	28	56.2 Å²	56.2	14%	0.144	29%	0.288	C	S	.	.	H	α-helix	trans	-65.8	-37.7	176.4	-71.6	172	0	0	0	111.8	I41 E42 T43 I55 Y74 A85 L86 A89	I41-I45 HydrophobicContact CG2-CD1 3.81Å; I41-I45 HydrophobicContact CG2-CG1 4.44Å; I41-I45 WeakPolarHBondContact O-CG1 3.36Å; I41-I45 PolarHBondContact O-N 3.16Å; E42-I45 PolarHBondContact O-N 2.74Å; T43-I45 PolarHBondContact O-N 2.82Å; I45-I55 HydrophobicContact CG1-CD1 4.12Å; I45-Y74 HydrophobicContact CD1-CE2 4.07Å; I45-A85 HydrophobicContact CD1-CB 3.99Å; I45-L86 HydrophobicContact CD1-CD2 4Å; I45-L86 HydrophobicContact CD1-CG 4.31Å; I45-A89 HydrophobicContact CB-CB 4.48Å; I45-A89 HydrophobicContact CG1-CB 4.13Å; I45-A89 HydrophobicContact CG2-CB 4.01Å
46	K	96.7	Very high	97.9	Very high	146 Å²	146	52.8 Å²	52.8	64%	0.635	27%	0.27	S	S	*	.	H	α-helix	trans	-80.1	-16.7	-177.9	-74	177.8	174.9	176.2	0	114	E42 T43	E42-K46 HydrophobicContact CG-CD 4.11Å; E42-K46 WeakPolarHBondContact O-CB 3.48Å; E42-K46 WeakPolarHBondContact O-CG 3.33Å; E42-K46 PolarHBondContact O-N 3.3Å; E42-K46 WeakPolarHBondContact OE1-CE 3.27Å; E42-K46 IonicContact OE1-NZ 3.9Å; E42-K46 PolarHBondContact OE1-NZ 3.15Å; T43-K46 PolarHBondContact O-N 3.11Å
47	T	97.4	Very high	97.9	Very high	65 Å²	65	49.2 Å²	49.2	40%	0.399	26%	0.26	S	S	.	.	S	Bend	trans	-61.7	137.8	179.6	-66	0	0	0	0	109.9	T43 A44 G49 V50	T43-T47 PolarHBondContact O-N 3.36Å; T43-T47 PolarHBondContact O-OG1 3.09Å; A44-T47 PolarHBondContact O-N 3.41Å; T47-G49 PolarHBondContact O-N 3.31Å; T47-G49 VanDerWaalsContact O-N 3.15Å; T47-V50 WeakPolarHBondContact O-CA 3.37Å; T47-V50 PolarHBondContact O-N 3.3Å
48	K	95.3	Very high	97.9	Very high	210 Å²	210	49.2 Å²	49.2	91%	0.913	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	119.6	178	-177.7	-179.3	178.3	-178	0	109.1
49	G	93.5	Very high	97.9	Very high	63 Å²	63	49.2 Å²	49.2	65%	0.649	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.5	-2	-174.1	0	0	0	0	0	114.4	T47	T47-G49 PolarHBondContact O-N 3.31Å; T47-G49 VanDerWaalsContact O-N 3.15Å
50	V	97.9	Very high	97.9	Very high	31 Å²	31	48.3 Å²	48.3	19%	0.188	25%	0.252	C	S	.	.			trans	63.1	145.4	-173.4	-174.4	0	0	0	0	111.7	T47 E52 I55 A89 L90	T47-V50 WeakPolarHBondContact O-CA 3.37Å; T47-V50 PolarHBondContact O-N 3.3Å; V50-E52 HydrophobicContact CG1-CG 4.4Å; V50-E52 VanDerWaalsContact O-OE2 3.12Å; V50-I55 HydrophobicContact CG1-CD1 3.89Å; V50-A89 HydrophobicContact CG1-CB 4.31Å; V50-A89 HydrophobicContact CG2-CB 4.12Å; V50-L90 HydrophobicContact CG1-CD2 4.33Å
51	D	98.3	Very high	97.9	Very high	54 Å²	54	48.2 Å²	48.2	29%	0.289	26%	0.255	S	S	.	.			trans	-104.4	81.3	170.6	178	2.2	0	0	0	109.1	A44 Q53 T54 I55	A44-D51 HydrophobicContact CB-CB 3.94Å; A44-D51 PolarHBondContact O-N 3.15Å; D51-Q53 PolarHBondContact O-N 3.23Å; D51-Q53 WeakPolarHBondContact OD1-CB 3.29Å; D51-Q53 PolarHBondContact OD1-N 2.96Å; D51-T54 VanDerWaalsContact CG-OG1 3.32Å; D51-T54 PolarHBondContact O-N 3.11Å; D51-T54 PolarHBondContact OD1-N 3.33Å; D51-T54 WeakPolarHBondContact OD2-CB 3.46Å; D51-T54 PolarHBondContact OD2-OG1 2.88Å; D51-I55 PolarHBondContact O-N 2.93Å
52	E	98.5	Very high	97.9	Very high	51 Å²	51	49.2 Å²	49.2	24%	0.238	26%	0.258	C	S	.	.	H	α-helix	trans	-59.4	-33.5	178.9	-66.7	86.3	170	0	0	111.7	V50 I55 I56 L90 L94 D325	V50-E52 HydrophobicContact CG1-CG 4.4Å; V50-E52 VanDerWaalsContact O-OE2 3.12Å; E52-I55 PolarHBondContact O-N 2.92Å; E52-I56 WeakPolarHBondContact O-CD1 3.42Å; E52-I56 VanDerWaalsContact O-CG1 3.24Å; E52-I56 WeakPolarHBondContact O-CG1 3.2Å; E52-I56 PolarHBondContact O-N 3.46Å; E52-L90 HydrophobicContact CG-CD2 3.97Å; E52-L94 HydrophobicContact CB-CD2 3.73Å; E52-L94 HydrophobicContact CG-CD2 3.55Å; E52-D325 HydrophobicContact CB-CB 4.35Å
53	Q	98.4	Very high	97.9	Very high	70 Å²	70	48.1 Å²	48.1	33%	0.327	25%	0.253	S	S	.	.	H	α-helix	trans	-62.5	-47.2	-178.6	-174.8	60.4	54.6	0	0	111.1	D51 I55 I56 D57	D51-Q53 PolarHBondContact O-N 3.23Å; D51-Q53 WeakPolarHBondContact OD1-CB 3.29Å; D51-Q53 PolarHBondContact OD1-N 2.96Å; Q53-I55 VanDerWaalsContact C-N 3.31Å; Q53-I55 PolarHBondContact O-N 3.25Å; Q53-I56 PolarHBondContact O-N 3.37Å; Q53-D57 PolarHBondContact NE2-OD2 2.89Å; Q53-D57 WeakPolarHBondContact O-CB 3.27Å; Q53-D57 PolarHBondContact O-N 2.98Å
54	T	98.7	Very high	97.9	Very high	29 Å²	29	46 Å²	46	18%	0.178	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-39.2	175.7	-71.6	0	0	0	0	111.8	R40 A44 D51 D57 V58	R40-T54 HydrophobicContact CB-CG2 4.13Å; A44-T54 HydrophobicContact CB-CG2 3.87Å; D51-T54 VanDerWaalsContact CG-OG1 3.32Å; D51-T54 PolarHBondContact O-N 3.11Å; D51-T54 PolarHBondContact OD1-N 3.33Å; D51-T54 WeakPolarHBondContact OD2-CB 3.46Å; D51-T54 PolarHBondContact OD2-OG1 2.88Å; T54-D57 PolarHBondContact O-N 2.95Å; T54-V58 WeakPolarHBondContact O-CG2 3.39Å; T54-V58 PolarHBondContact O-N 3.38Å; T54-V58 VanDerWaalsContact O-N 3.12Å
55	I	98.8	Very high	97.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-45.7	177	-64.7	168.6	0	0	0	110.5	I41 A44 I45 V50 D51 E52 Q53 V58 L59 L86 L90 I98	I41-I55 HydrophobicContact CD1-CB 4.31Å; I41-I55 HydrophobicContact CD1-CG1 4.14Å; I41-I55 HydrophobicContact CD1-CG2 4.32Å; A44-I55 HydrophobicContact CB-CD1 4.36Å; A44-I55 HydrophobicContact CB-CG1 3.86Å; I45-I55 HydrophobicContact CG1-CD1 4.12Å; V50-I55 HydrophobicContact CG1-CD1 3.89Å; D51-I55 PolarHBondContact O-N 2.93Å; E52-I55 PolarHBondContact O-N 2.92Å; Q53-I55 VanDerWaalsContact C-N 3.31Å; Q53-I55 PolarHBondContact O-N 3.25Å; I55-V58 PolarHBondContact O-N 3.44Å; I55-L59 HydrophobicContact CG2-CD1 3.8Å; I55-L59 HydrophobicContact CG2-CG 4.46Å; I55-L59 WeakPolarHBondContact O-CB 3.31Å; I55-L59 PolarHBondContact O-N 3.01Å; I55-L86 HydrophobicContact CD1-CD2 4.26Å; I55-L86 HydrophobicContact CG2-CD2 3.89Å; I55-L90 HydrophobicContact CD1-CD2 3.94Å; I55-L90 HydrophobicContact CG2-CD1 4.36Å; I55-I98 HydrophobicContact CG2-CD1 4.26Å; I55-I98 HydrophobicContact CG2-CG1 4.34Å; I55-I98 HydrophobicContact CG2-CG2 4.23Å
56	I	98.8	Very high	97.9	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-51.6	177.1	-69.4	164	0	0	0	110.4	E52 Q53 V58 L59 T60 L94 D325 K328 A329	E52-I56 WeakPolarHBondContact O-CD1 3.42Å; E52-I56 VanDerWaalsContact O-CG1 3.24Å; E52-I56 WeakPolarHBondContact O-CG1 3.2Å; E52-I56 PolarHBondContact O-N 3.46Å; Q53-I56 PolarHBondContact O-N 3.37Å; I56-V58 PolarHBondContact O-N 3.24Å; I56-L59 PolarHBondContact O-N 3.48Å; I56-T60 HydrophobicContact CG2-CG2 3.96Å; I56-T60 WeakPolarHBondContact O-CB 3.42Å; I56-T60 WeakPolarHBondContact O-CG2 3.49Å; I56-T60 PolarHBondContact O-N 3.28Å; I56-T60 PolarHBondContact O-OG1 3.49Å; I56-L94 HydrophobicContact CD1-CD1 3.75Å; I56-L94 HydrophobicContact CD1-CD2 4.44Å; I56-L94 HydrophobicContact CG1-CD1 3.76Å; I56-D325 HydrophobicContact CD1-CB 3.9Å; I56-D325 WeakPolarHBondContact CD1-O 3.33Å; I56-K328 HydrophobicContact CD1-CB 4.21Å; I56-A329 HydrophobicContact CD1-CB 4.38Å; I56-A329 HydrophobicContact CG1-CB 4.21Å; I56-A329 HydrophobicContact CG2-CB 4.32Å
57	D	98.1	Very high	98	Very high	50 Å²	50	40.6 Å²	40.6	27%	0.267	22%	0.217	S	C	.	.	H	α-helix	trans	-61.6	-27.6	-176.2	-87.2	-46.5	0	0	0	113.8	Q53 T54 K61	Q53-D57 PolarHBondContact NE2-OD2 2.89Å; Q53-D57 WeakPolarHBondContact O-CB 3.27Å; Q53-D57 PolarHBondContact O-N 2.98Å; T54-D57 PolarHBondContact O-N 2.95Å; D57-K61 WeakPolarHBondContact O-CD 3.44Å; D57-K61 IonicContact OD1-NZ 3.19Å; D57-K61 PolarHBondContact OD1-NZ 3.03Å
58	V	98.4	Very high	98	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-82.7	-60.4	172.8	175.7	0	0	0	0	110.1	D37 I41 T54 I55 I56 T60 K61 R62 I70	D37-V58 HydrophobicContact CB-CG1 3.97Å; I41-V58 HydrophobicContact CD1-CB 3.98Å; I41-V58 HydrophobicContact CD1-CG1 4.08Å; I41-V58 HydrophobicContact CD1-CG2 4.45Å; I41-V58 HydrophobicContact CG1-CB 4.46Å; I41-V58 HydrophobicContact CG1-CG1 4.13Å; T54-V58 WeakPolarHBondContact O-CG2 3.39Å; T54-V58 PolarHBondContact O-N 3.38Å; T54-V58 VanDerWaalsContact O-N 3.12Å; I55-V58 PolarHBondContact O-N 3.44Å; I56-V58 PolarHBondContact O-N 3.24Å; V58-T60 PolarHBondContact O-N 2.8Å; V58-K61 PolarHBondContact O-N 2.8Å; V58-R62 WeakPolarHBondContact O-CG 3.49Å; V58-I70 HydrophobicContact CG1-CD1 4Å
59	L	98.6	Very high	98.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-77.9	-19.5	-164.5	-61.9	-179.5	0	0	0	114.9	I41 I55 I56 K61 R67 M82 L86 I98 M102	I41-L59 HydrophobicContact CD1-CD1 4.2Å; I41-L59 HydrophobicContact CD1-CD2 4.37Å; I41-L59 HydrophobicContact CD1-CG 4Å; I55-L59 HydrophobicContact CG2-CD1 3.8Å; I55-L59 HydrophobicContact CG2-CG 4.46Å; I55-L59 WeakPolarHBondContact O-CB 3.31Å; I55-L59 PolarHBondContact O-N 3.01Å; I56-L59 PolarHBondContact O-N 3.48Å; L59-K61 VanDerWaalsContact C-N 3.34Å; L59-R67 HydrophobicContact CD2-CG 4.09Å; L59-R67 WeakPolarHBondContact O-CD 3.46Å; L59-M82 HydrophobicContact CD1-CE 3.91Å; L59-M82 HydrophobicContact CD2-CE 3.71Å; L59-M82 HydrophobicContact CG-CE 4.37Å; L59-L86 HydrophobicContact CD1-CD1 3.97Å; L59-L86 HydrophobicContact CD1-CD2 4.28Å; L59-I98 HydrophobicContact CB-CD1 4.3Å; L59-I98 HydrophobicContact CD1-CG2 3.56Å; L59-M102 HydrophobicContact CD1-SD 4.21Å; L59-M102 HydrophobicContact CD2-SD 4.22Å
60	T	98.6	Very high	98.4	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.012	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-9.6	173.3	63	0	0	0	0	113.2	V26 I56 V58 L101 A329 S332 L333	V26-T60 WeakPolarHBondContact CG2-O 3.43Å; I56-T60 HydrophobicContact CG2-CG2 3.96Å; I56-T60 WeakPolarHBondContact O-CB 3.42Å; I56-T60 WeakPolarHBondContact O-CG2 3.49Å; I56-T60 PolarHBondContact O-N 3.28Å; I56-T60 PolarHBondContact O-OG1 3.49Å; V58-T60 PolarHBondContact O-N 2.8Å; T60-L101 HydrophobicContact CG2-CD1 3.96Å; T60-A329 HydrophobicContact CG2-CB 4.31Å; T60-S332 VanDerWaalsContact OG1-CB 3.26Å; T60-S332 WeakPolarHBondContact OG1-CB 3.49Å; T60-S332 PolarHBondContact OG1-OG 3.09Å; T60-L333 HydrophobicContact CG2-CD2 4.09Å; T60-L333 HydrophobicContact CG2-CG 4.01Å
61	K	97.6	Very high	98.5	Very high	95 Å²	95	34.5 Å²	34.5	41%	0.413	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118	21.5	-177	-60.6	-179.6	-175.2	155.7	0	112.3	V29 D57 V58 L59 S332	V29-K61 VanDerWaalsContact CG2-O 3.27Å; V29-K61 WeakPolarHBondContact CG2-O 3.4Å; D57-K61 WeakPolarHBondContact O-CD 3.44Å; D57-K61 IonicContact OD1-NZ 3.19Å; D57-K61 PolarHBondContact OD1-NZ 3.03Å; V58-K61 PolarHBondContact O-N 2.8Å; L59-K61 VanDerWaalsContact C-N 3.34Å; K61-S332 WeakPolarHBondContact CE-OG 3.46Å
62	R	98.3	Very high	98.5	Very high	21 Å²	21	38.9 Å²	38.9	8%	0.079	18%	0.181	C	C	.	.	S	Bend	trans	-131.8	134.4	177.6	-64.7	-66.6	-178.5	-73.3	-9.7	108.4	D37 V58 Q66 R67 I70	D37-R62 IonicContact OD1-NH2 2.82Å; D37-R62 PolarHBondContact OD1-NH2 3.4Å; D37-R62 VanDerWaalsContact OD1-NH2 3.11Å; D37-R62 IonicContact OD2-CZ 2.73Å; D37-R62 IonicContact OD2-NE 3.11Å; D37-R62 PolarHBondContact OD2-NE 3.03Å; D37-R62 IonicContact OD2-NH2 2.63Å; D37-R62 PolarHBondContact OD2-NH2 3.41Å; V58-R62 WeakPolarHBondContact O-CG 3.49Å; R62-Q66 HydrophobicContact CB-CB 4.04Å; R62-R67 HydrophobicContact CB-CG 3.82Å; R62-R67 WeakPolarHBondContact O-CD 3.44Å; R62-R67 PolarHBondContact O-NE 3.33Å; R62-R67 VanDerWaalsContact O-NE 3.17Å; R62-I70 HydrophobicContact CB-CD1 4.35Å; R62-I70 HydrophobicContact CG-CD1 3.91Å
63	S	98.3	Very high	98.5	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.014	17%	0.172	C	C	.	.			trans	-61.7	162.4	172.1	57.5	0	0	0	0	111.4	S65 Q66 R67	S63-S65 VanDerWaalsContact C-N 3.28Å; S63-S65 PolarHBondContact O-N 2.7Å; S63-S65 PolarHBondContact OG-OG 3.26Å; S63-S65 VanDerWaalsContact OG-OG 3.09Å; S63-Q66 PolarHBondContact O-N 3.02Å; S63-Q66 VanDerWaalsContact O-N 3.15Å; S63-Q66 WeakPolarHBondContact OG-CG 3.21Å; S63-Q66 PolarHBondContact OG-OE1 2.59Å; S63-R67 WeakPolarHBondContact O-CG 3.46Å; S63-R67 PolarHBondContact O-N 2.87Å; S63-R67 PolarHBondContact O-NE 3.13Å
64	Y	98.3	Very high	98.5	Very high	46 Å²	46	33.8 Å²	33.8	18%	0.18	16%	0.158	C	C	.	.	H	α-helix	trans	-54.4	-42.6	176.6	170.1	-107	0	0	0	112.9	Q66 R67 R68 K103 Q107 E296	Y64-Q66 VanDerWaalsContact C-N 3.33Å; Y64-Q66 PolarHBondContact O-N 3.04Å; Y64-R67 PolarHBondContact O-N 2.99Å; Y64-R68 PolarHBondContact O-N 3.02Å; Y64-K103 WeakPolarHBondContact CD2-O 3.44Å; Y64-Q107 PolarHBondContact OH-OE1 3.15Å; Y64-E296 PolarHBondContact N-OE1 2.69Å; Y64-E296 PolarHBondContact N-OE2 2.9Å
65	S	97.9	Very high	98.4	Very high	47 Å²	47	36.2 Å²	36.2	33%	0.329	17%	0.167	S	C	.	.	H	α-helix	trans	-58.3	-46.2	177.8	53.9	0	0	0	0	111.6	S63 R68 E69	S63-S65 VanDerWaalsContact C-N 3.28Å; S63-S65 PolarHBondContact O-N 2.7Å; S63-S65 PolarHBondContact OG-OG 3.26Å; S63-S65 VanDerWaalsContact OG-OG 3.09Å; S65-R68 WeakPolarHBondContact O-CB 3.43Å; S65-R68 PolarHBondContact O-N 2.77Å; S65-E69 PolarHBondContact O-N 3.19Å; S65-E69 VanDerWaalsContact O-N 3.15Å
66	Q	98.7	Very high	98.3	Very high	10 Å²	10	42.8 Å²	42.8	5%	0.047	20%	0.196	C	C	.	.	H	α-helix	trans	-66.2	-41.2	176.9	-69.2	178.3	-35.8	0	0	112	V29 F32 R62 S63 Y64 R68 E69 I70	V29-Q66 VanDerWaalsContact N-NE2 3.15Å; V29-Q66 PolarHBondContact O-NE2 3.12Å; F32-Q66 VanDerWaalsContact CB-NE2 3.34Å; F32-Q66 HydrophobicContact CD1-CB 4.39Å; F32-Q66 HydrophobicContact CD1-CG 3.8Å; F32-Q66 HydrophobicContact CD2-CB 4.28Å; F32-Q66 HydrophobicContact CD2-CG 4.21Å; F32-Q66 HydrophobicContact CE1-CB 3.99Å; F32-Q66 HydrophobicContact CE1-CG 3.83Å; F32-Q66 HydrophobicContact CE2-CB 3.91Å; F32-Q66 HydrophobicContact CE2-CG 4.27Å; F32-Q66 HydrophobicContact CG-CG 3.99Å; F32-Q66 HydrophobicContact CZ-CB 3.73Å; F32-Q66 HydrophobicContact CZ-CG 4.06Å; F32-Q66 WeakPolarHBondContact CZ-O 3.49Å; R62-Q66 HydrophobicContact CB-CB 4.04Å; S63-Q66 PolarHBondContact O-N 3.02Å; S63-Q66 VanDerWaalsContact O-N 3.15Å; S63-Q66 WeakPolarHBondContact OG-CG 3.21Å; S63-Q66 PolarHBondContact OG-OE1 2.59Å; Y64-Q66 VanDerWaalsContact C-N 3.33Å; Y64-Q66 PolarHBondContact O-N 3.04Å; Q66-R68 VanDerWaalsContact C-N 3.26Å; Q66-R68 PolarHBondContact O-N 2.9Å; Q66-E69 PolarHBondContact O-N 3.36Å; Q66-E69 VanDerWaalsContact O-N 3.11Å; Q66-I70 VanDerWaalsContact O-CG1 3.27Å; Q66-I70 WeakPolarHBondContact O-CG1 3.4Å; Q66-I70 PolarHBondContact O-N 3.18Å
67	R	98.8	Very high	98.1	Very high	5 Å²	5	48 Å²	48	2%	0.019	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-35.6	175.9	-71.1	176.3	-68.7	-177	18.2	112.4	L59 R62 S63 Y64 I70 A71 L101 M102 E296	L59-R67 HydrophobicContact CD2-CG 4.09Å; L59-R67 WeakPolarHBondContact O-CD 3.46Å; R62-R67 HydrophobicContact CB-CG 3.82Å; R62-R67 WeakPolarHBondContact O-CD 3.44Å; R62-R67 PolarHBondContact O-NE 3.33Å; R62-R67 VanDerWaalsContact O-NE 3.17Å; S63-R67 WeakPolarHBondContact O-CG 3.46Å; S63-R67 PolarHBondContact O-N 2.87Å; S63-R67 PolarHBondContact O-NE 3.13Å; Y64-R67 PolarHBondContact O-N 2.99Å; R67-I70 PolarHBondContact O-N 3.12Å; R67-A71 WeakPolarHBondContact O-CB 3.48Å; R67-A71 PolarHBondContact O-N 3.17Å; R67-L101 PolarHBondContact NE-O 2.97Å; R67-L101 VanDerWaalsContact NE-O 3.13Å; R67-L101 VanDerWaalsContact NH1-CA 3.31Å; R67-L101 PolarHBondContact NH1-O 2.88Å; R67-L101 VanDerWaalsContact NH1-O 3.07Å; R67-L101 PolarHBondContact NH2-O 3.2Å; R67-M102 HydrophobicContact CB-CE 4.32Å; R67-M102 HydrophobicContact CB-SD 4.29Å; R67-E296 IonicContact CZ-OE1 3.63Å; R67-E296 IonicContact NE-OE1 3.48Å; R67-E296 IonicContact NH2-OE1 3.45Å; R67-E296 PolarHBondContact NH2-OE1 3.06Å
68	R	98.5	Very high	98	Very high	141 Å²	141	46.9 Å²	46.9	53%	0.532	21%	0.213	S	C	.	.	H	α-helix	trans	-66.3	-41.3	173.3	-171	-178.1	66.8	-145.8	-1	112.1	Y64 S65 Q66 A71 F72	Y64-R68 PolarHBondContact O-N 3.02Å; S65-R68 WeakPolarHBondContact O-CB 3.43Å; S65-R68 PolarHBondContact O-N 2.77Å; Q66-R68 VanDerWaalsContact C-N 3.26Å; Q66-R68 PolarHBondContact O-N 2.9Å; R68-A71 PolarHBondContact O-N 3.43Å; R68-F72 PolarHBondContact O-N 3.21Å
69	E	98.7	Very high	97.9	Very high	88 Å²	88	55.1 Å²	55.1	41%	0.411	25%	0.249	S	C	.	.	H	α-helix	trans	-65.9	-39.3	175.3	-69.6	176.4	-127.7	0	0	112	F32 P34 S65 Q66 F72 A73	F32-E69 HydrophobicContact CE1-CB 3.9Å; F32-E69 HydrophobicContact CE1-CG 4.5Å; F32-E69 WeakPolarHBondContact CE1-OE2 3.49Å; F32-E69 HydrophobicContact CZ-CB 3.97Å; P34-E69 HydrophobicContact CB-CB 4.04Å; S65-E69 PolarHBondContact O-N 3.19Å; S65-E69 VanDerWaalsContact O-N 3.15Å; Q66-E69 PolarHBondContact O-N 3.36Å; Q66-E69 VanDerWaalsContact O-N 3.11Å; E69-F72 PolarHBondContact O-N 3.39Å; E69-A73 PolarHBondContact O-N 3.47Å
70	I	98.8	Very high	97.7	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.4	-45.9	172.2	-63.3	166.4	0	0	0	110.3	F32 D37 A38 I41 V58 R62 Q66 R67 F72 A73 Y74 M82	F32-I70 HydrophobicContact CE2-CD1 3.95Å; F32-I70 HydrophobicContact CE2-CG1 3.76Å; F32-I70 HydrophobicContact CZ-CD1 4.41Å; F32-I70 HydrophobicContact CZ-CG1 3.84Å; D37-I70 HydrophobicContact CB-CD1 3.78Å; D37-I70 HydrophobicContact CB-CG1 3.83Å; D37-I70 HydrophobicContact CB-CG2 4.35Å; A38-I70 HydrophobicContact CB-CG2 4.31Å; I41-I70 HydrophobicContact CG1-CG2 4.47Å; V58-I70 HydrophobicContact CG1-CD1 4Å; R62-I70 HydrophobicContact CB-CD1 4.35Å; R62-I70 HydrophobicContact CG-CD1 3.91Å; Q66-I70 VanDerWaalsContact O-CG1 3.27Å; Q66-I70 WeakPolarHBondContact O-CG1 3.4Å; Q66-I70 PolarHBondContact O-N 3.18Å; R67-I70 PolarHBondContact O-N 3.12Å; I70-F72 VanDerWaalsContact C-N 3.33Å; I70-F72 PolarHBondContact O-N 3.34Å; I70-A73 PolarHBondContact O-N 3.37Å; I70-Y74 VanDerWaalsContact O-CB 3.27Å; I70-Y74 WeakPolarHBondContact O-CB 3.47Å; I70-Y74 PolarHBondContact O-N 2.6Å; I70-M82 HydrophobicContact CG2-CE 4.03Å; I70-M82 HydrophobicContact CG2-SD 3.93Å
71	A	98.5	Very high	97.7	Very high	12 Å²	12	62.3 Å²	62.3	10%	0.099	28%	0.282	C	S	.	.	H	α-helix	trans	-59.8	-42.9	178.6	0	0	0	0	0	112.3	R67 R68 Y74 E75 M82 M102	R67-A71 WeakPolarHBondContact O-CB 3.48Å; R67-A71 PolarHBondContact O-N 3.17Å; R68-A71 PolarHBondContact O-N 3.43Å; A71-Y74 WeakPolarHBondContact O-CB 3.38Å; A71-Y74 PolarHBondContact O-N 3.29Å; A71-E75 WeakPolarHBondContact O-CG 3.37Å; A71-E75 PolarHBondContact O-N 3.07Å; A71-M82 VanDerWaalsContact CA-SD 3.52Å; A71-M82 HydrophobicContact CB-CB 4.09Å; A71-M82 HydrophobicContact CB-SD 3.98Å; A71-M102 HydrophobicContact CB-CE 3.95Å
72	F	98.3	Very high	97.7	Very high	146 Å²	146	57.8 Å²	57.8	64%	0.64	26%	0.263	S	S	*	.	H	α-helix	trans	-63.6	-45.4	175.8	-179	-99.4	0	0	0	112.6	R68 E69 I70 Y74 E75 K76	R68-F72 PolarHBondContact O-N 3.21Å; E69-F72 PolarHBondContact O-N 3.39Å; I70-F72 VanDerWaalsContact C-N 3.33Å; I70-F72 PolarHBondContact O-N 3.34Å; F72-Y74 VanDerWaalsContact C-N 3.33Å; F72-Y74 PolarHBondContact O-N 3.04Å; F72-E75 PolarHBondContact O-N 3.21Å; F72-K76 PolarHBondContact O-N 3.44Å; F72-K76 VanDerWaalsContact O-N 3.12Å
73	A	98.5	Very high	97.7	Very high	6 Å²	6	60.2 Å²	60.2	5%	0.05	28%	0.277	C	S	.	.	H	α-helix	trans	-64.7	-38.2	176.7	0	0	0	0	0	112.1	P34 A38 E69 I70 K76 R77	P34-A73 HydrophobicContact CB-CB 4.19Å; A38-A73 HydrophobicContact CB-CB 3.79Å; E69-A73 PolarHBondContact O-N 3.47Å; I70-A73 PolarHBondContact O-N 3.37Å; A73-K76 PolarHBondContact O-N 2.98Å; A73-R77 WeakPolarHBondContact O-CB 3.15Å; A73-R77 PolarHBondContact O-N 3.49Å; A73-R77 VanDerWaalsContact O-N 3.12Å
74	Y	98.6	Very high	97.7	Very high	8 Å²	8	63.9 Å²	63.9	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-60.7	-48.9	174.3	-179.7	-80.6	0	0	0	111.2	I41 E42 I45 I70 A71 F72 K76 R77 A78 K80 M82 A85	I41-Y74 HydrophobicContact CB-CD2 4.38Å; I41-Y74 HydrophobicContact CG2-CD2 3.93Å; I41-Y74 HydrophobicContact CG2-CE2 3.9Å; E42-Y74 HydrophobicContact CB-CD2 4.19Å; E42-Y74 HydrophobicContact CB-CE2 3.78Å; E42-Y74 HydrophobicContact CG-CE2 4.29Å; I45-Y74 HydrophobicContact CD1-CE2 4.07Å; I70-Y74 VanDerWaalsContact O-CB 3.27Å; I70-Y74 WeakPolarHBondContact O-CB 3.47Å; I70-Y74 PolarHBondContact O-N 2.6Å; A71-Y74 WeakPolarHBondContact O-CB 3.38Å; A71-Y74 PolarHBondContact O-N 3.29Å; F72-Y74 VanDerWaalsContact C-N 3.33Å; F72-Y74 PolarHBondContact O-N 3.04Å; Y74-K76 VanDerWaalsContact C-N 3.34Å; Y74-K76 PolarHBondContact O-N 3.37Å; Y74-R77 PolarHBondContact O-N 3.05Å; Y74-R77 VanDerWaalsContact O-N 3.14Å; Y74-A78 HydrophobicContact CD1-CB 4.1Å; Y74-A78 HydrophobicContact CE1-CB 3.7Å; Y74-A78 HydrophobicContact CE2-CB 4.37Å; Y74-A78 WeakPolarHBondContact O-CB 3.4Å; Y74-A78 PolarHBondContact O-N 3.13Å; Y74-K80 VanDerWaalsContact CD1-O 3.31Å; Y74-K80 WeakPolarHBondContact CD1-O 3.33Å; Y74-K80 VanDerWaalsContact CE1-O 3.27Å; Y74-K80 WeakPolarHBondContact CE1-O 3.48Å; Y74-M82 HydrophobicContact CD1-CB 3.5Å; Y74-M82 HydrophobicContact CD1-CG 4.04Å; Y74-M82 HydrophobicContact CD2-CG 4.29Å; Y74-M82 HydrophobicContact CD2-SD 4.43Å; Y74-M82 HydrophobicContact CE1-CB 4.09Å; Y74-M82 HydrophobicContact CE1-CG 4.5Å; Y74-M82 HydrophobicContact CG-CB 3.82Å; Y74-M82 HydrophobicContact CG-CG 3.95Å; Y74-M82 HydrophobicContact CG-SD 4.16Å; Y74-A85 HydrophobicContact CE1-CB 3.98Å; Y74-A85 WeakPolarHBondContact OH-CB 3.34Å
75	E	97.4	Very high	97.7	Very high	80 Å²	80	61.7 Å²	61.7	37%	0.374	29%	0.29	S	S	.	.	H	α-helix	trans	-58.7	-44.3	178.2	-82.4	177.3	-160.7	0	0	112.5	A71 F72 R77 K79 K80	A71-E75 WeakPolarHBondContact O-CG 3.37Å; A71-E75 PolarHBondContact O-N 3.07Å; F72-E75 PolarHBondContact O-N 3.21Å; E75-R77 VanDerWaalsContact C-N 3.26Å; E75-R77 PolarHBondContact O-N 2.97Å; E75-K79 WeakPolarHBondContact O-CA 3.46Å; E75-K79 PolarHBondContact O-N 2.94Å; E75-K80 WeakPolarHBondContact CG-O 3.33Å
76	K	96.9	Very high	97.7	Very high	138 Å²	138	59.5 Å²	59.5	60%	0.6	28%	0.275	S	S	*	.	H	α-helix	trans	-60.2	-38.6	177.4	-176.1	-178.4	175	-172.3	0	111.8	F72 A73 Y74 K79	F72-K76 PolarHBondContact O-N 3.44Å; F72-K76 VanDerWaalsContact O-N 3.12Å; A73-K76 PolarHBondContact O-N 2.98Å; Y74-K76 VanDerWaalsContact C-N 3.34Å; Y74-K76 PolarHBondContact O-N 3.37Å; K76-K79 WeakPolarHBondContact O-CE 3.2Å; K76-K79 PolarHBondContact O-NZ 2.85Å
77	R	95.4	Very high	97.7	Very high	111 Å²	111	65 Å²	65	42%	0.419	30%	0.299	S	S	.	.	H	α-helix	trans	-81.1	-56.8	-176.7	-178.1	-175.3	-65.7	-119.7	-0.4	112.7	D35 A39 E42 A73 Y74 E75 K79	D35-R77 PolarHBondContact O-NH2 3.32Å; D35-R77 IonicContact OD1-NH2 3.66Å; A39-R77 VanDerWaalsContact CB-CZ 3.49Å; E42-R77 WeakPolarHBondContact OE2-CD 3.48Å; E42-R77 VanDerWaalsContact OE2-CG 3.26Å; E42-R77 WeakPolarHBondContact OE2-CG 3.17Å; A73-R77 WeakPolarHBondContact O-CB 3.15Å; A73-R77 PolarHBondContact O-N 3.49Å; A73-R77 VanDerWaalsContact O-N 3.12Å; Y74-R77 PolarHBondContact O-N 3.05Å; Y74-R77 VanDerWaalsContact O-N 3.14Å; E75-R77 VanDerWaalsContact C-N 3.26Å; E75-R77 PolarHBondContact O-N 2.97Å; R77-K79 VanDerWaalsContact C-N 3.34Å
78	A	94.8	Very high	97.6	Very high	27 Å²	27	68.5 Å²	68.5	22%	0.223	33%	0.329	C	S	.	.	H	α-helix	trans	-84	-8.4	-173.6	0	0	0	0	0	113.4	E42 Y74 K80	E42-A78 HydrophobicContact CG-CB 4.28Å; Y74-A78 HydrophobicContact CD1-CB 4.1Å; Y74-A78 HydrophobicContact CE1-CB 3.7Å; Y74-A78 HydrophobicContact CE2-CB 4.37Å; Y74-A78 WeakPolarHBondContact O-CB 3.4Å; Y74-A78 PolarHBondContact O-N 3.13Å; A78-K80 PolarHBondContact O-N 3.15Å; A78-K80 VanDerWaalsContact O-N 3.16Å
79	K	96.2	Very high	97.6	Very high	172 Å²	172	63 Å²	63	75%	0.748	31%	0.313	S	S	*	.	S	Bend	trans	53.4	31.4	-174.8	-54	-55	-173.9	-165.1	0	112.9	E75 K76 R77	E75-K79 WeakPolarHBondContact O-CA 3.46Å; E75-K79 PolarHBondContact O-N 2.94Å; K76-K79 WeakPolarHBondContact O-CE 3.2Å; K76-K79 PolarHBondContact O-NZ 2.85Å; R77-K79 VanDerWaalsContact C-N 3.34Å
80	K	95.8	Very high	97.5	Very high	101 Å²	101	59.2 Å²	59.2	44%	0.439	30%	0.295	S	S	.	.	S	Bend	trans	-146.2	139.8	-177.3	-174.8	177.6	179.4	-179.6	0	109.2	Y74 E75 A78 M82 A85	Y74-K80 VanDerWaalsContact CD1-O 3.31Å; Y74-K80 WeakPolarHBondContact CD1-O 3.33Å; Y74-K80 VanDerWaalsContact CE1-O 3.27Å; Y74-K80 WeakPolarHBondContact CE1-O 3.48Å; E75-K80 WeakPolarHBondContact CG-O 3.33Å; A78-K80 PolarHBondContact O-N 3.15Å; A78-K80 VanDerWaalsContact O-N 3.16Å; K80-M82 PolarHBondContact O-N 3.14Å; K80-A85 HydrophobicContact CD-CB 4.14Å
81	D	97.5	Very high	97.4	Very high	52 Å²	52	63.8 Å²	63.8	28%	0.278	33%	0.327	S	S	.	.			trans	-56.6	129.2	172	164.9	-123.7	0	0	0	111.3	I83 T84 A85	D81-I83 VanDerWaalsContact C-N 3.35Å; D81-I83 PolarHBondContact OD2-N 3.36Å; D81-I83 VanDerWaalsContact OD2-N 3.13Å; D81-T84 WeakPolarHBondContact OD1-CB 3.42Å; D81-T84 PolarHBondContact OD1-N 2.86Å; D81-T84 PolarHBondContact OD1-OG1 2.91Å; D81-A85 WeakPolarHBondContact O-CB 3.41Å; D81-A85 PolarHBondContact O-N 3.41Å
82	M	98.1	Very high	97.4	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-64.9	-39.6	-178.3	-176.9	171.2	162.7	0	0	111.5	I41 L59 I70 A71 Y74 K80 A85 L86 M102	I41-M82 HydrophobicContact CB-CE 4.43Å; I41-M82 HydrophobicContact CD1-CE 4.39Å; I41-M82 HydrophobicContact CG1-CE 4.11Å; I41-M82 HydrophobicContact CG2-CE 3.77Å; I41-M82 HydrophobicContact CG2-SD 4.4Å; L59-M82 HydrophobicContact CD1-CE 3.91Å; L59-M82 HydrophobicContact CD2-CE 3.71Å; L59-M82 HydrophobicContact CG-CE 4.37Å; I70-M82 HydrophobicContact CG2-CE 4.03Å; I70-M82 HydrophobicContact CG2-SD 3.93Å; A71-M82 VanDerWaalsContact CA-SD 3.52Å; A71-M82 HydrophobicContact CB-CB 4.09Å; A71-M82 HydrophobicContact CB-SD 3.98Å; Y74-M82 HydrophobicContact CD1-CB 3.5Å; Y74-M82 HydrophobicContact CD1-CG 4.04Å; Y74-M82 HydrophobicContact CD2-CG 4.29Å; Y74-M82 HydrophobicContact CD2-SD 4.43Å; Y74-M82 HydrophobicContact CE1-CB 4.09Å; Y74-M82 HydrophobicContact CE1-CG 4.5Å; Y74-M82 HydrophobicContact CG-CB 3.82Å; Y74-M82 HydrophobicContact CG-CG 3.95Å; Y74-M82 HydrophobicContact CG-SD 4.16Å; K80-M82 PolarHBondContact O-N 3.14Å; M82-A85 PolarHBondContact O-N 2.97Å; M82-L86 HydrophobicContact CE-CD1 3.79Å; M82-L86 HydrophobicContact CG-CD1 3.94Å; M82-L86 HydrophobicContact CG-CG 4.29Å; M82-L86 WeakPolarHBondContact O-CB 3.46Å; M82-L86 WeakPolarHBondContact O-CG 3.24Å; M82-L86 PolarHBondContact O-N 2.77Å; M82-M102 HydrophobicContact CE-CE 4.18Å; M82-M102 HydrophobicContact CE-SD 4.33Å; M82-M102 HydrophobicContact SD-CE 4.28Å
83	I	97.8	Very high	97.3	Very high	73 Å²	73	60.2 Å²	60.2	37%	0.374	33%	0.327	S	S	.	.	H	α-helix	trans	-65.3	-45.6	-177.6	-61.5	178.2	0	0	0	109.8	D81 A85 L86 K87 L99 M102	D81-I83 VanDerWaalsContact C-N 3.35Å; D81-I83 PolarHBondContact OD2-N 3.36Å; D81-I83 VanDerWaalsContact OD2-N 3.13Å; I83-A85 VanDerWaalsContact C-N 3.32Å; I83-A85 PolarHBondContact O-N 2.92Å; I83-L86 PolarHBondContact O-N 3.39Å; I83-K87 WeakPolarHBondContact O-CB 3.4Å; I83-K87 PolarHBondContact O-N 3.46Å; I83-L99 HydrophobicContact CG2-CD2 3.95Å; I83-M102 HydrophobicContact CD1-CB 4.25Å; I83-M102 HydrophobicContact CG1-CB 4.19Å; I83-M102 HydrophobicContact CG1-CG 4.38Å
84	T	98.1	Very high	97.3	Very high	78 Å²	78	60.5 Å²	60.5	48%	0.479	33%	0.328	S	S	.	.	H	α-helix	trans	-62.2	-38.7	174.4	-61.9	0	0	0	0	111.8	D81 A88	D81-T84 WeakPolarHBondContact OD1-CB 3.42Å; D81-T84 PolarHBondContact OD1-N 2.86Å; D81-T84 PolarHBondContact OD1-OG1 2.91Å; T84-A88 WeakPolarHBondContact O-CB 3.48Å; T84-A88 PolarHBondContact O-N 3.23Å; T84-A88 VanDerWaalsContact O-N 3.13Å
85	A	98.1	Very high	97.3	Very high	1 Å²	1	62 Å²	62	1%	0.008	34%	0.335	C	S	.	.	H	α-helix	trans	-66.5	-46	176.3	0	0	0	0	0	112.4	I45 Y74 K80 D81 M82 I83 A88 A89	I45-A85 HydrophobicContact CD1-CB 3.99Å; Y74-A85 HydrophobicContact CE1-CB 3.98Å; Y74-A85 WeakPolarHBondContact OH-CB 3.34Å; K80-A85 HydrophobicContact CD-CB 4.14Å; D81-A85 WeakPolarHBondContact O-CB 3.41Å; D81-A85 PolarHBondContact O-N 3.41Å; M82-A85 PolarHBondContact O-N 2.97Å; I83-A85 VanDerWaalsContact C-N 3.32Å; I83-A85 PolarHBondContact O-N 2.92Å; A85-A88 PolarHBondContact O-N 2.6Å; A85-A89 WeakPolarHBondContact O-CB 3.5Å; A85-A89 PolarHBondContact O-N 3.04Å
86	L	98.4	Very high	97.3	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-61.1	-43.4	175.6	-72.8	167.8	0	0	0	111.6	I45 I55 L59 M82 I83 A88 A89 L90 I98 L99 M102	I45-L86 HydrophobicContact CD1-CD2 4Å; I45-L86 HydrophobicContact CD1-CG 4.31Å; I55-L86 HydrophobicContact CD1-CD2 4.26Å; I55-L86 HydrophobicContact CG2-CD2 3.89Å; L59-L86 HydrophobicContact CD1-CD1 3.97Å; L59-L86 HydrophobicContact CD1-CD2 4.28Å; M82-L86 HydrophobicContact CE-CD1 3.79Å; M82-L86 HydrophobicContact CG-CD1 3.94Å; M82-L86 HydrophobicContact CG-CG 4.29Å; M82-L86 WeakPolarHBondContact O-CB 3.46Å; M82-L86 WeakPolarHBondContact O-CG 3.24Å; M82-L86 PolarHBondContact O-N 2.77Å; I83-L86 PolarHBondContact O-N 3.39Å; L86-A88 VanDerWaalsContact C-N 3.25Å; L86-A88 PolarHBondContact O-N 3.22Å; L86-A89 PolarHBondContact O-N 3.13Å; L86-A89 VanDerWaalsContact O-N 3.14Å; L86-L90 HydrophobicContact CD2-CD1 4.21Å; L86-L90 WeakPolarHBondContact O-CB 3.34Å; L86-L90 WeakPolarHBondContact O-CG 3.26Å; L86-L90 PolarHBondContact O-N 2.89Å; L86-I98 HydrophobicContact CD1-CG2 3.95Å; L86-I98 HydrophobicContact CD2-CG2 4.18Å; L86-L99 HydrophobicContact CB-CD2 4.22Å; L86-M102 HydrophobicContact CD1-CG 4.11Å; L86-M102 HydrophobicContact CD1-SD 4.28Å
87	K	97.9	Very high	97.4	Very high	127 Å²	127	55.2 Å²	55.2	55%	0.552	31%	0.311	S	S	*	.	H	α-helix	trans	-61	-33.4	176.5	-173.1	172.9	-174.1	-178.2	0	113.2	I83 E95 L99	I83-K87 WeakPolarHBondContact O-CB 3.4Å; I83-K87 PolarHBondContact O-N 3.46Å; K87-E95 WeakPolarHBondContact CG-OE1 3.18Å; K87-L99 HydrophobicContact CB-CD1 4.2Å; K87-L99 HydrophobicContact CB-CD2 4.42Å; K87-L99 HydrophobicContact CD-CD1 4.46Å; K87-L99 HydrophobicContact CG-CD1 4.2Å
88	A	97.7	Very high	97.5	Very high	78 Å²	78	50 Å²	50	65%	0.645	29%	0.291	S	S	*	.	H	α-helix	trans	-80.8	-24.5	177.1	0	0	0	0	0	113.1	T84 A85 L86	T84-A88 WeakPolarHBondContact O-CB 3.48Å; T84-A88 PolarHBondContact O-N 3.23Å; T84-A88 VanDerWaalsContact O-N 3.13Å; A85-A88 PolarHBondContact O-N 2.6Å; L86-A88 VanDerWaalsContact C-N 3.25Å; L86-A88 PolarHBondContact O-N 3.22Å
89	A	97.7	Very high	97.7	Very high	24 Å²	24	50.1 Å²	50.1	20%	0.198	29%	0.288	C	S	.	.	H	α-helix	trans	-91.8	-34.3	-176.1	0	0	0	0	0	112.9	I45 V50 A85 L86	I45-A89 HydrophobicContact CB-CB 4.48Å; I45-A89 HydrophobicContact CG1-CB 4.13Å; I45-A89 HydrophobicContact CG2-CB 4.01Å; V50-A89 HydrophobicContact CG1-CB 4.31Å; V50-A89 HydrophobicContact CG2-CB 4.12Å; A85-A89 WeakPolarHBondContact O-CB 3.5Å; A85-A89 PolarHBondContact O-N 3.04Å; L86-A89 PolarHBondContact O-N 3.13Å; L86-A89 VanDerWaalsContact O-N 3.14Å
90	L	98.1	Very high	97.8	Very high	9 Å²	9	42 Å²	42	5%	0.047	25%	0.254	C	S	.	.			trans	-101	161.1	-176.3	-56.3	178.5	0	0	0	110.8	V50 E52 I55 L86 L94 E95 I98	V50-L90 HydrophobicContact CG1-CD2 4.33Å; E52-L90 HydrophobicContact CG-CD2 3.97Å; I55-L90 HydrophobicContact CD1-CD2 3.94Å; I55-L90 HydrophobicContact CG2-CD1 4.36Å; L86-L90 HydrophobicContact CD2-CD1 4.21Å; L86-L90 WeakPolarHBondContact O-CB 3.34Å; L86-L90 WeakPolarHBondContact O-CG 3.26Å; L86-L90 PolarHBondContact O-N 2.89Å; L90-L94 HydrophobicContact CD2-CD2 3.9Å; L90-E95 HydrophobicContact CB-CB 3.79Å; L90-E95 HydrophobicContact CB-CG 4.14Å; L90-I98 HydrophobicContact CD1-CB 3.75Å; L90-I98 HydrophobicContact CD1-CG1 3.81Å; L90-I98 HydrophobicContact CD1-CG2 3.79Å
91	S	96.7	Very high	98	Very high	96 Å²	96	37.3 Å²	37.3	67%	0.671	23%	0.233	S	C	*	.			trans	-141.5	163.3	171.7	64.1	0	0	0	0	112.3	E95	S91-E95 WeakPolarHBondContact CA-OE2 3.47Å; S91-E95 PolarHBondContact O-N 2.77Å
92	G	96.8	Very high	98	Very high	46 Å²	46	35.5 Å²	35.5	47%	0.474	22%	0.223	S	C	.	.	H	α-helix	trans	63.2	-138.9	170.3	0	0	0	0	0	114.1	E95 T96	G92-E95 WeakPolarHBondContact O-CB 3.44Å; G92-E95 PolarHBondContact O-N 3.03Å; G92-T96 PolarHBondContact O-N 3.43Å; G92-T96 VanDerWaalsContact O-N 3.1Å; G92-T96 PolarHBondContact O-OG1 3Å
93	S	96.6	Very high	98	Very high	37 Å²	37	39 Å²	39	26%	0.259	24%	0.238	S	C	.	.	H	α-helix	trans	-71.5	-33.5	-171.6	-45.1	0	0	0	0	112.5	T96 V97 E284	S93-T96 WeakPolarHBondContact O-CB 3.36Å; S93-T96 PolarHBondContact O-N 3.49Å; S93-V97 WeakPolarHBondContact O-CG2 3.24Å; S93-V97 PolarHBondContact O-N 2.8Å; S93-E284 WeakPolarHBondContact CB-OE2 3.2Å; S93-E284 PolarHBondContact OG-OE2 3.41Å
94	L	98	Very high	98	Very high	13 Å²	13	36.7 Å²	36.7	7%	0.068	23%	0.229	C	C	.	.	H	α-helix	trans	-63.3	-46.8	173.3	177.9	66.1	0	0	0	111.2	E52 I56 L90 T96 V97 I98 D325 A329	E52-L94 HydrophobicContact CB-CD2 3.73Å; E52-L94 HydrophobicContact CG-CD2 3.55Å; I56-L94 HydrophobicContact CD1-CD1 3.75Å; I56-L94 HydrophobicContact CD1-CD2 4.44Å; I56-L94 HydrophobicContact CG1-CD1 3.76Å; L90-L94 HydrophobicContact CD2-CD2 3.9Å; L94-T96 VanDerWaalsContact C-N 3.26Å; L94-T96 PolarHBondContact O-N 3.32Å; L94-V97 PolarHBondContact O-N 3.25Å; L94-I98 HydrophobicContact CD1-CD1 4.33Å; L94-I98 HydrophobicContact CD1-CG1 3.87Å; L94-I98 HydrophobicContact CG-CG1 4.21Å; L94-I98 WeakPolarHBondContact O-CG1 3.49Å; L94-I98 PolarHBondContact O-N 3.25Å; L94-D325 HydrophobicContact CD1-CB 4.41Å; L94-D325 HydrophobicContact CD2-CB 3.75Å; L94-D325 HydrophobicContact CG-CB 4.48Å; L94-A329 HydrophobicContact CD1-CB 3.97Å
95	E	98.4	Very high	98	Very high	40 Å²	40	34.6 Å²	34.6	19%	0.187	22%	0.216	C	C	.	.	H	α-helix	trans	-54.6	-46.7	175	-175.7	-162.3	155.5	0	0	110.6	K87 L90 S91 G92 V97 I98 L99	K87-E95 WeakPolarHBondContact CG-OE1 3.18Å; L90-E95 HydrophobicContact CB-CB 3.79Å; L90-E95 HydrophobicContact CB-CG 4.14Å; S91-E95 WeakPolarHBondContact CA-OE2 3.47Å; S91-E95 PolarHBondContact O-N 2.77Å; G92-E95 WeakPolarHBondContact O-CB 3.44Å; G92-E95 PolarHBondContact O-N 3.03Å; E95-V97 VanDerWaalsContact C-N 3.32Å; E95-V97 PolarHBondContact O-N 3.2Å; E95-I98 PolarHBondContact O-N 2.64Å; E95-L99 HydrophobicContact CG-CD1 3.7Å; E95-L99 HydrophobicContact CG-CG 4.11Å; E95-L99 WeakPolarHBondContact O-CB 3.24Å; E95-L99 VanDerWaalsContact O-CG 3.27Å; E95-L99 WeakPolarHBondContact O-CG 3.38Å; E95-L99 PolarHBondContact O-N 2.89Å
96	T	98.3	Very high	98	Very high	75 Å²	75	35.6 Å²	35.6	46%	0.46	22%	0.223	S	C	.	.	H	α-helix	trans	-58.1	-44.4	-179.8	-57.5	0	0	0	0	111.9	G92 S93 L94 G100 T288	G92-T96 PolarHBondContact O-N 3.43Å; G92-T96 VanDerWaalsContact O-N 3.1Å; G92-T96 PolarHBondContact O-OG1 3Å; S93-T96 WeakPolarHBondContact O-CB 3.36Å; S93-T96 PolarHBondContact O-N 3.49Å; L94-T96 VanDerWaalsContact C-N 3.26Å; L94-T96 PolarHBondContact O-N 3.32Å; T96-G100 PolarHBondContact O-N 2.93Å; T96-T288 HydrophobicContact CG2-CG2 4.19Å
97	V	98.6	Very high	98	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.5	-54.2	177.7	174.3	0	0	0	0	110.6	S93 L94 E95 L99 G100 L101 T288 V292 Y326 A329 M330 L333	S93-V97 WeakPolarHBondContact O-CG2 3.24Å; S93-V97 PolarHBondContact O-N 2.8Å; L94-V97 PolarHBondContact O-N 3.25Å; E95-V97 VanDerWaalsContact C-N 3.32Å; E95-V97 PolarHBondContact O-N 3.2Å; V97-L99 VanDerWaalsContact C-N 3.35Å; V97-L99 PolarHBondContact O-N 2.89Å; V97-G100 WeakPolarHBondContact O-CA 3.36Å; V97-G100 PolarHBondContact O-N 2.6Å; V97-G100 VanDerWaalsContact O-N 3.11Å; V97-L101 HydrophobicContact CG1-CD1 4.11Å; V97-L101 HydrophobicContact CG1-CG 4.38Å; V97-L101 WeakPolarHBondContact O-CB 3.32Å; V97-L101 VanDerWaalsContact O-CG 3.32Å; V97-L101 WeakPolarHBondContact O-CG 3.37Å; V97-L101 PolarHBondContact O-N 3.23Å; V97-T288 HydrophobicContact CB-CG2 4.47Å; V97-T288 HydrophobicContact CG2-CG2 3.66Å; V97-V292 HydrophobicContact CG1-CG2 4.34Å; V97-Y326 HydrophobicContact CG2-CD2 3.7Å; V97-Y326 HydrophobicContact CG2-CE2 3.54Å; V97-A329 HydrophobicContact CG1-CB 4.12Å; V97-M330 HydrophobicContact CB-CE 3.95Å; V97-M330 HydrophobicContact CG1-CE 3.37Å; V97-M330 HydrophobicContact CG2-CE 3.24Å; V97-M330 HydrophobicContact CG2-SD 4.42Å; V97-L333 HydrophobicContact CG1-CD1 4.06Å
98	I	98.7	Very high	98	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.2	-41.5	-174.8	-64.5	-58.6	0	0	0	111.1	I55 L59 L86 L90 L94 E95 G100 L101 M102	I55-I98 HydrophobicContact CG2-CD1 4.26Å; I55-I98 HydrophobicContact CG2-CG1 4.34Å; I55-I98 HydrophobicContact CG2-CG2 4.23Å; L59-I98 HydrophobicContact CB-CD1 4.3Å; L59-I98 HydrophobicContact CD1-CG2 3.56Å; L86-I98 HydrophobicContact CD1-CG2 3.95Å; L86-I98 HydrophobicContact CD2-CG2 4.18Å; L90-I98 HydrophobicContact CD1-CB 3.75Å; L90-I98 HydrophobicContact CD1-CG1 3.81Å; L90-I98 HydrophobicContact CD1-CG2 3.79Å; L94-I98 HydrophobicContact CD1-CD1 4.33Å; L94-I98 HydrophobicContact CD1-CG1 3.87Å; L94-I98 HydrophobicContact CG-CG1 4.21Å; L94-I98 WeakPolarHBondContact O-CG1 3.49Å; L94-I98 PolarHBondContact O-N 3.25Å; E95-I98 PolarHBondContact O-N 2.64Å; I98-G100 VanDerWaalsContact C-N 3.34Å; I98-L101 HydrophobicContact CD1-CD1 4.27Å; I98-L101 WeakPolarHBondContact O-CB 3.49Å; I98-L101 PolarHBondContact O-N 2.59Å; I98-M102 WeakPolarHBondContact O-CG 3.48Å; I98-M102 PolarHBondContact O-N 2.88Å; I98-M102 VanDerWaalsContact O-N 3.16Å
99	L	98.6	Very high	98.1	Very high	30 Å²	30	28.5 Å²	28.5	16%	0.157	18%	0.178	C	C	.	.	H	α-helix	trans	-69.6	-31.4	175.6	-64.7	-175.8	0	0	0	112.6	I83 L86 K87 E95 V97 M102	I83-L99 HydrophobicContact CG2-CD2 3.95Å; L86-L99 HydrophobicContact CB-CD2 4.22Å; K87-L99 HydrophobicContact CB-CD1 4.2Å; K87-L99 HydrophobicContact CB-CD2 4.42Å; K87-L99 HydrophobicContact CD-CD1 4.46Å; K87-L99 HydrophobicContact CG-CD1 4.2Å; E95-L99 HydrophobicContact CG-CD1 3.7Å; E95-L99 HydrophobicContact CG-CG 4.11Å; E95-L99 WeakPolarHBondContact O-CB 3.24Å; E95-L99 VanDerWaalsContact O-CG 3.27Å; E95-L99 WeakPolarHBondContact O-CG 3.38Å; E95-L99 PolarHBondContact O-N 2.89Å; V97-L99 VanDerWaalsContact C-N 3.35Å; V97-L99 PolarHBondContact O-N 2.89Å; L99-M102 PolarHBondContact O-N 3.3Å
100	G	98.6	Very high	98.1	Very high	3 Å²	3	27.4 Å²	27.4	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-62.8	-43.4	170.5	0	0	0	0	0	111.9	T96 V97 I98 M102 K103	T96-G100 PolarHBondContact O-N 2.93Å; V97-G100 WeakPolarHBondContact O-CA 3.36Å; V97-G100 PolarHBondContact O-N 2.6Å; V97-G100 VanDerWaalsContact O-N 3.11Å; I98-G100 VanDerWaalsContact C-N 3.34Å; G100-M102 PolarHBondContact O-N 3.22Å; G100-K103 WeakPolarHBondContact O-CB 3.36Å; G100-K103 PolarHBondContact O-N 3.41Å; G100-K103 VanDerWaalsContact O-N 3.12Å
101	L	98.6	Very high	98.2	Very high	1 Å²	1	28 Å²	28	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-63.2	-23.9	175.1	-74	-176	0	0	0	113.2	T60 R67 V97 I98 K103 V292 L333	T60-L101 HydrophobicContact CG2-CD1 3.96Å; R67-L101 PolarHBondContact NE-O 2.97Å; R67-L101 VanDerWaalsContact NE-O 3.13Å; R67-L101 VanDerWaalsContact NH1-CA 3.31Å; R67-L101 PolarHBondContact NH1-O 2.88Å; R67-L101 VanDerWaalsContact NH1-O 3.07Å; R67-L101 PolarHBondContact NH2-O 3.2Å; V97-L101 HydrophobicContact CG1-CD1 4.11Å; V97-L101 HydrophobicContact CG1-CG 4.38Å; V97-L101 WeakPolarHBondContact O-CB 3.32Å; V97-L101 VanDerWaalsContact O-CG 3.32Å; V97-L101 WeakPolarHBondContact O-CG 3.37Å; V97-L101 PolarHBondContact O-N 3.23Å; I98-L101 HydrophobicContact CD1-CD1 4.27Å; I98-L101 WeakPolarHBondContact O-CB 3.49Å; I98-L101 PolarHBondContact O-N 2.59Å; L101-K103 PolarHBondContact O-N 3.28Å; L101-V292 HydrophobicContact CD2-CG1 4.23Å; L101-V292 HydrophobicContact CD2-CG2 4.26Å; L101-L333 HydrophobicContact CD1-CD1 4.2Å; L101-L333 HydrophobicContact CD1-CD2 4.06Å; L101-L333 HydrophobicContact CD2-CD1 4.02Å; L101-L333 HydrophobicContact CD2-CD2 3.79Å
102	M	98.6	Very high	98.2	Very high	14 Å²	14	25.2 Å²	25.2	7%	0.069	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	4.4	174.3	-62.1	-50	-64.3	0	0	114.1	L59 R67 A71 M82 I83 L86 I98 L99 G100	L59-M102 HydrophobicContact CD1-SD 4.21Å; L59-M102 HydrophobicContact CD2-SD 4.22Å; R67-M102 HydrophobicContact CB-CE 4.32Å; R67-M102 HydrophobicContact CB-SD 4.29Å; A71-M102 HydrophobicContact CB-CE 3.95Å; M82-M102 HydrophobicContact CE-CE 4.18Å; M82-M102 HydrophobicContact CE-SD 4.33Å; M82-M102 HydrophobicContact SD-CE 4.28Å; I83-M102 HydrophobicContact CD1-CB 4.25Å; I83-M102 HydrophobicContact CG1-CB 4.19Å; I83-M102 HydrophobicContact CG1-CG 4.38Å; L86-M102 HydrophobicContact CD1-CG 4.11Å; L86-M102 HydrophobicContact CD1-SD 4.28Å; I98-M102 WeakPolarHBondContact O-CG 3.48Å; I98-M102 PolarHBondContact O-N 2.88Å; I98-M102 VanDerWaalsContact O-N 3.16Å; L99-M102 PolarHBondContact O-N 3.3Å; G100-M102 PolarHBondContact O-N 3.22Å
103	K	98.4	Very high	98.3	Very high	74 Å²	74	23 Å²	23	32%	0.322	13%	0.128	S	C	.	.	S	Bend	trans	-115.2	147.4	177	-63.6	171.5	-173.3	173.8	0	109.8	Y64 G100 L101 Q107 Y108 S111	Y64-K103 WeakPolarHBondContact CD2-O 3.44Å; G100-K103 WeakPolarHBondContact O-CB 3.36Å; G100-K103 PolarHBondContact O-N 3.41Å; G100-K103 VanDerWaalsContact O-N 3.12Å; L101-K103 PolarHBondContact O-N 3.28Å; K103-Q107 HydrophobicContact CB-CB 3.84Å; K103-Q107 HydrophobicContact CG-CB 4.38Å; K103-Y108 HydrophobicContact CD-CD2 4.28Å; K103-S111 PolarHBondContact NZ-OG 3.27Å; K103-S111 VanDerWaalsContact NZ-OG 3.1Å
104	S	97.9	Very high	98.4	Very high	24 Å²	24	23.5 Å²	23.5	17%	0.168	12%	0.124	C	C	.	.			trans	-62.8	160.7	164	56.5	0	0	0	0	109.7	S106 Q107 Y108	S104-S106 VanDerWaalsContact C-N 3.27Å; S104-S106 PolarHBondContact O-N 2.89Å; S104-Q107 PolarHBondContact O-N 3.11Å; S104-Q107 WeakPolarHBondContact OG-CB 3.39Å; S104-Q107 VanDerWaalsContact OG-CD 3.26Å; S104-Q107 WeakPolarHBondContact OG-CG 3.32Å; S104-Q107 PolarHBondContact OG-N 3.27Å; S104-Q107 PolarHBondContact OG-OE1 3.23Å; S104-Q107 VanDerWaalsContact OG-OE1 3.05Å; S104-Y108 WeakPolarHBondContact O-CB 3.43Å; S104-Y108 PolarHBondContact O-N 2.94Å
105	T	97.4	Very high	98.3	Very high	34 Å²	34	25.3 Å²	25.3	21%	0.209	15%	0.146	C	C	.	.	H	α-helix	trans	-50.7	-47	176.8	-53.2	0	0	0	0	112	Q107 Y108 D109 S293 V297	T105-Q107 PolarHBondContact O-N 3.41Å; T105-Y108 PolarHBondContact O-N 3.36Å; T105-D109 WeakPolarHBondContact O-CB 3.41Å; T105-D109 PolarHBondContact O-N 3.31Å; T105-S293 WeakPolarHBondContact CG2-O 3.17Å; T105-V297 HydrophobicContact CG2-CG2 4.29Å
106	S	98.1	Very high	98.2	Very high	22 Å²	22	23.6 Å²	23.6	15%	0.154	14%	0.138	C	C	.	.	H	α-helix	trans	-68.1	-35.3	179.2	-47.9	0	0	0	0	113.4	S104 A110 E141	S104-S106 VanDerWaalsContact C-N 3.27Å; S104-S106 PolarHBondContact O-N 2.89Å; S106-A110 WeakPolarHBondContact O-CB 3.43Å; S106-A110 PolarHBondContact O-N 3.28Å; S106-E141 WeakPolarHBondContact OG-CG 3.29Å
107	Q	98.6	Very high	98.1	Very high	48 Å²	48	20.3 Å²	20.3	22%	0.224	12%	0.117	C	C	.	.	H	α-helix	trans	-69	-36.4	173.6	-74.1	170.3	-29.3	0	0	112.2	Y64 K103 S104 T105 S111 V145 L149	Y64-Q107 PolarHBondContact OH-OE1 3.15Å; K103-Q107 HydrophobicContact CB-CB 3.84Å; K103-Q107 HydrophobicContact CG-CB 4.38Å; S104-Q107 PolarHBondContact O-N 3.11Å; S104-Q107 WeakPolarHBondContact OG-CB 3.39Å; S104-Q107 VanDerWaalsContact OG-CD 3.26Å; S104-Q107 WeakPolarHBondContact OG-CG 3.32Å; S104-Q107 PolarHBondContact OG-N 3.27Å; S104-Q107 PolarHBondContact OG-OE1 3.23Å; S104-Q107 VanDerWaalsContact OG-OE1 3.05Å; T105-Q107 PolarHBondContact O-N 3.41Å; Q107-S111 WeakPolarHBondContact O-CB 3.2Å; Q107-S111 PolarHBondContact O-N 2.94Å; Q107-S111 PolarHBondContact O-OG 3.32Å; Q107-V145 HydrophobicContact CB-CG1 4.08Å; Q107-V145 HydrophobicContact CG-CG1 3.45Å; Q107-V145 VanDerWaalsContact CG-CG1 3.45Å; Q107-L149 HydrophobicContact CB-CD1 4.19Å; Q107-L149 HydrophobicContact CG-CD1 4.12Å
108	Y	98.8	Very high	97.6	Very high	8 Å²	8	27.1 Å²	27.1	3%	0.031	15%	0.147	C	C	.	.	H	α-helix	trans	-66.8	-50.8	175.2	-174	-106.9	0	0	0	110.4	K103 S104 T105 A110 S111 E112 R289 V292	K103-Y108 HydrophobicContact CD-CD2 4.28Å; S104-Y108 WeakPolarHBondContact O-CB 3.43Å; S104-Y108 PolarHBondContact O-N 2.94Å; T105-Y108 PolarHBondContact O-N 3.36Å; Y108-A110 PolarHBondContact O-N 3.08Å; Y108-S111 WeakPolarHBondContact O-CA 3.47Å; Y108-S111 WeakPolarHBondContact O-CB 3.47Å; Y108-S111 PolarHBondContact O-N 3.29Å; Y108-E112 HydrophobicContact CD1-CG 4.29Å; Y108-E112 HydrophobicContact CE1-CG 3.93Å; Y108-E112 HydrophobicContact CE2-CG 4.41Å; Y108-E112 PolarHBondContact O-N 2.96Å; Y108-R289 HydrophobicContact CE1-CB 4.38Å; Y108-R289 HydrophobicContact CE1-CG 4.03Å; Y108-R289 WeakPolarHBondContact OH-CA 3.49Å; Y108-V292 HydrophobicContact CD1-CG1 3.97Å; Y108-V292 HydrophobicContact CD2-CG1 4.05Å; Y108-V292 HydrophobicContact CE1-CB 4.05Å; Y108-V292 HydrophobicContact CE1-CG1 3.88Å; Y108-V292 HydrophobicContact CE2-CG1 4.02Å; Y108-V292 HydrophobicContact CG-CG1 4.04Å
109	D	98.7	Very high	97.1	Very high	1 Å²	1	30 Å²	30	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-59.4	-44.6	176.5	-79.6	-5.6	0	0	0	112.1	T105 S111 E112 I113 I130 R134 I142	T105-D109 WeakPolarHBondContact O-CB 3.41Å; T105-D109 PolarHBondContact O-N 3.31Å; D109-S111 VanDerWaalsContact C-N 3.28Å; D109-S111 PolarHBondContact O-N 2.87Å; D109-E112 PolarHBondContact O-N 2.83Å; D109-I113 VanDerWaalsContact O-CG1 3.31Å; D109-I113 WeakPolarHBondContact O-CG1 3.45Å; D109-I113 PolarHBondContact O-N 3.44Å; D109-I130 HydrophobicContact CB-CG2 4.11Å; D109-R134 IonicContact OD1-CZ 2.77Å; D109-R134 IonicContact OD1-NE 3.98Å; D109-R134 IonicContact OD1-NH2 2.8Å; D109-R134 PolarHBondContact OD1-NH2 3.11Å; D109-R134 IonicContact OD2-CZ 2.77Å; D109-R134 IonicContact OD2-NE 3.77Å; D109-R134 PolarHBondContact OD2-NE 3.06Å; D109-R134 IonicContact OD2-NH2 3.76Å; D109-R134 PolarHBondContact OD2-NH2 3.44Å; D109-I142 HydrophobicContact CB-CD1 3.71Å; D109-I142 HydrophobicContact CB-CG1 3.96Å
110	A	98.7	Very high	96.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-38.4	174.8	0	0	0	0	0	112.1	S106 Y108 R114 I142 V145 Y146 L149 F150	S106-A110 WeakPolarHBondContact O-CB 3.43Å; S106-A110 PolarHBondContact O-N 3.28Å; Y108-A110 PolarHBondContact O-N 3.08Å; A110-R114 WeakPolarHBondContact O-CB 3.34Å; A110-R114 PolarHBondContact O-N 3.06Å; A110-I142 HydrophobicContact CB-CG2 4.41Å; A110-V145 HydrophobicContact CB-CG1 4.17Å; A110-Y146 HydrophobicContact CB-CD2 3.97Å; A110-L149 HydrophobicContact CB-CD1 4.44Å; A110-F150 HydrophobicContact CB-CE2 4.21Å; A110-F150 WeakPolarHBondContact O-CE2 3.27Å
111	S	98.4	Very high	95.9	Very high	23 Å²	23	40.3 Å²	40.3	16%	0.161	25%	0.245	C	C	.	.	H	α-helix	trans	-66.7	-42.9	175.5	-60.5	0	0	0	0	112.3	K103 Q107 Y108 D109 R114 G115	K103-S111 PolarHBondContact NZ-OG 3.27Å; K103-S111 VanDerWaalsContact NZ-OG 3.1Å; Q107-S111 WeakPolarHBondContact O-CB 3.2Å; Q107-S111 PolarHBondContact O-N 2.94Å; Q107-S111 PolarHBondContact O-OG 3.32Å; Y108-S111 WeakPolarHBondContact O-CA 3.47Å; Y108-S111 WeakPolarHBondContact O-CB 3.47Å; Y108-S111 PolarHBondContact O-N 3.29Å; D109-S111 VanDerWaalsContact C-N 3.28Å; D109-S111 PolarHBondContact O-N 2.87Å; S111-R114 PolarHBondContact O-N 2.91Å; S111-G115 PolarHBondContact O-N 3.42Å
112	E	98.6	Very high	95.6	Very high	37 Å²	37	41.8 Å²	41.8	17%	0.173	25%	0.253	C	S	.	.	H	α-helix	trans	-65.9	-42.3	178.4	-72	-65.1	113.2	0	0	111.1	Y108 D109 G115 S116 T126 I130 R289	Y108-E112 HydrophobicContact CD1-CG 4.29Å; Y108-E112 HydrophobicContact CE1-CG 3.93Å; Y108-E112 HydrophobicContact CE2-CG 4.41Å; Y108-E112 PolarHBondContact O-N 2.96Å; D109-E112 PolarHBondContact O-N 2.83Å; E112-G115 PolarHBondContact O-N 3.49Å; E112-S116 PolarHBondContact O-N 2.86Å; E112-T126 HydrophobicContact CB-CG2 4.18Å; E112-I130 HydrophobicContact CB-CD1 3.45Å; E112-I130 VanDerWaalsContact CB-CD1 3.45Å; E112-I130 HydrophobicContact CG-CD1 4.46Å; E112-R289 HydrophobicContact CG-CG 4.22Å; E112-R289 WeakPolarHBondContact OE2-CD 3.28Å; E112-R289 IonicContact OE2-NH1 3.6Å
113	I	98.4	Very high	95.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-45.7	173.4	-64.9	162	0	0	0	110.7	D109 G115 S116 I117 L127 I130 L131 I142 Y146 L154	D109-I113 VanDerWaalsContact O-CG1 3.31Å; D109-I113 WeakPolarHBondContact O-CG1 3.45Å; D109-I113 PolarHBondContact O-N 3.44Å; I113-G115 VanDerWaalsContact C-N 3.26Å; I113-G115 PolarHBondContact O-N 3.24Å; I113-S116 PolarHBondContact O-N 3.12Å; I113-S116 VanDerWaalsContact O-N 3.16Å; I113-S116 PolarHBondContact O-OG 3.3Å; I113-I117 HydrophobicContact CG2-CD1 4.14Å; I113-I117 WeakPolarHBondContact O-CG1 3.38Å; I113-I117 PolarHBondContact O-N 3.32Å; I113-L127 HydrophobicContact CG2-CD1 3.87Å; I113-I130 HydrophobicContact CD1-CG2 3.71Å; I113-I130 HydrophobicContact CG1-CB 4.19Å; I113-I130 HydrophobicContact CG1-CD1 3.92Å; I113-I130 HydrophobicContact CG1-CG2 3.87Å; I113-L131 HydrophobicContact CD1-CD2 4.01Å; I113-I142 HydrophobicContact CD1-CG2 3.71Å; I113-Y146 HydrophobicContact CB-CE2 4.36Å; I113-Y146 HydrophobicContact CG2-CE2 4.1Å; I113-L154 HydrophobicContact CD1-CD1 4.48Å; I113-L154 HydrophobicContact CG2-CD1 3.59Å
114	R	97.7	Very high	95.4	Very high	47 Å²	47	42.7 Å²	42.7	18%	0.177	26%	0.26	C	S	.	.	H	α-helix	trans	-62.4	-38.7	177.5	-177.3	64.7	-169.4	132.9	15.6	111	A110 S111 S116 K118 Y146 F150 D157	A110-R114 WeakPolarHBondContact O-CB 3.34Å; A110-R114 PolarHBondContact O-N 3.06Å; S111-R114 PolarHBondContact O-N 2.91Å; R114-S116 VanDerWaalsContact C-N 3.32Å; R114-K118 WeakPolarHBondContact O-CB 3.43Å; R114-K118 PolarHBondContact O-N 3.16Å; R114-K118 VanDerWaalsContact O-N 3.17Å; R114-Y146 HydrophobicContact CB-CE2 3.81Å; R114-Y146 WeakPolarHBondContact CD-OH 3.26Å; R114-F150 HydrophobicContact CB-CD2 4.09Å; R114-F150 HydrophobicContact CB-CE1 4.34Å; R114-F150 HydrophobicContact CB-CE2 3.67Å; R114-F150 HydrophobicContact CB-CZ 3.82Å; R114-F150 HydrophobicContact CG-CD1 4.17Å; R114-F150 HydrophobicContact CG-CD2 4.2Å; R114-F150 HydrophobicContact CG-CE1 4.11Å; R114-F150 HydrophobicContact CG-CE2 4.14Å; R114-F150 HydrophobicContact CG-CG 4.22Å; R114-F150 HydrophobicContact CG-CZ 4.11Å; R114-D157 IonicContact CZ-OD2 3.68Å; R114-D157 IonicContact NH1-OD2 2.74Å; R114-D157 PolarHBondContact NH1-OD2 3.21Å
115	G	96.8	Very high	95.4	Very high	51 Å²	51	45.6 Å²	45.6	53%	0.526	27%	0.271	S	S	.	.	H	α-helix	trans	-64.9	-33.4	175.5	0	0	0	0	0	113.1	S111 E112 I113	S111-G115 PolarHBondContact O-N 3.42Å; E112-G115 PolarHBondContact O-N 3.49Å; I113-G115 VanDerWaalsContact C-N 3.26Å; I113-G115 PolarHBondContact O-N 3.24Å
116	S	96.6	Very high	95.4	Very high	4 Å²	4	44.1 Å²	44.1	3%	0.028	26%	0.262	C	S	.	.	H	α-helix	trans	-77.2	-19.4	-179.2	71.5	0	0	0	0	114.2	E112 I113 R114 T122 D123	E112-S116 PolarHBondContact O-N 2.86Å; I113-S116 PolarHBondContact O-N 3.12Å; I113-S116 VanDerWaalsContact O-N 3.16Å; I113-S116 PolarHBondContact O-OG 3.3Å; R114-S116 VanDerWaalsContact C-N 3.32Å; S116-T122 CarbonylContact O-C 3.51Å; S116-T122 WeakPolarHBondContact O-CA 3.35Å; S116-D123 WeakPolarHBondContact CB-O 3.29Å; S116-D123 PolarHBondContact O-N 3Å
117	I	94.6	Very high	95.4	Very high	5 Å²	5	43 Å²	43	3%	0.026	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	13.4	-178.7	70.9	-165.7	0	0	0	112.8	I113 T122 L127 D157 D161	I113-I117 HydrophobicContact CG2-CD1 4.14Å; I113-I117 WeakPolarHBondContact O-CG1 3.38Å; I113-I117 PolarHBondContact O-N 3.32Å; I117-T122 HydrophobicContact CG2-CG2 4.15Å; I117-L127 HydrophobicContact CG2-CD1 4.32Å; I117-L127 HydrophobicContact CG2-CD2 4.14Å; I117-D157 HydrophobicContact CD1-CB 3.71Å; I117-D161 WeakPolarHBondContact CA-OD1 3.38Å; I117-D161 HydrophobicContact CB-CB 3.91Å; I117-D161 HydrophobicContact CG2-CB 4.02Å
118	K	90.1	Very high	95.4	Very high	144 Å²	144	41 Å²	41	63%	0.626	25%	0.245	S	C	*	.	S	Bend	trans	-109.2	117.3	177.9	-179.8	-173.2	176.8	-171.2	0	109.2	R114	R114-K118 WeakPolarHBondContact O-CB 3.43Å; R114-K118 PolarHBondContact O-N 3.16Å; R114-K118 VanDerWaalsContact O-N 3.17Å
119	G	87.3	Confident	95.4	Very high	61 Å²	61	40.6 Å²	40.6	63%	0.629	24%	0.243	S	C	*	.	S	Bend	trans	124.4	-156.3	172.7	0	0	0	0	0	111
120	L	82.3	Confident	95.4	Very high	190 Å²	190	40.6 Å²	40.6	100%	0.995	24%	0.243	S	C	*	.	S	Bend	trans	-89.3	120.5	172.4	-65.8	176.9	0	0	0	109
121	G	88.6	Confident	95.4	Very high	59 Å²	59	40.6 Å²	40.6	61%	0.608	24%	0.243	S	C	*	.	S	Bend	trans	84.2	171.1	-175.5	0	0	0	0	0	112.9
122	T	93.4	Very high	95.4	Very high	31 Å²	31	39.7 Å²	39.7	19%	0.19	24%	0.237	C	C	.	.			trans	-121.8	141.8	-176.7	-50.7	0	0	0	0	108.4	S116 I117 E124 L127 D161	S116-T122 CarbonylContact O-C 3.51Å; S116-T122 WeakPolarHBondContact O-CA 3.35Å; I117-T122 HydrophobicContact CG2-CG2 4.15Å; T122-E124 HydrophobicContact CG2-CG 4.18Å; T122-E124 PolarHBondContact O-N 3.14Å; T122-L127 HydrophobicContact CG2-CD2 4.36Å; T122-D161 PolarHBondContact OG1-O 3.29Å; T122-D161 PolarHBondContact OG1-OD1 2.89Å
123	D	96.3	Very high	95.3	Very high	42 Å²	42	38 Å²	38	23%	0.225	23%	0.23	C	C	.	.			trans	-92.6	82.2	167.5	176.6	-11.7	0	0	0	107.7	S116 E125 T126 L127 K285	S116-D123 WeakPolarHBondContact CB-O 3.29Å; S116-D123 PolarHBondContact O-N 3Å; D123-E125 PolarHBondContact O-N 2.86Å; D123-E125 PolarHBondContact OD1-N 2.86Å; D123-T126 PolarHBondContact O-N 3.21Å; D123-T126 WeakPolarHBondContact OD1-CB 3.16Å; D123-T126 PolarHBondContact OD1-N 3.45Å; D123-T126 PolarHBondContact OD1-OG1 3.28Å; D123-T126 VanDerWaalsContact OD1-OG1 3.11Å; D123-T126 PolarHBondContact OD2-OG1 3.11Å; D123-L127 PolarHBondContact O-N 3.38Å; D123-L127 VanDerWaalsContact O-N 3.13Å; D123-K285 IonicContact OD2-NZ 2.74Å; D123-K285 PolarHBondContact OD2-NZ 3.29Å
124	E	96.8	Very high	95.3	Very high	66 Å²	66	38.7 Å²	38.7	31%	0.308	23%	0.232	S	C	.	.	H	α-helix	trans	-63.4	-29.5	-176.5	-57	84.6	176.5	0	0	111.2	T122 L127 I128 F166	T122-E124 HydrophobicContact CG2-CG 4.18Å; T122-E124 PolarHBondContact O-N 3.14Å; E124-L127 PolarHBondContact O-N 3.33Å; E124-I128 HydrophobicContact CB-CD1 4.29Å; E124-I128 WeakPolarHBondContact O-CB 3.47Å; E124-I128 WeakPolarHBondContact O-CD1 3.36Å; E124-I128 WeakPolarHBondContact O-CG1 3.23Å; E124-I128 PolarHBondContact O-N 3.41Å; E124-F166 HydrophobicContact CB-CZ 4.27Å; E124-F166 HydrophobicContact CG-CE1 4.09Å; E124-F166 HydrophobicContact CG-CZ 4.31Å
125	E	96.9	Very high	95.2	Very high	85 Å²	85	38.6 Å²	38.6	40%	0.397	24%	0.239	S	C	.	.	H	α-helix	trans	-62.7	-46.6	179.1	-169.9	-173.9	160.2	0	0	111.7	D123 E129 K272 I286	D123-E125 PolarHBondContact O-N 2.86Å; D123-E125 PolarHBondContact OD1-N 2.86Å; E125-E129 WeakPolarHBondContact O-CB 3.47Å; E125-E129 PolarHBondContact O-N 3.45Å; E125-K272 WeakPolarHBondContact OE1-CE 3.48Å; E125-K272 IonicContact OE1-NZ 2.99Å; E125-I286 VanDerWaalsContact OE1-CD1 3.26Å; E125-I286 WeakPolarHBondContact OE1-CD1 3.42Å
126	T	97.9	Very high	95.1	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.012	22%	0.221	C	C	.	.	H	α-helix	trans	-68.1	-43.1	176.8	-60.8	0	0	0	0	110.9	E112 D123 I128 E129 I130 R289	E112-T126 HydrophobicContact CB-CG2 4.18Å; D123-T126 PolarHBondContact O-N 3.21Å; D123-T126 WeakPolarHBondContact OD1-CB 3.16Å; D123-T126 PolarHBondContact OD1-N 3.45Å; D123-T126 PolarHBondContact OD1-OG1 3.28Å; D123-T126 VanDerWaalsContact OD1-OG1 3.11Å; D123-T126 PolarHBondContact OD2-OG1 3.11Å; T126-I128 PolarHBondContact O-N 2.8Å; T126-E129 PolarHBondContact O-N 3.26Å; T126-I130 HydrophobicContact CG2-CD1 3.83Å; T126-I130 WeakPolarHBondContact O-CG1 3.48Å; T126-I130 PolarHBondContact O-N 3.1Å; T126-I130 VanDerWaalsContact O-N 3.07Å; T126-R289 PolarHBondContact OG1-NH1 3.44Å
127	L	98.1	Very high	95	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.1	-45.5	179.5	-172.7	62.3	0	0	0	111.7	I113 I117 T122 D123 E124 L131 V158 T162 F166 L170	I113-L127 HydrophobicContact CG2-CD1 3.87Å; I117-L127 HydrophobicContact CG2-CD1 4.32Å; I117-L127 HydrophobicContact CG2-CD2 4.14Å; T122-L127 HydrophobicContact CG2-CD2 4.36Å; D123-L127 PolarHBondContact O-N 3.38Å; D123-L127 VanDerWaalsContact O-N 3.13Å; E124-L127 PolarHBondContact O-N 3.33Å; L127-L131 HydrophobicContact CD1-CD1 3.58Å; L127-L131 HydrophobicContact CD1-CG 4.08Å; L127-L131 HydrophobicContact CG-CD1 4.02Å; L127-L131 WeakPolarHBondContact O-CB 3.17Å; L127-L131 WeakPolarHBondContact O-CG 3.39Å; L127-L131 PolarHBondContact O-N 2.99Å; L127-V158 HydrophobicContact CD1-CG2 4.35Å; L127-T162 HydrophobicContact CD2-CG2 3.77Å; L127-F166 HydrophobicContact CD2-CZ 4.49Å; L127-L170 HydrophobicContact CD2-CD1 3.56Å; L127-L170 HydrophobicContact CG-CD1 3.88Å
128	I	98.6	Very high	95.2	Very high	5 Å²	5	42.3 Å²	42.3	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-64.1	-49	177.1	-71	168.4	0	0	0	110.7	E124 T126 I130 C132 F166 D250 K253 S254 V257	E124-I128 HydrophobicContact CB-CD1 4.29Å; E124-I128 WeakPolarHBondContact O-CB 3.47Å; E124-I128 WeakPolarHBondContact O-CD1 3.36Å; E124-I128 WeakPolarHBondContact O-CG1 3.23Å; E124-I128 PolarHBondContact O-N 3.41Å; T126-I128 PolarHBondContact O-N 2.8Å; I128-I130 VanDerWaalsContact C-N 3.27Å; I128-I130 PolarHBondContact O-N 3.47Å; I128-C132 WeakPolarHBondContact O-CB 3.1Å; I128-C132 PolarHBondContact O-N 3.32Å; I128-C132 PolarHBondContact O-SG 3.43Å; I128-F166 HydrophobicContact CD1-CE2 3.91Å; I128-F166 HydrophobicContact CD1-CZ 4.19Å; I128-F166 HydrophobicContact CG1-CE2 3.68Å; I128-F166 HydrophobicContact CG1-CZ 4Å; I128-D250 HydrophobicContact CD1-CB 4.01Å; I128-K253 HydrophobicContact CD1-CB 3.95Å; I128-K253 HydrophobicContact CD1-CD 4.41Å; I128-S254 WeakPolarHBondContact CG1-OG 3.46Å; I128-V257 HydrophobicContact CG2-CB 4.18Å; I128-V257 HydrophobicContact CG2-CG2 3.78Å
129	E	98.6	Very high	95.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-54.1	-47	179.8	-174.3	-169.5	114.5	0	0	110.9	E125 T126 S133 R134 Y268 F269 K272 R289	E125-E129 WeakPolarHBondContact O-CB 3.47Å; E125-E129 PolarHBondContact O-N 3.45Å; T126-E129 PolarHBondContact O-N 3.26Å; E129-S133 VanDerWaalsContact O-CB 3.24Å; E129-S133 WeakPolarHBondContact O-CB 3.36Å; E129-S133 PolarHBondContact O-N 2.93Å; E129-S133 PolarHBondContact O-OG 3.16Å; E129-R134 PolarHBondContact O-NH1 3.32Å; E129-Y268 HydrophobicContact CG-CE1 4.35Å; E129-F269 HydrophobicContact CG-CE1 4.2Å; E129-K272 HydrophobicContact CG-CD 4.33Å; E129-K272 WeakPolarHBondContact OE2-CD 3.45Å; E129-K272 WeakPolarHBondContact OE2-CE 3.49Å; E129-K272 IonicContact OE2-NZ 3.58Å; E129-K272 PolarHBondContact OE2-NZ 3.38Å; E129-R289 VanDerWaalsContact CD-NE 3.35Å; E129-R289 IonicContact OE1-CZ 2.67Å; E129-R289 IonicContact OE1-NE 2.91Å; E129-R289 PolarHBondContact OE1-NE 2.86Å; E129-R289 IonicContact OE1-NH2 2.74Å; E129-R289 IonicContact OE2-CZ 2.86Å; E129-R289 IonicContact OE2-NE 3.66Å; E129-R289 PolarHBondContact OE2-NE 3.04Å; E129-R289 IonicContact OE2-NH2 2.85Å; E129-R289 PolarHBondContact OE2-NH2 2.76Å
130	I	98.6	Very high	96.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-72.6	-56.3	-176.4	-59	172.5	0	0	0	111	D109 E112 I113 T126 I128 C132 S133 R134	D109-I130 HydrophobicContact CB-CG2 4.11Å; E112-I130 HydrophobicContact CB-CD1 3.45Å; E112-I130 VanDerWaalsContact CB-CD1 3.45Å; E112-I130 HydrophobicContact CG-CD1 4.46Å; I113-I130 HydrophobicContact CD1-CG2 3.71Å; I113-I130 HydrophobicContact CG1-CB 4.19Å; I113-I130 HydrophobicContact CG1-CD1 3.92Å; I113-I130 HydrophobicContact CG1-CG2 3.87Å; T126-I130 HydrophobicContact CG2-CD1 3.83Å; T126-I130 WeakPolarHBondContact O-CG1 3.48Å; T126-I130 PolarHBondContact O-N 3.1Å; T126-I130 VanDerWaalsContact O-N 3.07Å; I128-I130 VanDerWaalsContact C-N 3.27Å; I128-I130 PolarHBondContact O-N 3.47Å; I130-C132 VanDerWaalsContact C-N 3.28Å; I130-C132 PolarHBondContact O-N 3.4Å; I130-S133 PolarHBondContact O-N 2.93Å; I130-R134 HydrophobicContact CG2-CG 4.34Å; I130-R134 WeakPolarHBondContact O-CB 3.49Å; I130-R134 VanDerWaalsContact O-CD 3.25Å; I130-R134 WeakPolarHBondContact O-CD 3.34Å; I130-R134 PolarHBondContact O-N 3.27Å
131	L	98.4	Very high	96.8	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-68.4	-26.6	-172.9	-64.2	-176.5	0	0	0	113.3	I113 L127 L139 V158 L170 V174	I113-L131 HydrophobicContact CD1-CD2 4.01Å; L127-L131 HydrophobicContact CD1-CD1 3.58Å; L127-L131 HydrophobicContact CD1-CG 4.08Å; L127-L131 HydrophobicContact CG-CD1 4.02Å; L127-L131 WeakPolarHBondContact O-CB 3.17Å; L127-L131 WeakPolarHBondContact O-CG 3.39Å; L127-L131 PolarHBondContact O-N 2.99Å; L131-L139 HydrophobicContact CD2-CD2 3.84Å; L131-V158 HydrophobicContact CD1-CG2 4.21Å; L131-L170 HydrophobicContact CB-CD2 4.11Å; L131-L170 HydrophobicContact CD1-CB 4.1Å; L131-L170 HydrophobicContact CD1-CD1 4.17Å; L131-L170 HydrophobicContact CD1-CD2 4.06Å; L131-L170 HydrophobicContact CD1-CG 4.34Å; L131-V174 HydrophobicContact CD1-CG2 4.04Å; L131-V174 HydrophobicContact CD2-CG2 3.93Å
132	C	98.5	Very high	97.3	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.02	15%	0.147	C	C	.	.	H	α-helix	trans	-94.7	-8.7	-178	-60	0	0	0	0	114.6	I128 I130 V257 L258	I128-C132 WeakPolarHBondContact O-CB 3.1Å; I128-C132 PolarHBondContact O-N 3.32Å; I128-C132 PolarHBondContact O-SG 3.43Å; I130-C132 VanDerWaalsContact C-N 3.28Å; I130-C132 PolarHBondContact O-N 3.4Å; C132-V257 HydrophobicContact CB-CB 3.92Å; C132-V257 HydrophobicContact CB-CG1 3.53Å; C132-L258 HydrophobicContact CB-CD2 3.91Å; C132-L258 HydrophobicContact CB-CG 3.87Å; C132-L258 WeakPolarHBondContact O-CD2 3.13Å
133	S	98.1	Very high	97.5	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-112.7	-19.3	-179.9	66.6	0	0	0	0	114.5	E129 I130 C261 K265	E129-S133 VanDerWaalsContact O-CB 3.24Å; E129-S133 WeakPolarHBondContact O-CB 3.36Å; E129-S133 PolarHBondContact O-N 2.93Å; E129-S133 PolarHBondContact O-OG 3.16Å; I130-S133 PolarHBondContact O-N 2.93Å; S133-C261 WeakPolarHBondContact CB-SG 3.43Å; S133-K265 WeakPolarHBondContact O-CE 3.49Å; S133-K265 PolarHBondContact O-NZ 2.96Å
134	R	97.4	Very high	97.6	Very high	14 Å²	14	32.8 Å²	32.8	5%	0.053	16%	0.164	C	C	.	.	S	Bend	trans	-76.3	141	177.7	-80.2	41.1	167.7	-160.2	-1.4	109.4	D109 E129 I130 E138 L139 I142	D109-R134 IonicContact OD1-CZ 2.77Å; D109-R134 IonicContact OD1-NE 3.98Å; D109-R134 IonicContact OD1-NH2 2.8Å; D109-R134 PolarHBondContact OD1-NH2 3.11Å; D109-R134 IonicContact OD2-CZ 2.77Å; D109-R134 IonicContact OD2-NE 3.77Å; D109-R134 PolarHBondContact OD2-NE 3.06Å; D109-R134 IonicContact OD2-NH2 3.76Å; D109-R134 PolarHBondContact OD2-NH2 3.44Å; E129-R134 PolarHBondContact O-NH1 3.32Å; I130-R134 HydrophobicContact CG2-CG 4.34Å; I130-R134 WeakPolarHBondContact O-CB 3.49Å; I130-R134 VanDerWaalsContact O-CD 3.25Å; I130-R134 WeakPolarHBondContact O-CD 3.34Å; I130-R134 PolarHBondContact O-N 3.27Å; R134-E138 WeakPolarHBondContact CA-OE2 3.49Å; R134-E138 HydrophobicContact CB-CB 3.91Å; R134-E138 HydrophobicContact CG-CB 4.14Å; R134-L139 HydrophobicContact CB-CD2 3.88Å; R134-L139 HydrophobicContact CB-CG 3.95Å; R134-I142 HydrophobicContact CB-CD1 4.4Å; R134-I142 HydrophobicContact CG-CD1 3.82Å
135	S	95.3	Very high	97.7	Very high	45 Å²	45	30.1 Å²	30.1	32%	0.315	15%	0.152	S	C	.	.			trans	-66.3	167.3	173.6	60.3	0	0	0	0	111.3	D137 E138 L139	S135-D137 VanDerWaalsContact C-N 3.3Å; S135-D137 PolarHBondContact O-N 3.24Å; S135-E138 WeakPolarHBondContact CB-OE2 3.44Å; S135-E138 PolarHBondContact N-OE2 3.22Å; S135-E138 PolarHBondContact O-N 3.1Å; S135-E138 WeakPolarHBondContact OG-CB 3.34Å; S135-E138 VanDerWaalsContact OG-CG 3.24Å; S135-E138 WeakPolarHBondContact OG-CG 3.35Å; S135-E138 PolarHBondContact OG-N 3.02Å; S135-E138 PolarHBondContact OG-OE2 3.3Å; S135-L139 WeakPolarHBondContact O-CG 3.47Å; S135-L139 PolarHBondContact O-N 2.76Å
136	N	95.4	Very high	97.7	Very high	28 Å²	28	26.1 Å²	26.1	15%	0.15	13%	0.133	C	C	.	.	H	α-helix	trans	-57.8	-45.3	177.7	-161.3	70.4	0	0	0	111.2	L139 V140 T176 R178	N136-L139 PolarHBondContact O-N 2.73Å; N136-V140 WeakPolarHBondContact O-CG2 3.38Å; N136-V140 PolarHBondContact O-N 3.05Å; N136-T176 PolarHBondContact ND2-O 3.23Å; N136-T176 VanDerWaalsContact ND2-O 3.15Å; N136-T176 WeakPolarHBondContact OD1-CA 3.22Å; N136-T176 PolarHBondContact OD1-O 2.64Å; N136-R178 HydrophobicContact CB-CB 4.05Å; N136-R178 PolarHBondContact OD1-N 3.38Å
137	D	94.8	Very high	97.8	Very high	73 Å²	73	28.6 Å²	28.6	39%	0.39	15%	0.151	S	C	.	.	H	α-helix	trans	-62.8	-44.5	177.5	-64.6	-17.6	0	0	0	112.7	H19 S135 L139 V140 E141	H19-D137 IonicContact CE1-OD2 3.73Å; H19-D137 PolarHBondContact CE1-OD2 2.81Å; H19-D137 VanDerWaalsContact CE1-OD2 3.26Å; H19-D137 IonicContact ND1-OD2 2.77Å; S135-D137 VanDerWaalsContact C-N 3.3Å; S135-D137 PolarHBondContact O-N 3.24Å; D137-L139 VanDerWaalsContact C-N 3.3Å; D137-L139 PolarHBondContact O-N 3Å; D137-V140 PolarHBondContact O-N 3.27Å; D137-E141 PolarHBondContact O-N 3.01Å; D137-E141 VanDerWaalsContact O-N 3.08Å
138	E	96.9	Very high	97.7	Very high	37 Å²	37	32.9 Å²	32.9	17%	0.173	17%	0.174	C	C	.	.	H	α-helix	trans	-59.2	-43.1	175	-75.8	166.4	129.6	0	0	110.5	R134 S135 E141 I142 K265 R294	R134-E138 WeakPolarHBondContact CA-OE2 3.49Å; R134-E138 HydrophobicContact CB-CB 3.91Å; R134-E138 HydrophobicContact CG-CB 4.14Å; S135-E138 WeakPolarHBondContact CB-OE2 3.44Å; S135-E138 PolarHBondContact N-OE2 3.22Å; S135-E138 PolarHBondContact O-N 3.1Å; S135-E138 WeakPolarHBondContact OG-CB 3.34Å; S135-E138 VanDerWaalsContact OG-CG 3.24Å; S135-E138 WeakPolarHBondContact OG-CG 3.35Å; S135-E138 PolarHBondContact OG-N 3.02Å; S135-E138 PolarHBondContact OG-OE2 3.3Å; E138-E141 PolarHBondContact O-N 3.41Å; E138-I142 WeakPolarHBondContact O-CB 3.12Å; E138-I142 WeakPolarHBondContact O-CD1 3.29Å; E138-I142 WeakPolarHBondContact O-CG1 3.17Å; E138-I142 PolarHBondContact O-N 3.38Å; E138-K265 IonicContact OE2-NZ 3.26Å; E138-R294 IonicContact OE1-NH1 2.59Å; E138-R294 PolarHBondContact OE1-NH1 2.96Å
139	L	98.2	Very high	97.7	Very high	6 Å²	6	36.4 Å²	36.4	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-67.5	-36.6	178.3	-70.7	176.5	0	0	0	113	L131 R134 S135 N136 D137 I142 K143 L173 T176	L131-L139 HydrophobicContact CD2-CD2 3.84Å; R134-L139 HydrophobicContact CB-CD2 3.88Å; R134-L139 HydrophobicContact CB-CG 3.95Å; S135-L139 WeakPolarHBondContact O-CG 3.47Å; S135-L139 PolarHBondContact O-N 2.76Å; N136-L139 PolarHBondContact O-N 2.73Å; D137-L139 VanDerWaalsContact C-N 3.3Å; D137-L139 PolarHBondContact O-N 3Å; L139-I142 HydrophobicContact CD2-CD1 4.39Å; L139-I142 PolarHBondContact O-N 2.96Å; L139-K143 VanDerWaalsContact O-CG 3.32Å; L139-K143 WeakPolarHBondContact O-CG 3.42Å; L139-K143 PolarHBondContact O-N 3.46Å; L139-L173 HydrophobicContact CD1-CB 4.37Å; L139-T176 HydrophobicContact CB-CG2 3.66Å
140	V	98	Very high	97.6	Very high	69 Å²	69	39.5 Å²	39.5	42%	0.418	21%	0.206	S	C	.	.	H	α-helix	trans	-59.6	-48.1	173.1	169.3	0	0	0	0	110.3	N136 D137 K143 K144 T176	N136-V140 WeakPolarHBondContact O-CG2 3.38Å; N136-V140 PolarHBondContact O-N 3.05Å; D137-V140 PolarHBondContact O-N 3.27Å; V140-K143 PolarHBondContact O-N 3.47Å; V140-K144 PolarHBondContact O-N 3.33Å; V140-T176 HydrophobicContact CG2-CG2 3.72Å
141	E	98.1	Very high	97.6	Very high	74 Å²	74	47.4 Å²	47.4	35%	0.346	24%	0.24	S	C	.	.	H	α-helix	trans	-68.4	-40	179.5	-173.5	60.6	-162.5	0	0	111.8	S106 D137 E138 K143 K144 V145	S106-E141 WeakPolarHBondContact OG-CG 3.29Å; D137-E141 PolarHBondContact O-N 3.01Å; D137-E141 VanDerWaalsContact O-N 3.08Å; E138-E141 PolarHBondContact O-N 3.41Å; E141-K143 VanDerWaalsContact C-N 3.33Å; E141-K143 PolarHBondContact O-N 2.97Å; E141-K144 PolarHBondContact O-N 2.93Å; E141-K144 IonicContact OE1-NZ 2.75Å; E141-K144 IonicContact OE2-NZ 3.65Å; E141-V145 HydrophobicContact CG-CG2 4.28Å; E141-V145 WeakPolarHBondContact O-CB 3.47Å; E141-V145 WeakPolarHBondContact O-CG2 3.49Å; E141-V145 PolarHBondContact O-N 3.45Å
142	I	98.6	Very high	97.5	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-58.3	-44.9	174.9	-71.8	162.4	0	0	0	110.6	D109 A110 I113 R134 E138 L139 K144 V145 Y146 L154	D109-I142 HydrophobicContact CB-CD1 3.71Å; D109-I142 HydrophobicContact CB-CG1 3.96Å; A110-I142 HydrophobicContact CB-CG2 4.41Å; I113-I142 HydrophobicContact CD1-CG2 3.71Å; R134-I142 HydrophobicContact CB-CD1 4.4Å; R134-I142 HydrophobicContact CG-CD1 3.82Å; E138-I142 WeakPolarHBondContact O-CB 3.12Å; E138-I142 WeakPolarHBondContact O-CD1 3.29Å; E138-I142 WeakPolarHBondContact O-CG1 3.17Å; E138-I142 PolarHBondContact O-N 3.38Å; L139-I142 HydrophobicContact CD2-CD1 4.39Å; L139-I142 PolarHBondContact O-N 2.96Å; I142-K144 PolarHBondContact O-N 3.13Å; I142-V145 PolarHBondContact O-N 2.98Å; I142-Y146 WeakPolarHBondContact O-CB 3.41Å; I142-Y146 PolarHBondContact O-N 3.25Å; I142-L154 HydrophobicContact CG2-CD2 4.13Å
143	K	98.1	Very high	97.5	Very high	60 Å²	60	54.2 Å²	54.2	26%	0.261	27%	0.273	S	S	.	.	H	α-helix	trans	-58.8	-46.8	177.7	-77	169.8	76.7	179.4	0	112.2	L139 V140 E141 Y146 S147 L154 V174 T176	L139-K143 VanDerWaalsContact O-CG 3.32Å; L139-K143 WeakPolarHBondContact O-CG 3.42Å; L139-K143 PolarHBondContact O-N 3.46Å; V140-K143 PolarHBondContact O-N 3.47Å; E141-K143 VanDerWaalsContact C-N 3.33Å; E141-K143 PolarHBondContact O-N 2.97Å; K143-Y146 PolarHBondContact O-N 3.35Å; K143-S147 PolarHBondContact O-N 2.9Å; K143-S147 VanDerWaalsContact O-N 3.11Å; K143-L154 HydrophobicContact CG-CB 4.34Å; K143-L154 HydrophobicContact CG-CD2 3.71Å; K143-V174 HydrophobicContact CD-CG1 3.97Å; K143-V174 WeakPolarHBondContact CD-O 3.04Å; K143-V174 WeakPolarHBondContact CE-O 3.16Å; K143-V174 HydrophobicContact CG-CG1 4.23Å; K143-V174 PolarHBondContact NZ-O 2.74Å; K143-T176 HydrophobicContact CD-CG2 4.02Å
144	K	98.4	Very high	97.5	Very high	116 Å²	116	54.2 Å²	54.2	50%	0.504	27%	0.273	S	S	.	.	H	α-helix	trans	-60.3	-53.4	178.4	177.4	-173.4	166.6	-159.9	0	110.6	V140 E141 I142 Y146 S147 D148	V140-K144 PolarHBondContact O-N 3.33Å; E141-K144 PolarHBondContact O-N 2.93Å; E141-K144 IonicContact OE1-NZ 2.75Å; E141-K144 IonicContact OE2-NZ 3.65Å; I142-K144 PolarHBondContact O-N 3.13Å; K144-Y146 VanDerWaalsContact C-N 3.31Å; K144-Y146 PolarHBondContact O-N 3.37Å; K144-S147 WeakPolarHBondContact O-CB 3.34Å; K144-S147 PolarHBondContact O-N 2.77Å; K144-S147 VanDerWaalsContact O-N 3.14Å; K144-D148 PolarHBondContact O-N 3.4Å
145	V	98.3	Very high	97.5	Very high	11 Å²	11	55 Å²	55	7%	0.067	28%	0.282	C	S	.	.	H	α-helix	trans	-61.8	-38.2	179.8	170.3	0	0	0	0	112	Q107 A110 E141 I142 S147 D148 L149	Q107-V145 HydrophobicContact CB-CG1 4.08Å; Q107-V145 HydrophobicContact CG-CG1 3.45Å; Q107-V145 VanDerWaalsContact CG-CG1 3.45Å; A110-V145 HydrophobicContact CB-CG1 4.17Å; E141-V145 HydrophobicContact CG-CG2 4.28Å; E141-V145 WeakPolarHBondContact O-CB 3.47Å; E141-V145 WeakPolarHBondContact O-CG2 3.49Å; E141-V145 PolarHBondContact O-N 3.45Å; I142-V145 PolarHBondContact O-N 2.98Å; V145-S147 VanDerWaalsContact C-N 3.32Å; V145-S147 PolarHBondContact O-N 2.97Å; V145-D148 PolarHBondContact O-N 3.41Å; V145-L149 HydrophobicContact CG1-CD1 3.67Å; V145-L149 HydrophobicContact CG1-CG 3.99Å; V145-L149 WeakPolarHBondContact O-CB 3.41Å; V145-L149 VanDerWaalsContact O-CG 3.29Å; V145-L149 WeakPolarHBondContact O-CG 3.38Å; V145-L149 PolarHBondContact O-N 3.4Å
146	Y	98.6	Very high	97.6	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.8	-44.4	176	-166.9	-80.5	0	0	0	111.4	A110 I113 R114 I142 K143 K144 F150 K152 L154 D157	A110-Y146 HydrophobicContact CB-CD2 3.97Å; I113-Y146 HydrophobicContact CB-CE2 4.36Å; I113-Y146 HydrophobicContact CG2-CE2 4.1Å; R114-Y146 HydrophobicContact CB-CE2 3.81Å; R114-Y146 WeakPolarHBondContact CD-OH 3.26Å; I142-Y146 WeakPolarHBondContact O-CB 3.41Å; I142-Y146 PolarHBondContact O-N 3.25Å; K143-Y146 PolarHBondContact O-N 3.35Å; K144-Y146 VanDerWaalsContact C-N 3.31Å; K144-Y146 PolarHBondContact O-N 3.37Å; Y146-F150 AromaticContact CD1-CD2 3.99Å; Y146-F150 HydrophobicContact CD1-CD2 3.99Å; Y146-F150 AromaticContact CD2-CD2 3.8Å; Y146-F150 HydrophobicContact CD2-CD2 3.8Å; Y146-F150 AromaticContact CD2-CE2 3.9Å; Y146-F150 HydrophobicContact CD2-CE2 3.9Å; Y146-F150 HydrophobicContact CE1-CD2 4.05Å; Y146-F150 AromaticContact CE2-CD2 3.87Å; Y146-F150 HydrophobicContact CE2-CD2 3.87Å; Y146-F150 HydrophobicContact CE2-CE2 4.04Å; Y146-F150 AromaticContact CG-CD2 3.86Å; Y146-F150 HydrophobicContact CG-CD2 3.86Å; Y146-F150 HydrophobicContact CG-CE2 4.34Å; Y146-F150 AromaticContact CZ-CD2 3.99Å; Y146-F150 WeakPolarHBondContact O-CB 3.25Å; Y146-F150 WeakPolarHBondContact O-CD2 3.21Å; Y146-F150 PolarHBondContact O-N 3.23Å; Y146-K152 HydrophobicContact CD1-CB 4.39Å; Y146-K152 HydrophobicContact CE1-CB 3.87Å; Y146-L154 HydrophobicContact CD1-CB 3.98Å; Y146-L154 HydrophobicContact CD2-CD1 3.92Å; Y146-L154 HydrophobicContact CE1-CB 4.43Å; Y146-L154 HydrophobicContact CE1-CD1 4.5Å; Y146-L154 HydrophobicContact CE2-CD1 3.86Å; Y146-L154 HydrophobicContact CG-CB 4.06Å; Y146-L154 HydrophobicContact CG-CD1 4.27Å; Y146-D157 PolarHBondContact OH-OD2 2.98Å
147	S	98.1	Very high	97.7	Very high	54 Å²	54	60.4 Å²	60.4	38%	0.378	30%	0.3	S	S	.	.	H	α-helix	trans	-64.2	-43.7	175.3	-161.1	0	0	0	0	112	K143 K144 V145 L149 K151 K152	K143-S147 PolarHBondContact O-N 2.9Å; K143-S147 VanDerWaalsContact O-N 3.11Å; K144-S147 WeakPolarHBondContact O-CB 3.34Å; K144-S147 PolarHBondContact O-N 2.77Å; K144-S147 VanDerWaalsContact O-N 3.14Å; V145-S147 VanDerWaalsContact C-N 3.32Å; V145-S147 PolarHBondContact O-N 2.97Å; S147-L149 PolarHBondContact O-N 3.37Å; S147-K151 WeakPolarHBondContact O-CA 3.26Å; S147-K151 PolarHBondContact O-N 3.21Å; S147-K152 VanDerWaalsContact CA-O 3.23Å; S147-K152 WeakPolarHBondContact CA-O 3.11Å; S147-K152 PolarHBondContact OG-O 2.98Å
148	D	97.9	Very high	97.8	Very high	91 Å²	91	56.9 Å²	56.9	49%	0.487	28%	0.281	S	S	.	.	H	α-helix	trans	-63.5	-44.3	179.5	-72.4	-24.5	0	0	0	112.5	K144 V145 K151	K144-D148 PolarHBondContact O-N 3.4Å; V145-D148 PolarHBondContact O-N 3.41Å; D148-K151 WeakPolarHBondContact O-CE 3.22Å; D148-K151 PolarHBondContact O-NZ 3.38Å
149	L	97.3	Very high	97.8	Very high	79 Å²	79	57.4 Å²	57.4	41%	0.414	29%	0.291	S	S	.	.	H	α-helix	trans	-74.8	-43.4	-177.1	-71.3	-179.7	0	0	0	113.2	Q107 A110 V145 S147	Q107-L149 HydrophobicContact CB-CD1 4.19Å; Q107-L149 HydrophobicContact CG-CD1 4.12Å; A110-L149 HydrophobicContact CB-CD1 4.44Å; V145-L149 HydrophobicContact CG1-CD1 3.67Å; V145-L149 HydrophobicContact CG1-CG 3.99Å; V145-L149 WeakPolarHBondContact O-CB 3.41Å; V145-L149 VanDerWaalsContact O-CG 3.29Å; V145-L149 WeakPolarHBondContact O-CG 3.38Å; V145-L149 PolarHBondContact O-N 3.4Å; S147-L149 PolarHBondContact O-N 3.37Å
150	F	97.6	Very high	97.7	Very high	65 Å²	65	60.3 Å²	60.3	29%	0.285	32%	0.323	S	S	.	.	H	α-helix	trans	-109.9	-7.3	-168.4	-53.5	-57.4	0	0	0	113.9	A110 R114 Y146 K152	A110-F150 HydrophobicContact CB-CE2 4.21Å; A110-F150 WeakPolarHBondContact O-CE2 3.27Å; R114-F150 HydrophobicContact CB-CD2 4.09Å; R114-F150 HydrophobicContact CB-CE1 4.34Å; R114-F150 HydrophobicContact CB-CE2 3.67Å; R114-F150 HydrophobicContact CB-CZ 3.82Å; R114-F150 HydrophobicContact CG-CD1 4.17Å; R114-F150 HydrophobicContact CG-CD2 4.2Å; R114-F150 HydrophobicContact CG-CE1 4.11Å; R114-F150 HydrophobicContact CG-CE2 4.14Å; R114-F150 HydrophobicContact CG-CG 4.22Å; R114-F150 HydrophobicContact CG-CZ 4.11Å; Y146-F150 AromaticContact CD1-CD2 3.99Å; Y146-F150 HydrophobicContact CD1-CD2 3.99Å; Y146-F150 AromaticContact CD2-CD2 3.8Å; Y146-F150 HydrophobicContact CD2-CD2 3.8Å; Y146-F150 AromaticContact CD2-CE2 3.9Å; Y146-F150 HydrophobicContact CD2-CE2 3.9Å; Y146-F150 HydrophobicContact CE1-CD2 4.05Å; Y146-F150 AromaticContact CE2-CD2 3.87Å; Y146-F150 HydrophobicContact CE2-CD2 3.87Å; Y146-F150 HydrophobicContact CE2-CE2 4.04Å; Y146-F150 AromaticContact CG-CD2 3.86Å; Y146-F150 HydrophobicContact CG-CD2 3.86Å; Y146-F150 HydrophobicContact CG-CE2 4.34Å; Y146-F150 AromaticContact CZ-CD2 3.99Å; Y146-F150 WeakPolarHBondContact O-CB 3.25Å; Y146-F150 WeakPolarHBondContact O-CD2 3.21Å; Y146-F150 PolarHBondContact O-N 3.23Å; F150-K152 HydrophobicContact CB-CB 4.2Å; F150-K152 HydrophobicContact CB-CG 4.37Å; F150-K152 WeakPolarHBondContact O-CG 3.48Å; F150-K152 PolarHBondContact O-N 3.22Å
151	K	97.6	Very high	97.6	Very high	166 Å²	166	59.7 Å²	59.7	72%	0.722	32%	0.317	S	S	*	.	S	Bend	trans	53.9	39.6	-172.9	-51.9	-51	-177.6	-158.3	0	111.8	S147 D148	S147-K151 WeakPolarHBondContact O-CA 3.26Å; S147-K151 PolarHBondContact O-N 3.21Å; D148-K151 WeakPolarHBondContact O-CE 3.22Å; D148-K151 PolarHBondContact O-NZ 3.38Å
152	K	97.3	Very high	97.5	Very high	72 Å²	72	56.9 Å²	56.9	31%	0.313	31%	0.305	S	S	.	.	S	Bend	trans	-132.3	160.3	-176.6	-75.7	-165.5	162.3	-142.6	0	111.2	Y146 S147 F150 D157	Y146-K152 HydrophobicContact CD1-CB 4.39Å; Y146-K152 HydrophobicContact CE1-CB 3.87Å; S147-K152 VanDerWaalsContact CA-O 3.23Å; S147-K152 WeakPolarHBondContact CA-O 3.11Å; S147-K152 PolarHBondContact OG-O 2.98Å; F150-K152 HydrophobicContact CB-CB 4.2Å; F150-K152 HydrophobicContact CB-CG 4.37Å; F150-K152 WeakPolarHBondContact O-CG 3.48Å; F150-K152 PolarHBondContact O-N 3.22Å; K152-D157 WeakPolarHBondContact CD-OD2 3.44Å; K152-D157 IonicContact NZ-OD1 3.67Å; K152-D157 PolarHBondContact NZ-OD1 3.35Å; K152-D157 IonicContact NZ-OD2 3.72Å; K152-D157 PolarHBondContact NZ-OD2 3.32Å
153	D	97.8	Very high	97.4	Very high	74 Å²	74	61.3 Å²	61.3	40%	0.396	34%	0.336	S	S	.	.			trans	-97.8	123.8	173.9	-179.1	-87.1	0	0	0	109.8	A155 K156 D157	D153-A155 VanDerWaalsContact C-N 3.33Å; D153-A155 PolarHBondContact O-N 2.71Å; D153-A155 WeakPolarHBondContact OD1-CA 3.41Å; D153-A155 WeakPolarHBondContact OD1-CB 3Å; D153-A155 PolarHBondContact OD1-N 2.96Å; D153-K156 HydrophobicContact CB-CB 4.05Å; D153-K156 HydrophobicContact CB-CD 3.96Å; D153-K156 HydrophobicContact CB-CG 4.01Å; D153-K156 PolarHBondContact O-N 2.8Å; D153-K156 WeakPolarHBondContact OD1-CG 3.47Å; D153-K156 PolarHBondContact OD1-N 2.77Å; D153-D157 PolarHBondContact O-N 3.39Å
154	L	97.9	Very high	97.4	Very high	4 Å²	4	60.9 Å²	60.9	2%	0.021	35%	0.349	C	S	.	.	H	α-helix	trans	-61.1	-41.6	-177.8	175.3	60	0	0	0	111.8	I113 I142 K143 Y146 D157 V158 V174	I113-L154 HydrophobicContact CD1-CD1 4.48Å; I113-L154 HydrophobicContact CG2-CD1 3.59Å; I142-L154 HydrophobicContact CG2-CD2 4.13Å; K143-L154 HydrophobicContact CG-CB 4.34Å; K143-L154 HydrophobicContact CG-CD2 3.71Å; Y146-L154 HydrophobicContact CD1-CB 3.98Å; Y146-L154 HydrophobicContact CD2-CD1 3.92Å; Y146-L154 HydrophobicContact CE1-CB 4.43Å; Y146-L154 HydrophobicContact CE1-CD1 4.5Å; Y146-L154 HydrophobicContact CE2-CD1 3.86Å; Y146-L154 HydrophobicContact CG-CB 4.06Å; Y146-L154 HydrophobicContact CG-CD1 4.27Å; L154-D157 PolarHBondContact O-N 2.7Å; L154-V158 HydrophobicContact CD1-CG2 3.9Å; L154-V158 HydrophobicContact CG-CG2 4.41Å; L154-V158 WeakPolarHBondContact O-CB 3.33Å; L154-V158 VanDerWaalsContact O-CG2 3.28Å; L154-V158 WeakPolarHBondContact O-CG2 3.48Å; L154-V158 PolarHBondContact O-N 2.75Å; L154-V174 HydrophobicContact CD2-CG1 4.29Å; L154-V174 HydrophobicContact CD2-CG2 4.36Å; L154-V174 HydrophobicContact CG-CG1 4.21Å; L154-V174 HydrophobicContact CG-CG2 4.49Å
155	A	97.7	Very high	97.4	Very high	30 Å²	30	58 Å²	58	25%	0.248	34%	0.339	C	S	.	.	H	α-helix	trans	-66.5	-41	-178.6	0	0	0	0	0	111.3	D153 V158 A159 L171 V174	D153-A155 VanDerWaalsContact C-N 3.33Å; D153-A155 PolarHBondContact O-N 2.71Å; D153-A155 WeakPolarHBondContact OD1-CA 3.41Å; D153-A155 WeakPolarHBondContact OD1-CB 3Å; D153-A155 PolarHBondContact OD1-N 2.96Å; A155-V158 PolarHBondContact O-N 3.06Å; A155-A159 VanDerWaalsContact O-CB 3.27Å; A155-A159 WeakPolarHBondContact O-CB 3.16Å; A155-A159 PolarHBondContact O-N 3.2Å; A155-L171 HydrophobicContact CB-CD2 4.2Å; A155-L171 VanDerWaalsContact O-CD2 3.26Å; A155-L171 WeakPolarHBondContact O-CD2 3.42Å; A155-V174 HydrophobicContact CB-CG1 3.8Å
156	K	97.9	Very high	97.4	Very high	158 Å²	158	58.6 Å²	58.6	69%	0.687	34%	0.341	S	S	*	.	H	α-helix	trans	-64.7	-44.4	176	-69.4	-177.8	-175.2	175.5	0	112.4	D153 A159 G160	D153-K156 HydrophobicContact CB-CB 4.05Å; D153-K156 HydrophobicContact CB-CD 3.96Å; D153-K156 HydrophobicContact CB-CG 4.01Å; D153-K156 PolarHBondContact O-N 2.8Å; D153-K156 WeakPolarHBondContact OD1-CG 3.47Å; D153-K156 PolarHBondContact OD1-N 2.77Å; K156-A159 PolarHBondContact O-N 3.06Å; K156-G160 PolarHBondContact O-N 2.68Å
157	D	97.1	Very high	97.3	Very high	28 Å²	28	59 Å²	59	15%	0.15	35%	0.345	C	S	.	.	H	α-helix	trans	-65.4	-41.6	178.3	-97.5	25.3	0	0	0	110.5	R114 I117 Y146 K152 D153 L154 G160 D161	R114-D157 IonicContact CZ-OD2 3.68Å; R114-D157 IonicContact NH1-OD2 2.74Å; R114-D157 PolarHBondContact NH1-OD2 3.21Å; I117-D157 HydrophobicContact CD1-CB 3.71Å; Y146-D157 PolarHBondContact OH-OD2 2.98Å; K152-D157 WeakPolarHBondContact CD-OD2 3.44Å; K152-D157 IonicContact NZ-OD1 3.67Å; K152-D157 PolarHBondContact NZ-OD1 3.35Å; K152-D157 IonicContact NZ-OD2 3.72Å; K152-D157 PolarHBondContact NZ-OD2 3.32Å; D153-D157 PolarHBondContact O-N 3.39Å; L154-D157 PolarHBondContact O-N 2.7Å; D157-G160 PolarHBondContact O-N 3.02Å; D157-D161 PolarHBondContact O-N 2.86Å
158	V	97	Very high	97.3	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-63.2	-42.6	173.8	170.5	0	0	0	0	111.8	L127 L131 L154 A155 G160 D161 T162 L170 L171	L127-V158 HydrophobicContact CD1-CG2 4.35Å; L131-V158 HydrophobicContact CD1-CG2 4.21Å; L154-V158 HydrophobicContact CD1-CG2 3.9Å; L154-V158 HydrophobicContact CG-CG2 4.41Å; L154-V158 WeakPolarHBondContact O-CB 3.33Å; L154-V158 VanDerWaalsContact O-CG2 3.28Å; L154-V158 WeakPolarHBondContact O-CG2 3.48Å; L154-V158 PolarHBondContact O-N 2.75Å; A155-V158 PolarHBondContact O-N 3.06Å; V158-G160 VanDerWaalsContact C-N 3.27Å; V158-G160 PolarHBondContact O-N 3.35Å; V158-D161 PolarHBondContact O-N 3.32Å; V158-T162 WeakPolarHBondContact O-CB 3.18Å; V158-T162 PolarHBondContact O-N 3.06Å; V158-T162 VanDerWaalsContact O-N 3.11Å; V158-T162 PolarHBondContact O-OG1 3.42Å; V158-L170 HydrophobicContact CG1-CB 3.86Å; V158-L170 HydrophobicContact CG1-CD1 4.19Å; V158-L171 HydrophobicContact CB-CD2 4.32Å; V158-L171 HydrophobicContact CG1-CD2 4.12Å
159	A	97.1	Very high	97.4	Very high	47 Å²	47	57 Å²	57	39%	0.388	32%	0.324	S	S	.	.	H	α-helix	trans	-65.2	-30.7	177.3	0	0	0	0	0	112.8	A155 K156 L171	A155-A159 VanDerWaalsContact O-CB 3.27Å; A155-A159 WeakPolarHBondContact O-CB 3.16Å; A155-A159 PolarHBondContact O-N 3.2Å; K156-A159 PolarHBondContact O-N 3.06Å; A159-L171 HydrophobicContact CB-CD1 4Å; A159-L171 HydrophobicContact CB-CD2 4.06Å
160	G	96	Very high	97.4	Very high	67 Å²	67	53.2 Å²	53.2	69%	0.691	31%	0.305	S	S	*	.	H	α-helix	trans	-75.6	-29.2	178.6	0	0	0	0	0	113.9	K156 D157 V158	K156-G160 PolarHBondContact O-N 2.68Å; D157-G160 PolarHBondContact O-N 3.02Å; V158-G160 VanDerWaalsContact C-N 3.27Å; V158-G160 PolarHBondContact O-N 3.35Å
161	D	95.4	Very high	97.5	Very high	56 Å²	56	52.8 Å²	52.8	30%	0.299	31%	0.305	S	S	.	.	H	α-helix	trans	-102	-6.3	-175.7	-115	-117.3	0	0	0	113.8	I117 T122 D157 V158	I117-D161 WeakPolarHBondContact CA-OD1 3.38Å; I117-D161 HydrophobicContact CB-CB 3.91Å; I117-D161 HydrophobicContact CG2-CB 4.02Å; T122-D161 PolarHBondContact OG1-O 3.29Å; T122-D161 PolarHBondContact OG1-OD1 2.89Å; D157-D161 PolarHBondContact O-N 2.86Å; V158-D161 PolarHBondContact O-N 3.32Å
162	T	96.5	Very high	97.5	Very high	15 Å²	15	46 Å²	46	9%	0.092	28%	0.281	C	S	.	.			trans	-129.5	160.1	-178.6	67.3	0	0	0	0	111.3	L127 V158 F166 A167 L170	L127-T162 HydrophobicContact CD2-CG2 3.77Å; V158-T162 WeakPolarHBondContact O-CB 3.18Å; V158-T162 PolarHBondContact O-N 3.06Å; V158-T162 VanDerWaalsContact O-N 3.11Å; V158-T162 PolarHBondContact O-OG1 3.42Å; T162-F166 HydrophobicContact CG2-CD1 4.14Å; T162-F166 HydrophobicContact CG2-CE1 3.61Å; T162-F166 HydrophobicContact CG2-CZ 4.31Å; T162-A167 WeakPolarHBondContact OG1-CA 3.15Å; T162-A167 WeakPolarHBondContact OG1-CB 3.4Å; T162-L170 HydrophobicContact CG2-CD1 4.11Å
163	S	96.6	Very high	97.6	Very high	95 Å²	95	43 Å²	43	66%	0.664	27%	0.268	S	S	*	.			trans	-141.2	170.5	-179.8	67.5	0	0	0	0	113.8	A167	S163-A167 PolarHBondContact O-N 2.67Å; S163-A167 VanDerWaalsContact O-N 3.1Å
164	G	97.6	Very high	97.6	Very high	51 Å²	51	39.5 Å²	39.5	53%	0.526	25%	0.249	S	C	.	.	H	α-helix	trans	60.6	-149.1	174.4	0	0	0	0	0	113.8	F166 A167 K168	G164-F166 VanDerWaalsContact C-N 3.26Å; G164-F166 PolarHBondContact O-N 3.37Å; G164-A167 PolarHBondContact O-N 3.35Å; G164-K168 PolarHBondContact O-N 3.25Å
165	N	98	Very high	97.5	Very high	55 Å²	55	42.9 Å²	42.9	29%	0.294	27%	0.267	S	S	.	.	H	α-helix	trans	-70.1	-24	-179.3	-71.9	-22.1	0	0	0	113.2	K168 L169 V209 L251	N165-K168 PolarHBondContact O-N 3.1Å; N165-K168 PolarHBondContact OD1-NZ 2.84Å; N165-K168 VanDerWaalsContact OD1-NZ 3.1Å; N165-L169 PolarHBondContact O-N 2.69Å; N165-V209 HydrophobicContact CB-CG1 3.81Å; N165-L251 HydrophobicContact CB-CD1 4.41Å; N165-L251 HydrophobicContact CB-CD2 3.82Å
166	F	97.8	Very high	97.4	Very high	23 Å²	23	42.8 Å²	42.8	10%	0.101	26%	0.263	C	S	.	.	H	α-helix	trans	-61.6	-50.5	171.8	171.4	-129.4	0	0	0	110.7	E124 L127 I128 T162 G164 K168 L169 L170 D250 S254	E124-F166 HydrophobicContact CB-CZ 4.27Å; E124-F166 HydrophobicContact CG-CE1 4.09Å; E124-F166 HydrophobicContact CG-CZ 4.31Å; L127-F166 HydrophobicContact CD2-CZ 4.49Å; I128-F166 HydrophobicContact CD1-CE2 3.91Å; I128-F166 HydrophobicContact CD1-CZ 4.19Å; I128-F166 HydrophobicContact CG1-CE2 3.68Å; I128-F166 HydrophobicContact CG1-CZ 4Å; T162-F166 HydrophobicContact CG2-CD1 4.14Å; T162-F166 HydrophobicContact CG2-CE1 3.61Å; T162-F166 HydrophobicContact CG2-CZ 4.31Å; G164-F166 VanDerWaalsContact C-N 3.26Å; G164-F166 PolarHBondContact O-N 3.37Å; F166-K168 VanDerWaalsContact C-N 3.33Å; F166-K168 PolarHBondContact O-N 3.37Å; F166-L169 PolarHBondContact O-N 2.95Å; F166-L170 HydrophobicContact CD2-CD1 4.17Å; F166-L170 HydrophobicContact CD2-CG 4.12Å; F166-L170 HydrophobicContact CE1-CD1 4.1Å; F166-L170 HydrophobicContact CE2-CD1 3.46Å; F166-L170 VanDerWaalsContact CE2-CD1 3.46Å; F166-L170 HydrophobicContact CE2-CD2 4.04Å; F166-L170 HydrophobicContact CE2-CG 3.74Å; F166-L170 HydrophobicContact CZ-CD1 3.44Å; F166-L170 VanDerWaalsContact CZ-CD1 3.44Å; F166-L170 HydrophobicContact CZ-CG 4.24Å; F166-L170 PolarHBondContact O-N 3.23Å; F166-L170 VanDerWaalsContact O-N 3.12Å; F166-D250 HydrophobicContact CD1-CB 4.13Å; F166-D250 HydrophobicContact CD2-CB 3.94Å; F166-D250 HydrophobicContact CE1-CB 4.17Å; F166-D250 HydrophobicContact CE2-CB 3.99Å; F166-D250 HydrophobicContact CG-CB 4.01Å; F166-D250 HydrophobicContact CZ-CB 4.09Å; F166-S254 WeakPolarHBondContact CE2-OG 3.44Å
167	A	97.9	Very high	97.4	Very high	10 Å²	10	41.5 Å²	41.5	8%	0.083	26%	0.258	C	S	.	.	H	α-helix	trans	-57.4	-45.3	173.7	0	0	0	0	0	112.3	T162 S163 G164 L169 L170 L171	T162-A167 WeakPolarHBondContact OG1-CA 3.15Å; T162-A167 WeakPolarHBondContact OG1-CB 3.4Å; S163-A167 PolarHBondContact O-N 2.67Å; S163-A167 VanDerWaalsContact O-N 3.1Å; G164-A167 PolarHBondContact O-N 3.35Å; A167-L169 VanDerWaalsContact C-N 3.3Å; A167-L169 PolarHBondContact O-N 3.37Å; A167-L170 PolarHBondContact O-N 3.35Å; A167-L171 WeakPolarHBondContact O-CB 3.31Å; A167-L171 WeakPolarHBondContact O-CG 3.35Å; A167-L171 PolarHBondContact O-N 2.89Å
168	K	98.5	Very high	97.3	Very high	101 Å²	101	41.7 Å²	41.7	44%	0.439	26%	0.257	S	S	.	.	H	α-helix	trans	-57.1	-42.8	179	-69.3	-179.7	-172.8	168.9	0	112.4	G164 N165 F166 A172 N210 I213	G164-K168 PolarHBondContact O-N 3.25Å; N165-K168 PolarHBondContact O-N 3.1Å; N165-K168 PolarHBondContact OD1-NZ 2.84Å; N165-K168 VanDerWaalsContact OD1-NZ 3.1Å; F166-K168 VanDerWaalsContact C-N 3.33Å; F166-K168 PolarHBondContact O-N 3.37Å; K168-A172 WeakPolarHBondContact O-CB 3.28Å; K168-A172 PolarHBondContact O-N 2.99Å; K168-N210 PolarHBondContact NZ-OD1 3.48Å; K168-I213 HydrophobicContact CB-CD1 3.72Å
169	L	98.6	Very high	97.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.1	-49.9	178.3	176.5	58	0	0	0	111	N165 F166 A167 L171 A172 L173 I213 L251 S254 F255 L258	N165-L169 PolarHBondContact O-N 2.69Å; F166-L169 PolarHBondContact O-N 2.95Å; A167-L169 VanDerWaalsContact C-N 3.3Å; A167-L169 PolarHBondContact O-N 3.37Å; L169-L171 VanDerWaalsContact C-N 3.31Å; L169-L171 PolarHBondContact O-N 2.84Å; L169-A172 WeakPolarHBondContact O-CB 3.45Å; L169-A172 PolarHBondContact O-N 3.43Å; L169-L173 HydrophobicContact CD1-CD1 4.43Å; L169-L173 HydrophobicContact CD1-CG 4.46Å; L169-L173 HydrophobicContact CG-CD1 4.41Å; L169-L173 WeakPolarHBondContact O-CG 3.45Å; L169-L173 PolarHBondContact O-N 2.95Å; L169-I213 HydrophobicContact CB-CD1 4.06Å; L169-I213 HydrophobicContact CB-CG1 4.01Å; L169-I213 HydrophobicContact CD1-CB 4.48Å; L169-I213 HydrophobicContact CD1-CG1 4.11Å; L169-I213 HydrophobicContact CD1-CG2 4.23Å; L169-L251 HydrophobicContact CB-CD1 4.2Å; L169-L251 HydrophobicContact CD2-CD1 3.95Å; L169-S254 VanDerWaalsContact CD2-CB 3.46Å; L169-F255 HydrophobicContact CD1-CE1 4Å; L169-F255 HydrophobicContact CD1-CZ 4.44Å; L169-F255 HydrophobicContact CD2-CD1 3.96Å; L169-F255 HydrophobicContact CD2-CD2 4.34Å; L169-F255 HydrophobicContact CD2-CE1 3.94Å; L169-F255 HydrophobicContact CD2-CE2 4.33Å; L169-F255 HydrophobicContact CD2-CG 4.19Å; L169-F255 HydrophobicContact CD2-CZ 4.14Å; L169-L258 HydrophobicContact CD1-CD1 3.9Å; L169-L258 HydrophobicContact CD2-CD1 4.14Å; L169-L258 HydrophobicContact CG-CD1 4.43Å
170	L	98.4	Very high	97	Very high	0 Å²	0	49 Å²	49	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61.7	-40.9	-179.7	-64.3	-171.4	0	0	0	112	L127 L131 V158 T162 F166 A167 L173 V174	L127-L170 HydrophobicContact CD2-CD1 3.56Å; L127-L170 HydrophobicContact CG-CD1 3.88Å; L131-L170 HydrophobicContact CB-CD2 4.11Å; L131-L170 HydrophobicContact CD1-CB 4.1Å; L131-L170 HydrophobicContact CD1-CD1 4.17Å; L131-L170 HydrophobicContact CD1-CD2 4.06Å; L131-L170 HydrophobicContact CD1-CG 4.34Å; V158-L170 HydrophobicContact CG1-CB 3.86Å; V158-L170 HydrophobicContact CG1-CD1 4.19Å; T162-L170 HydrophobicContact CG2-CD1 4.11Å; F166-L170 HydrophobicContact CD2-CD1 4.17Å; F166-L170 HydrophobicContact CD2-CG 4.12Å; F166-L170 HydrophobicContact CE1-CD1 4.1Å; F166-L170 HydrophobicContact CE2-CD1 3.46Å; F166-L170 VanDerWaalsContact CE2-CD1 3.46Å; F166-L170 HydrophobicContact CE2-CD2 4.04Å; F166-L170 HydrophobicContact CE2-CG 3.74Å; F166-L170 HydrophobicContact CZ-CD1 3.44Å; F166-L170 VanDerWaalsContact CZ-CD1 3.44Å; F166-L170 HydrophobicContact CZ-CG 4.24Å; F166-L170 PolarHBondContact O-N 3.23Å; F166-L170 VanDerWaalsContact O-N 3.12Å; A167-L170 PolarHBondContact O-N 3.35Å; L170-L173 PolarHBondContact O-N 3.45Å; L170-V174 VanDerWaalsContact O-CG2 3.3Å; L170-V174 WeakPolarHBondContact O-CG2 3.41Å; L170-V174 PolarHBondContact O-N 3.03Å
171	L	98.5	Very high	96.7	Very high	56 Å²	56	48.3 Å²	48.3	29%	0.293	27%	0.268	S	S	.	.	H	α-helix	trans	-66.3	-36.9	176.1	-67.6	173.2	0	0	0	112.1	A155 V158 A159 A167 L169 L173 V174 D175	A155-L171 HydrophobicContact CB-CD2 4.2Å; A155-L171 VanDerWaalsContact O-CD2 3.26Å; A155-L171 WeakPolarHBondContact O-CD2 3.42Å; V158-L171 HydrophobicContact CB-CD2 4.32Å; V158-L171 HydrophobicContact CG1-CD2 4.12Å; A159-L171 HydrophobicContact CB-CD1 4Å; A159-L171 HydrophobicContact CB-CD2 4.06Å; A167-L171 WeakPolarHBondContact O-CB 3.31Å; A167-L171 WeakPolarHBondContact O-CG 3.35Å; A167-L171 PolarHBondContact O-N 2.89Å; L169-L171 VanDerWaalsContact C-N 3.31Å; L169-L171 PolarHBondContact O-N 2.84Å; L171-L173 VanDerWaalsContact C-N 3.31Å; L171-L173 PolarHBondContact O-N 2.79Å; L171-V174 CarbonylContact O-C 3.49Å; L171-V174 PolarHBondContact O-N 2.99Å; L171-D175 WeakPolarHBondContact O-CB 3.19Å; L171-D175 PolarHBondContact O-N 2.92Å
172	A	98.6	Very high	96.4	Very high	25 Å²	25	49.4 Å²	49.4	21%	0.207	28%	0.28	C	S	.	.	H	α-helix	trans	-64	-36.1	174.4	0	0	0	0	0	112.3	K168 L169 I213	K168-A172 WeakPolarHBondContact O-CB 3.28Å; K168-A172 PolarHBondContact O-N 2.99Å; L169-A172 WeakPolarHBondContact O-CB 3.45Å; L169-A172 PolarHBondContact O-N 3.43Å; A172-I213 HydrophobicContact CB-CG2 3.65Å
173	L	98.3	Very high	96	Very high	8 Å²	8	53.1 Å²	53.1	4%	0.042	31%	0.313	C	S	.	.	H	α-helix	trans	-70	-44.9	173.5	-63.1	169.4	0	0	0	111.4	L139 L169 L170 L171 D175 T176 L258	L139-L173 HydrophobicContact CD1-CB 4.37Å; L169-L173 HydrophobicContact CD1-CD1 4.43Å; L169-L173 HydrophobicContact CD1-CG 4.46Å; L169-L173 HydrophobicContact CG-CD1 4.41Å; L169-L173 WeakPolarHBondContact O-CG 3.45Å; L169-L173 PolarHBondContact O-N 2.95Å; L170-L173 PolarHBondContact O-N 3.45Å; L171-L173 VanDerWaalsContact C-N 3.31Å; L171-L173 PolarHBondContact O-N 2.79Å; L173-D175 PolarHBondContact O-N 3.02Å; L173-T176 PolarHBondContact O-N 3.37Å; L173-L258 HydrophobicContact CD1-CD1 4.33Å; L173-L258 HydrophobicContact CD1-CD2 4.06Å; L173-L258 HydrophobicContact CD2-CD2 3.89Å
174	V	97.5	Very high	95.7	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.006	32%	0.315	C	S	.	.	H	α-helix	trans	-65.8	-22.4	176.6	173.7	0	0	0	0	111.7	L131 K143 L154 A155 L170 L171 T176	L131-V174 HydrophobicContact CD1-CG2 4.04Å; L131-V174 HydrophobicContact CD2-CG2 3.93Å; K143-V174 HydrophobicContact CD-CG1 3.97Å; K143-V174 WeakPolarHBondContact CD-O 3.04Å; K143-V174 WeakPolarHBondContact CE-O 3.16Å; K143-V174 HydrophobicContact CG-CG1 4.23Å; K143-V174 PolarHBondContact NZ-O 2.74Å; L154-V174 HydrophobicContact CD2-CG1 4.29Å; L154-V174 HydrophobicContact CD2-CG2 4.36Å; L154-V174 HydrophobicContact CG-CG1 4.21Å; L154-V174 HydrophobicContact CG-CG2 4.49Å; A155-V174 HydrophobicContact CB-CG1 3.8Å; L170-V174 VanDerWaalsContact O-CG2 3.3Å; L170-V174 WeakPolarHBondContact O-CG2 3.41Å; L170-V174 PolarHBondContact O-N 3.03Å; L171-V174 CarbonylContact O-C 3.49Å; L171-V174 PolarHBondContact O-N 2.99Å; V174-T176 PolarHBondContact O-N 2.65Å
175	D	96.8	Very high	95.5	Very high	74 Å²	74	55.2 Å²	55.2	40%	0.396	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-14.9	173.9	-160.6	25.1	0	0	0	112.6	L171 L173 K177	L171-D175 WeakPolarHBondContact O-CB 3.19Å; L171-D175 PolarHBondContact O-N 2.92Å; L173-D175 PolarHBondContact O-N 3.02Å; D175-K177 VanDerWaalsContact C-N 3.32Å; D175-K177 HydrophobicContact CB-CG 4.5Å; D175-K177 PolarHBondContact O-N 2.91Å; D175-K177 IonicContact OD1-NZ 2.73Å; D175-K177 WeakPolarHBondContact OD2-CD 3.39Å; D175-K177 WeakPolarHBondContact OD2-CE 3.4Å; D175-K177 IonicContact OD2-NZ 3.64Å; D175-K177 PolarHBondContact OD2-NZ 2.87Å
176	T	96.1	Very high	95.4	Very high	28 Å²	28	56.3 Å²	56.3	17%	0.172	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	39.6	171	50.6	0	0	0	0	114.1	N136 L139 V140 K143 L173 V174	N136-T176 PolarHBondContact ND2-O 3.23Å; N136-T176 VanDerWaalsContact ND2-O 3.15Å; N136-T176 WeakPolarHBondContact OD1-CA 3.22Å; N136-T176 PolarHBondContact OD1-O 2.64Å; L139-T176 HydrophobicContact CB-CG2 3.66Å; V140-T176 HydrophobicContact CG2-CG2 3.72Å; K143-T176 HydrophobicContact CD-CG2 4.02Å; L173-T176 PolarHBondContact O-N 3.37Å; V174-T176 PolarHBondContact O-N 2.65Å
177	K	96.4	Very high	95.4	Very high	131 Å²	131	63.4 Å²	63.4	57%	0.57	34%	0.338	S	S	*	.			trans	-104.8	30.1	-178.6	-65.4	-173.4	-179.7	149.9	0	113.6	D175	D175-K177 VanDerWaalsContact C-N 3.32Å; D175-K177 HydrophobicContact CB-CG 4.5Å; D175-K177 PolarHBondContact O-N 2.91Å; D175-K177 IonicContact OD1-NZ 2.73Å; D175-K177 WeakPolarHBondContact OD2-CD 3.39Å; D175-K177 WeakPolarHBondContact OD2-CE 3.4Å; D175-K177 IonicContact OD2-NZ 3.64Å; D175-K177 PolarHBondContact OD2-NZ 2.87Å
178	R	96.4	Very high	95.4	Very high	33 Å²	33	70.4 Å²	70.4	13%	0.125	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-71.9	132.2	175.1	-170.4	175.8	-63.5	-78.8	-5	110.1	N136 M216 S217 Q218 R219 L224	N136-R178 HydrophobicContact CB-CB 4.05Å; N136-R178 PolarHBondContact OD1-N 3.38Å; R178-M216 PolarHBondContact NH1-O 3.48Å; R178-M216 PolarHBondContact NH2-O 3.41Å; R178-S217 PolarHBondContact NH2-O 3.1Å; R178-Q218 CarbonylContact C-O 3.55Å; R178-Q218 WeakPolarHBondContact CA-O 3.37Å; R178-R219 VanDerWaalsContact CG-O 3.29Å; R178-R219 WeakPolarHBondContact CG-O 3.45Å; R178-R219 PolarHBondContact NH1-O 3.33Å; R178-L224 VanDerWaalsContact NH1-CD1 3.35Å
179	D	95.3	Very high	95.4	Very high	73 Å²	73	69 Å²	69	39%	0.39	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-56.8	136.8	172.6	-63.6	-28.1	0	0	0	109.9	Q218 S220	D179-Q218 WeakPolarHBondContact CB-O 3.31Å; D179-Q218 PolarHBondContact N-O 3.37Å; D179-S220 VanDerWaalsContact O-CA 3.31Å; D179-S220 WeakPolarHBondContact O-CA 3.37Å; D179-S220 WeakPolarHBondContact O-CB 3.22Å
180	E	91	Very high	95.4	Very high	126 Å²	126	69.5 Å²	69.5	59%	0.589	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-66.2	150.2	172.3	-69.6	-58.4	149	0	0	111.4	S182	E180-S182 PolarHBondContact O-N 3.45Å
181	P	90.8	Very high	95.4	Very high	53 Å²	53	71.2 Å²	71.2	34%	0.344	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-53.9	130.6	169.3	-26	36.2	0	0	0	111.8	P222	P181-P222 HydrophobicContact CB-CG 4.19Å; P181-P222 HydrophobicContact CG-CG 4.4Å
182	S	88.7	Confident	95.4	Very high	79 Å²	79	72.1 Å²	72.1	55%	0.552	38%	0.382	S	S	*	.			trans	-104.8	141.3	172.6	178.3	0	0	0	0	110.2	E180 I184	E180-S182 PolarHBondContact O-N 3.45Å; S182-I184 PolarHBondContact O-N 2.87Å; S182-I184 PolarHBondContact OG-N 3.03Å; S182-I184 VanDerWaalsContact OG-N 3.11Å; S182-I184 PolarHBondContact OG-O 3.48Å
183	A	87.8	Confident	95.4	Very high	94 Å²	94	71.3 Å²	71.3	78%	0.777	38%	0.375	S	S	*	.	S	Bend	trans	-68.8	-22.8	170.6	0	0	0	0	0	112.3
184	I	91.1	Very high	95.4	Very high	140 Å²	140	71 Å²	71	72%	0.718	37%	0.373	S	S	*	.	S	Bend	trans	-92.6	126.6	-179.9	-57.3	175.6	0	0	0	109	S182	S182-I184 PolarHBondContact O-N 2.87Å; S182-I184 PolarHBondContact OG-N 3.03Å; S182-I184 VanDerWaalsContact OG-N 3.11Å; S182-I184 PolarHBondContact OG-O 3.48Å
185	V	93.1	Very high	95.4	Very high	50 Å²	50	76.3 Å²	76.3	30%	0.303	39%	0.393	S	S	.	.			trans	-89.4	112.1	177.9	-175.5	0	0	0	0	109	Y187 I190 K226	V185-Y187 HydrophobicContact CB-CE2 4Å; V185-Y187 HydrophobicContact CG1-CD1 4.27Å; V185-Y187 HydrophobicContact CG1-CD2 4.14Å; V185-Y187 HydrophobicContact CG1-CE1 3.95Å; V185-Y187 HydrophobicContact CG1-CE2 3.79Å; V185-Y187 HydrophobicContact CG1-CG 4.37Å; V185-Y187 PolarHBondContact O-N 3.38Å; V185-I190 HydrophobicContact CG1-CD1 3.71Å; V185-K226 HydrophobicContact CG1-CD 3.83Å
186	D	96.4	Very high	95.5	Very high	77 Å²	77	74.2 Å²	74.2	41%	0.412	39%	0.386	S	S	.	.			trans	-89.6	93.1	176.4	-173.5	-19.5	0	0	0	110.6	E188 K189 I190	D186-E188 VanDerWaalsContact C-N 3.32Å; D186-E188 PolarHBondContact O-N 3.35Å; D186-E188 PolarHBondContact OD1-N 2.97Å; D186-K189 HydrophobicContact CB-CB 3.96Å; D186-K189 PolarHBondContact O-N 3.16Å; D186-K189 WeakPolarHBondContact OD1-CB 3.39Å; D186-K189 PolarHBondContact OD1-N 3.44Å; D186-K189 WeakPolarHBondContact OD2-CB 3.47Å; D186-I190 WeakPolarHBondContact O-CD1 3.22Å; D186-I190 WeakPolarHBondContact O-CG1 3.43Å; D186-I190 PolarHBondContact O-N 2.89Å
187	Y	97.4	Very high	95.6	Very high	173 Å²	173	72.9 Å²	72.9	68%	0.678	38%	0.378	S	S	*	.	H	α-helix	trans	-67.3	-29.9	-178.1	-69.2	-82	0	0	0	113.6	V185 I190 D191	V185-Y187 HydrophobicContact CB-CE2 4Å; V185-Y187 HydrophobicContact CG1-CD1 4.27Å; V185-Y187 HydrophobicContact CG1-CD2 4.14Å; V185-Y187 HydrophobicContact CG1-CE1 3.95Å; V185-Y187 HydrophobicContact CG1-CE2 3.79Å; V185-Y187 HydrophobicContact CG1-CG 4.37Å; V185-Y187 PolarHBondContact O-N 3.38Å; Y187-I190 PolarHBondContact O-N 2.91Å; Y187-D191 PolarHBondContact O-N 3.46Å
188	E	98	Very high	95.7	Very high	156 Å²	156	69.1 Å²	69.1	73%	0.729	36%	0.36	S	S	*	.	H	α-helix	trans	-71.2	-43.3	178.1	-176.1	177.4	-177.2	0	0	110.6	D186 I190 D191 T192	D186-E188 VanDerWaalsContact C-N 3.32Å; D186-E188 PolarHBondContact O-N 3.35Å; D186-E188 PolarHBondContact OD1-N 2.97Å; E188-I190 VanDerWaalsContact C-N 3.34Å; E188-D191 PolarHBondContact O-N 3.37Å; E188-T192 WeakPolarHBondContact O-CB 3.5Å; E188-T192 PolarHBondContact O-N 3.22Å; E188-T192 PolarHBondContact O-OG1 3.26Å
189	K	98	Very high	95.7	Very high	73 Å²	73	70.2 Å²	70.2	32%	0.317	37%	0.368	S	S	.	.	H	α-helix	trans	-64.9	-38.4	173.7	-169.3	-176.1	-175.2	77.8	0	111.8	D186 T192 D193 R219	D186-K189 HydrophobicContact CB-CB 3.96Å; D186-K189 PolarHBondContact O-N 3.16Å; D186-K189 WeakPolarHBondContact OD1-CB 3.39Å; D186-K189 PolarHBondContact OD1-N 3.44Å; D186-K189 WeakPolarHBondContact OD2-CB 3.47Å; K189-T192 PolarHBondContact O-N 3.02Å; K189-D193 WeakPolarHBondContact O-CB 3.39Å; K189-D193 PolarHBondContact O-N 3.11Å; K189-R219 VanDerWaalsContact CE-NE 3.32Å
190	I	98.5	Very high	95.8	Very high	10 Å²	10	67 Å²	67	5%	0.051	35%	0.352	C	S	.	.	H	α-helix	trans	-60	-47.6	174	-72	161.5	0	0	0	110.6	V185 D186 Y187 E188 T192 A194 K226 V227 K230	V185-I190 HydrophobicContact CG1-CD1 3.71Å; D186-I190 WeakPolarHBondContact O-CD1 3.22Å; D186-I190 WeakPolarHBondContact O-CG1 3.43Å; D186-I190 PolarHBondContact O-N 2.89Å; Y187-I190 PolarHBondContact O-N 2.91Å; E188-I190 VanDerWaalsContact C-N 3.34Å; I190-T192 VanDerWaalsContact C-N 3.35Å; I190-A194 WeakPolarHBondContact O-CB 3.27Å; I190-A194 PolarHBondContact O-N 3.49Å; I190-K226 HydrophobicContact CD1-CB 3.7Å; I190-K226 HydrophobicContact CD1-CD 3.7Å; I190-K226 HydrophobicContact CD1-CG 4.35Å; I190-K226 HydrophobicContact CG1-CB 4.14Å; I190-K226 HydrophobicContact CG2-CB 4.27Å; I190-V227 HydrophobicContact CB-CG2 4.46Å; I190-V227 HydrophobicContact CG1-CG2 4.41Å; I190-V227 HydrophobicContact CG2-CG2 4.29Å; I190-K230 HydrophobicContact CG2-CB 3.8Å; I190-K230 HydrophobicContact CG2-CG 4.17Å
191	D	98.6	Very high	96	Very high	36 Å²	36	61 Å²	61	19%	0.193	32%	0.324	C	S	.	.	H	α-helix	trans	-62	-44	177.5	-171.3	71.5	0	0	0	111.8	Y187 E188 A194 R195 K230 Y234	Y187-D191 PolarHBondContact O-N 3.46Å; E188-D191 PolarHBondContact O-N 3.37Å; D191-A194 PolarHBondContact O-N 3.13Å; D191-R195 WeakPolarHBondContact O-CB 3.35Å; D191-R195 PolarHBondContact O-N 3.24Å; D191-R195 IonicContact OD2-CZ 3.33Å; D191-R195 IonicContact OD2-NH2 3.71Å; D191-R195 PolarHBondContact OD2-NH2 3.49Å; D191-K230 WeakPolarHBondContact OD1-CE 3.39Å; D191-K230 IonicContact OD1-NZ 2.92Å; D191-K230 PolarHBondContact OD1-NZ 3.41Å; D191-Y234 PolarHBondContact OD1-OH 3.46Å; D191-Y234 PolarHBondContact OD2-OH 2.85Å
192	T	98.6	Very high	96.1	Very high	75 Å²	75	60 Å²	60	46%	0.46	32%	0.317	S	S	.	.	H	α-helix	trans	-63.6	-50.2	179.9	-61.1	0	0	0	0	111.8	E188 K189 I190 R195 A196	E188-T192 WeakPolarHBondContact O-CB 3.5Å; E188-T192 PolarHBondContact O-N 3.22Å; E188-T192 PolarHBondContact O-OG1 3.26Å; K189-T192 PolarHBondContact O-N 3.02Å; I190-T192 VanDerWaalsContact C-N 3.35Å; T192-R195 PolarHBondContact O-N 2.96Å; T192-A196 VanDerWaalsContact O-CB 3.28Å; T192-A196 WeakPolarHBondContact O-CB 3.29Å; T192-A196 PolarHBondContact O-N 2.65Å
193	D	98.6	Very high	96.3	Very high	8 Å²	8	62.2 Å²	62.2	4%	0.043	32%	0.317	C	S	.	.	H	α-helix	trans	-66.8	-38	179.5	-73.9	-30.6	0	0	0	111.1	K189 A196 L197 I215 R219 H223 V227	K189-D193 WeakPolarHBondContact O-CB 3.39Å; K189-D193 PolarHBondContact O-N 3.11Å; D193-A196 PolarHBondContact O-N 3.35Å; D193-L197 WeakPolarHBondContact O-CG 3.32Å; D193-L197 PolarHBondContact O-N 2.89Å; D193-I215 HydrophobicContact CB-CD1 4.32Å; D193-I215 HydrophobicContact CB-CG2 4.28Å; D193-R219 IonicContact OD1-CZ 3.13Å; D193-R219 IonicContact OD1-NE 3.37Å; D193-R219 PolarHBondContact OD1-NE 2.9Å; D193-R219 IonicContact OD1-NH2 2.65Å; D193-R219 PolarHBondContact OD1-NH2 2.93Å; D193-R219 WeakPolarHBondContact OD2-CD 3.44Å; D193-R219 IonicContact OD2-CZ 3.34Å; D193-R219 IonicContact OD2-NE 3.47Å; D193-R219 PolarHBondContact OD2-NE 3.42Å; D193-R219 IonicContact OD2-NH2 2.75Å; D193-H223 IonicContact OD2-CD2 3.31Å; D193-H223 IonicContact OD2-CE1 3.77Å; D193-H223 IonicContact OD2-NE2 2.67Å; D193-H223 PolarHBondContact OD2-NE2 2.97Å; D193-V227 HydrophobicContact CB-CG1 4.27Å; D193-V227 HydrophobicContact CB-CG2 3.92Å
194	A	98.6	Very high	96.5	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.2	-44.4	175.8	0	0	0	0	0	111.8	I190 D191 Y198 V227 K230 Y234	I190-A194 WeakPolarHBondContact O-CB 3.27Å; I190-A194 PolarHBondContact O-N 3.49Å; D191-A194 PolarHBondContact O-N 3.13Å; A194-Y198 PolarHBondContact O-N 3.15Å; A194-V227 HydrophobicContact CB-CG1 4.11Å; A194-K230 HydrophobicContact CB-CB 3.97Å; A194-K230 HydrophobicContact CB-CG 3.77Å; A194-Y234 HydrophobicContact CB-CD2 4.18Å; A194-Y234 HydrophobicContact CB-CE2 4.13Å
195	R	98.1	Very high	96.3	Very high	114 Å²	114	65.5 Å²	65.5	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-64.7	-42.6	174.8	-171.7	-179.2	-59	164.6	8.5	111.4	D191 T192 L197 Y198 D199 Y234	D191-R195 WeakPolarHBondContact O-CB 3.35Å; D191-R195 PolarHBondContact O-N 3.24Å; D191-R195 IonicContact OD2-CZ 3.33Å; D191-R195 IonicContact OD2-NH2 3.71Å; D191-R195 PolarHBondContact OD2-NH2 3.49Å; T192-R195 PolarHBondContact O-N 2.96Å; R195-L197 PolarHBondContact O-N 2.94Å; R195-Y198 PolarHBondContact O-N 3.13Å; R195-Y198 VanDerWaalsContact O-N 3.16Å; R195-D199 WeakPolarHBondContact O-CB 3.46Å; R195-D199 PolarHBondContact O-N 3.38Å; R195-Y234 HydrophobicContact CB-CE1 4.45Å; R195-Y234 HydrophobicContact CB-CE2 4.11Å; R195-Y234 HydrophobicContact CG-CE1 4.4Å; R195-Y234 PolarHBondContact NE-OH 3.31Å; R195-Y234 PolarHBondContact NH2-OH 3.18Å
196	A	98.4	Very high	96	Very high	30 Å²	30	65.3 Å²	65.3	25%	0.248	32%	0.319	C	S	.	.	H	α-helix	trans	-61.2	-42.2	178.7	0	0	0	0	0	112	T192 D193 Y198 A200 T211 I215	T192-A196 VanDerWaalsContact O-CB 3.28Å; T192-A196 WeakPolarHBondContact O-CB 3.29Å; T192-A196 PolarHBondContact O-N 2.65Å; D193-A196 PolarHBondContact O-N 3.35Å; A196-Y198 VanDerWaalsContact C-N 3.31Å; A196-Y198 PolarHBondContact O-N 3.41Å; A196-A200 WeakPolarHBondContact O-CB 3.41Å; A196-A200 PolarHBondContact O-N 3.05Å; A196-T211 HydrophobicContact CB-CG2 4.31Å; A196-I215 HydrophobicContact CB-CD1 3.92Å
197	L	98.1	Very high	95.8	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.7	-39.7	174.9	-71.3	173.1	0	0	0	112.1	D193 R195 G201 W212 I215 M216 V227 Y231 M239	D193-L197 WeakPolarHBondContact O-CG 3.32Å; D193-L197 PolarHBondContact O-N 2.89Å; R195-L197 PolarHBondContact O-N 2.94Å; L197-G201 PolarHBondContact O-N 2.87Å; L197-W212 HydrophobicContact CD2-CB 4.4Å; L197-W212 HydrophobicContact CD2-CD2 4.42Å; L197-W212 HydrophobicContact CD2-CG 3.92Å; L197-W212 PolarHBondContact O-NE1 3.16Å; L197-I215 HydrophobicContact CD1-CG2 4.15Å; L197-I215 HydrophobicContact CD2-CB 4.2Å; L197-I215 HydrophobicContact CD2-CD1 3.93Å; L197-I215 HydrophobicContact CD2-CG2 4.23Å; L197-I215 HydrophobicContact CG-CD1 3.93Å; L197-I215 HydrophobicContact CG-CG2 4.29Å; L197-M216 HydrophobicContact CD2-CE 4.47Å; L197-V227 HydrophobicContact CD1-CG1 3.72Å; L197-Y231 HydrophobicContact CB-CD2 4.06Å; L197-Y231 HydrophobicContact CB-CE2 3.98Å; L197-M239 HydrophobicContact CB-CE 4.21Å; L197-M239 HydrophobicContact CD1-CE 3.64Å; L197-M239 HydrophobicContact CG-CE 4.49Å
198	Y	97.9	Very high	95.7	Very high	51 Å²	51	58 Å²	58	20%	0.2	29%	0.293	C	S	.	.	H	α-helix	trans	-70.3	-47.9	178.6	176.3	-108.4	0	0	0	112.1	A194 R195 A196 A200 G201 V202 K203 Y234	A194-Y198 PolarHBondContact O-N 3.15Å; R195-Y198 PolarHBondContact O-N 3.13Å; R195-Y198 VanDerWaalsContact O-N 3.16Å; A196-Y198 VanDerWaalsContact C-N 3.31Å; A196-Y198 PolarHBondContact O-N 3.41Å; Y198-A200 VanDerWaalsContact C-N 3.26Å; Y198-A200 PolarHBondContact O-N 2.85Å; Y198-G201 CarbonylContact O-C 3.58Å; Y198-G201 PolarHBondContact O-N 3.37Å; Y198-G201 VanDerWaalsContact O-N 3.15Å; Y198-V202 HydrophobicContact CD2-CB 3.95Å; Y198-V202 HydrophobicContact CD2-CG1 4.39Å; Y198-V202 HydrophobicContact CE2-CB 3.83Å; Y198-V202 HydrophobicContact CE2-CG1 3.81Å; Y198-V202 PolarHBondContact O-N 3.32Å; Y198-K203 HydrophobicContact CD1-CB 4.13Å; Y198-K203 HydrophobicContact CD1-CD 4.23Å; Y198-K203 HydrophobicContact CE1-CB 3.82Å; Y198-K203 HydrophobicContact CE1-CD 3.94Å; Y198-K203 HydrophobicContact CE1-CG 4.06Å; Y198-K203 WeakPolarHBondContact O-CB 3.31Å; Y198-K203 PolarHBondContact O-N 3.45Å; Y198-Y234 WeakPolarHBondContact CE2-O 3.23Å
199	D	97.4	Very high	95.7	Very high	56 Å²	56	51.2 Å²	51.2	30%	0.299	26%	0.262	S	S	.	.	H	α-helix	trans	-63.7	-32.1	178.9	-74.4	-11.1	0	0	0	111.8	R195 K203 I204	R195-D199 WeakPolarHBondContact O-CB 3.46Å; R195-D199 PolarHBondContact O-N 3.38Å; D199-K203 HydrophobicContact CB-CD 4.35Å; D199-K203 WeakPolarHBondContact OD1-CD 3.29Å; D199-K203 WeakPolarHBondContact OD1-CE 3.4Å; D199-K203 IonicContact OD1-NZ 2.78Å; D199-K203 PolarHBondContact OD1-NZ 2.73Å; D199-K203 IonicContact OD2-NZ 2.73Å; D199-I204 WeakPolarHBondContact O-CG2 3.01Å
200	A	96.4	Very high	95.6	Very high	7 Å²	7	51.9 Å²	51.9	6%	0.058	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-5.1	177	0	0	0	0	0	114.4	A196 Y198 T207 D208 T211	A196-A200 WeakPolarHBondContact O-CB 3.41Å; A196-A200 PolarHBondContact O-N 3.05Å; Y198-A200 VanDerWaalsContact C-N 3.26Å; Y198-A200 PolarHBondContact O-N 2.85Å; A200-T207 CarbonylContact O-C 3.22Å; A200-T207 WeakPolarHBondContact O-CA 3.4Å; A200-T207 WeakPolarHBondContact O-CG2 3.43Å; A200-D208 HydrophobicContact CB-CB 3.99Å; A200-D208 PolarHBondContact O-N 2.52Å; A200-T211 HydrophobicContact CB-CG2 3.8Å
201	G	94.8	Very high	95.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.4	-104.5	-179.3	0	0	0	0	0	111.3	L197 Y198 K203 I204 E246	L197-G201 PolarHBondContact O-N 2.87Å; Y198-G201 CarbonylContact O-C 3.58Å; Y198-G201 PolarHBondContact O-N 3.37Å; Y198-G201 VanDerWaalsContact O-N 3.15Å; G201-K203 PolarHBondContact O-N 3.26Å; G201-I204 VanDerWaalsContact O-CG1 3.31Å; G201-I204 WeakPolarHBondContact O-CG1 3.5Å; G201-I204 PolarHBondContact O-N 3.41Å; G201-E246 WeakPolarHBondContact CA-OE2 3.39Å
202	V	93.4	Very high	95.6	Very high	31 Å²	31	51.7 Å²	51.7	19%	0.188	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-29	-169.3	178.7	0	0	0	0	114.6	Y198 Y231 Y237 E246	Y198-V202 HydrophobicContact CD2-CB 3.95Å; Y198-V202 HydrophobicContact CD2-CG1 4.39Å; Y198-V202 HydrophobicContact CE2-CB 3.83Å; Y198-V202 HydrophobicContact CE2-CG1 3.81Å; Y198-V202 PolarHBondContact O-N 3.32Å; V202-Y231 WeakPolarHBondContact CG2-OH 3.34Å; V202-Y237 HydrophobicContact CG1-CD2 4.14Å; V202-Y237 HydrophobicContact CG1-CE2 4.24Å; V202-Y237 HydrophobicContact CG2-CD2 4.36Å; V202-E246 HydrophobicContact CG2-CG 4.32Å
203	K	94	Very high	95.6	Very high	125 Å²	125	48.7 Å²	48.7	54%	0.543	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-27.1	-179.8	-170.2	178.3	-175.8	-177.9	0	114.2	Y198 D199 G201	Y198-K203 HydrophobicContact CD1-CB 4.13Å; Y198-K203 HydrophobicContact CD1-CD 4.23Å; Y198-K203 HydrophobicContact CE1-CB 3.82Å; Y198-K203 HydrophobicContact CE1-CD 3.94Å; Y198-K203 HydrophobicContact CE1-CG 4.06Å; Y198-K203 WeakPolarHBondContact O-CB 3.31Å; Y198-K203 PolarHBondContact O-N 3.45Å; D199-K203 HydrophobicContact CB-CD 4.35Å; D199-K203 WeakPolarHBondContact OD1-CD 3.29Å; D199-K203 WeakPolarHBondContact OD1-CE 3.4Å; D199-K203 IonicContact OD1-NZ 2.78Å; D199-K203 PolarHBondContact OD1-NZ 2.73Å; D199-K203 IonicContact OD2-NZ 2.73Å; G201-K203 PolarHBondContact O-N 3.26Å
204	I	91.4	Very high	95.6	Very high	84 Å²	84	50.5 Å²	50.5	43%	0.431	26%	0.264	S	S	.	.	S	Bend	trans	-113.2	168.9	-172.5	61.4	164.8	0	0	0	111.2	D199 G201 G206	D199-I204 WeakPolarHBondContact O-CG2 3.01Å; G201-I204 VanDerWaalsContact O-CG1 3.31Å; G201-I204 WeakPolarHBondContact O-CG1 3.5Å; G201-I204 PolarHBondContact O-N 3.41Å; I204-G206 WeakPolarHBondContact CG1-O 3.4Å; I204-G206 PolarHBondContact O-N 3.37Å
205	K	87.2	Confident	95.5	Very high	220 Å²	220	50.8 Å²	50.8	96%	0.957	27%	0.266	S	S	*	.	S	Bend	trans	-87.2	108.7	172.5	-172.8	178.2	179.3	-180	0	109.4
206	G	87.3	Confident	95.5	Very high	45 Å²	45	45.3 Å²	45.3	46%	0.464	25%	0.245	S	C	.	.	S	Bend	trans	95.3	-175	-171.4	0	0	0	0	0	110.8	I204	I204-G206 WeakPolarHBondContact CG1-O 3.4Å; I204-G206 PolarHBondContact O-N 3.37Å
207	T	91.4	Very high	95.5	Very high	34 Å²	34	44.1 Å²	44.1	21%	0.209	24%	0.235	C	C	.	.			trans	-133.8	127.7	-172.6	-42	0	0	0	0	110.3	A200 V209 W212 E246 V247	A200-T207 CarbonylContact O-C 3.22Å; A200-T207 WeakPolarHBondContact O-CA 3.4Å; A200-T207 WeakPolarHBondContact O-CG2 3.43Å; T207-V209 HydrophobicContact CG2-CG2 4.2Å; T207-V209 PolarHBondContact O-N 3.33Å; T207-W212 HydrophobicContact CG2-CD2 4.28Å; T207-W212 HydrophobicContact CG2-CZ2 4.37Å; T207-E246 HydrophobicContact CG2-CB 4.12Å; T207-E246 WeakPolarHBondContact OG1-CB 3.34Å; T207-E246 PolarHBondContact OG1-O 3.33Å; T207-E246 PolarHBondContact OG1-OE2 3.31Å; T207-V247 HydrophobicContact CG2-CG1 4.41Å
208	D	95.9	Very high	95.4	Very high	64 Å²	64	47.7 Å²	47.7	34%	0.342	25%	0.251	S	S	.	.			trans	-76.4	83.9	163.7	176.2	17.6	0	0	0	109.6	A200 N210 T211 W212	A200-D208 HydrophobicContact CB-CB 3.99Å; A200-D208 PolarHBondContact O-N 2.52Å; D208-N210 PolarHBondContact O-N 2.75Å; D208-N210 PolarHBondContact OD1-N 2.84Å; D208-N210 VanDerWaalsContact OD1-N 3.14Å; D208-T211 PolarHBondContact O-N 2.99Å; D208-T211 PolarHBondContact OD1-N 3.31Å; D208-T211 WeakPolarHBondContact OD2-CB 3.31Å; D208-T211 PolarHBondContact OD2-OG1 3.43Å; D208-W212 PolarHBondContact O-N 3.01Å
209	V	96.4	Very high	95.4	Very high	12 Å²	12	47 Å²	47	7%	0.073	25%	0.248	C	C	.	.	H	α-helix	trans	-61.6	-27.5	-179	179	0	0	0	0	112.2	N165 T207 T211 W212 I213 V247 L251 F255	N165-V209 HydrophobicContact CB-CG1 3.81Å; T207-V209 HydrophobicContact CG2-CG2 4.2Å; T207-V209 PolarHBondContact O-N 3.33Å; V209-T211 PolarHBondContact O-N 3.04Å; V209-W212 PolarHBondContact O-N 3.39Å; V209-I213 HydrophobicContact CG1-CD1 3.75Å; V209-I213 HydrophobicContact CG1-CG1 4Å; V209-I213 VanDerWaalsContact O-CG1 3.28Å; V209-I213 WeakPolarHBondContact O-CG1 3.24Å; V209-I213 PolarHBondContact O-N 2.67Å; V209-V247 HydrophobicContact CG2-CG1 4.07Å; V209-L251 HydrophobicContact CG1-CD1 4.36Å; V209-L251 HydrophobicContact CG1-CD2 3.74Å; V209-L251 HydrophobicContact CG2-CD2 4.14Å; V209-F255 HydrophobicContact CG1-CE2 4.31Å
210	N	97.6	Very high	95.4	Very high	88 Å²	88	44.9 Å²	44.9	47%	0.471	24%	0.238	S	C	.	.	H	α-helix	trans	-68.3	-38.8	-178.5	-61.7	-46.5	0	0	0	111	K168 D208 W212 I213 S214	K168-N210 PolarHBondContact NZ-OD1 3.48Å; D208-N210 PolarHBondContact O-N 2.75Å; D208-N210 PolarHBondContact OD1-N 2.84Å; D208-N210 VanDerWaalsContact OD1-N 3.14Å; N210-W212 VanDerWaalsContact C-N 3.34Å; N210-I213 PolarHBondContact O-N 3.39Å; N210-S214 WeakPolarHBondContact O-CB 3.36Å; N210-S214 PolarHBondContact O-N 2.82Å
211	T	98.1	Very high	95.4	Very high	41 Å²	41	46.4 Å²	46.4	25%	0.252	25%	0.246	S	C	.	.	H	α-helix	trans	-61.1	-44.7	173.9	-69.4	0	0	0	0	110.9	A196 A200 D208 V209 S214 I215	A196-T211 HydrophobicContact CB-CG2 4.31Å; A200-T211 HydrophobicContact CB-CG2 3.8Å; D208-T211 PolarHBondContact O-N 2.99Å; D208-T211 PolarHBondContact OD1-N 3.31Å; D208-T211 WeakPolarHBondContact OD2-CB 3.31Å; D208-T211 PolarHBondContact OD2-OG1 3.43Å; V209-T211 PolarHBondContact O-N 3.04Å; T211-S214 PolarHBondContact O-N 3.49Å; T211-I215 HydrophobicContact CG2-CD1 3.89Å; T211-I215 WeakPolarHBondContact O-CG1 3.41Å; T211-I215 PolarHBondContact O-N 3.06Å
212	W	97.9	Very high	95.4	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.3	-46.4	176.2	-77.8	36.5	0	0	0	112.5	L197 T207 D208 V209 N210 S214 M216 I243 E246 F255	L197-W212 HydrophobicContact CD2-CB 4.4Å; L197-W212 HydrophobicContact CD2-CD2 4.42Å; L197-W212 HydrophobicContact CD2-CG 3.92Å; L197-W212 PolarHBondContact O-NE1 3.16Å; T207-W212 HydrophobicContact CG2-CD2 4.28Å; T207-W212 HydrophobicContact CG2-CZ2 4.37Å; D208-W212 PolarHBondContact O-N 3.01Å; V209-W212 PolarHBondContact O-N 3.39Å; N210-W212 VanDerWaalsContact C-N 3.34Å; W212-S214 PolarHBondContact O-N 3.48Å; W212-M216 HydrophobicContact CE3-CE 4.33Å; W212-M216 WeakPolarHBondContact O-CB 3.24Å; W212-M216 WeakPolarHBondContact O-CG 3.32Å; W212-M216 PolarHBondContact O-N 2.96Å; W212-I243 HydrophobicContact CE3-CG1 4.34Å; W212-I243 HydrophobicContact CH2-CG1 4.13Å; W212-I243 HydrophobicContact CZ3-CB 4.2Å; W212-I243 HydrophobicContact CZ3-CG1 3.48Å; W212-I243 VanDerWaalsContact CZ3-CG1 3.48Å; W212-E246 HydrophobicContact CH2-CB 3.88Å; W212-E246 HydrophobicContact CH2-CG 3.96Å; W212-E246 HydrophobicContact CZ2-CB 4.41Å; W212-E246 HydrophobicContact CZ2-CG 4.18Å; W212-E246 HydrophobicContact CZ3-CB 4.43Å; W212-F255 HydrophobicContact CB-CE1 4.21Å; W212-F255 HydrophobicContact CB-CE2 4.43Å; W212-F255 HydrophobicContact CB-CZ 3.75Å; W212-F255 HydrophobicContact CE3-CD2 4.34Å; W212-F255 HydrophobicContact CE3-CE2 4.22Å; W212-F255 HydrophobicContact CE3-CZ 4.42Å
213	I	98.5	Very high	95.6	Very high	13 Å²	13	48.4 Å²	48.4	7%	0.067	26%	0.259	C	S	.	.	H	α-helix	trans	-58.9	-49.1	176.8	-69.8	172.6	0	0	0	110.1	K168 L169 A172 V209 N210 I215 S217 F255	K168-I213 HydrophobicContact CB-CD1 3.72Å; L169-I213 HydrophobicContact CB-CD1 4.06Å; L169-I213 HydrophobicContact CB-CG1 4.01Å; L169-I213 HydrophobicContact CD1-CB 4.48Å; L169-I213 HydrophobicContact CD1-CG1 4.11Å; L169-I213 HydrophobicContact CD1-CG2 4.23Å; A172-I213 HydrophobicContact CB-CG2 3.65Å; V209-I213 HydrophobicContact CG1-CD1 3.75Å; V209-I213 HydrophobicContact CG1-CG1 4Å; V209-I213 VanDerWaalsContact O-CG1 3.28Å; V209-I213 WeakPolarHBondContact O-CG1 3.24Å; V209-I213 PolarHBondContact O-N 2.67Å; N210-I213 PolarHBondContact O-N 3.39Å; I213-I215 PolarHBondContact O-N 3.48Å; I213-S217 VanDerWaalsContact O-CB 3.22Å; I213-S217 WeakPolarHBondContact O-CB 3.28Å; I213-S217 PolarHBondContact O-N 3.27Å; I213-S217 PolarHBondContact O-OG 2.97Å; I213-F255 HydrophobicContact CG1-CZ 3.81Å
214	S	98.2	Very high	95.8	Very high	45 Å²	45	42.5 Å²	42.5	32%	0.315	23%	0.233	S	C	.	.	H	α-helix	trans	-57.5	-52.9	-178.4	-177.2	0	0	0	0	111.4	N210 T211 W212 S217 Q218	N210-S214 WeakPolarHBondContact O-CB 3.36Å; N210-S214 PolarHBondContact O-N 2.82Å; T211-S214 PolarHBondContact O-N 3.49Å; W212-S214 PolarHBondContact O-N 3.48Å; S214-S217 PolarHBondContact O-OG 3.3Å; S214-Q218 VanDerWaalsContact O-CB 3.24Å; S214-Q218 WeakPolarHBondContact O-CB 3.11Å; S214-Q218 WeakPolarHBondContact O-CG 3.47Å; S214-Q218 PolarHBondContact O-N 3.07Å
215	I	98.2	Very high	96.1	Very high	6 Å²	6	42.8 Å²	42.8	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-64	-50	-178.6	-66.3	171.5	0	0	0	111	D193 A196 L197 T211 I213 S217 R219 L224	D193-I215 HydrophobicContact CB-CD1 4.32Å; D193-I215 HydrophobicContact CB-CG2 4.28Å; A196-I215 HydrophobicContact CB-CD1 3.92Å; L197-I215 HydrophobicContact CD1-CG2 4.15Å; L197-I215 HydrophobicContact CD2-CB 4.2Å; L197-I215 HydrophobicContact CD2-CD1 3.93Å; L197-I215 HydrophobicContact CD2-CG2 4.23Å; L197-I215 HydrophobicContact CG-CD1 3.93Å; L197-I215 HydrophobicContact CG-CG2 4.29Å; T211-I215 HydrophobicContact CG2-CD1 3.89Å; T211-I215 WeakPolarHBondContact O-CG1 3.41Å; T211-I215 PolarHBondContact O-N 3.06Å; I213-I215 PolarHBondContact O-N 3.48Å; I215-S217 PolarHBondContact O-N 2.61Å; I215-R219 HydrophobicContact CG2-CG 4.08Å; I215-R219 WeakPolarHBondContact O-CB 3.2Å; I215-R219 VanDerWaalsContact O-CG 3.31Å; I215-R219 WeakPolarHBondContact O-CG 3.24Å; I215-R219 PolarHBondContact O-N 3.02Å; I215-L224 HydrophobicContact CG2-CD2 3.92Å
216	M	97.5	Very high	96.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-73.4	-25.9	-174	-66	-161.7	-172.8	0	0	114.1	R178 L197 W212 F228 M239 I243 F255 V259 F262	R178-M216 PolarHBondContact NH1-O 3.48Å; R178-M216 PolarHBondContact NH2-O 3.41Å; L197-M216 HydrophobicContact CD2-CE 4.47Å; W212-M216 HydrophobicContact CE3-CE 4.33Å; W212-M216 WeakPolarHBondContact O-CB 3.24Å; W212-M216 WeakPolarHBondContact O-CG 3.32Å; W212-M216 PolarHBondContact O-N 2.96Å; M216-F228 HydrophobicContact CE-CE1 4.39Å; M216-M239 HydrophobicContact CE-CG 4.12Å; M216-M239 HydrophobicContact CE-SD 3.6Å; M216-M239 VanDerWaalsContact CE-SD 3.6Å; M216-I243 HydrophobicContact CE-CD1 4.35Å; M216-F255 HydrophobicContact CB-CE1 4.24Å; M216-F255 HydrophobicContact CE-CD1 4.34Å; M216-F255 HydrophobicContact CG-CD1 4.44Å; M216-F255 HydrophobicContact CG-CE1 4.28Å; M216-F255 HydrophobicContact SD-CD1 3.3Å; M216-F255 WeakPolarHBondContact SD-CD1 3.39Å; M216-F255 HydrophobicContact SD-CE1 3.68Å; M216-F255 HydrophobicContact SD-CG 4.3Å; M216-V259 HydrophobicContact CE-CG2 4.13Å; M216-V259 HydrophobicContact SD-CG2 4.15Å; M216-F262 WeakPolarHBondContact O-CZ 3.34Å
217	S	97.8	Very high	97.2	Very high	5 Å²	5	34 Å²	34	4%	0.035	18%	0.177	C	C	.	.	H	α-helix	trans	-86.2	-31.9	177.1	62.8	0	0	0	0	113.2	R178 I213 S214 I215	R178-S217 PolarHBondContact NH2-O 3.1Å; I213-S217 VanDerWaalsContact O-CB 3.22Å; I213-S217 WeakPolarHBondContact O-CB 3.28Å; I213-S217 PolarHBondContact O-N 3.27Å; I213-S217 PolarHBondContact O-OG 2.97Å; S214-S217 PolarHBondContact O-OG 3.3Å; I215-S217 PolarHBondContact O-N 2.61Å
218	Q	97.1	Very high	97.5	Very high	74 Å²	74	32.5 Å²	32.5	35%	0.346	17%	0.168	S	C	.	.	H	α-helix	trans	-102.1	-29.8	-171	-61.4	174.8	17	0	0	114	R178 D179 S214	R178-Q218 CarbonylContact C-O 3.55Å; R178-Q218 WeakPolarHBondContact CA-O 3.37Å; D179-Q218 WeakPolarHBondContact CB-O 3.31Å; D179-Q218 PolarHBondContact N-O 3.37Å; S214-Q218 VanDerWaalsContact O-CB 3.24Å; S214-Q218 WeakPolarHBondContact O-CB 3.11Å; S214-Q218 WeakPolarHBondContact O-CG 3.47Å; S214-Q218 PolarHBondContact O-N 3.07Å
219	R	97.8	Very high	97.5	Very high	37 Å²	37	34.2 Å²	34.2	14%	0.14	18%	0.177	C	C	.	.	S	Bend	trans	-73.7	147.9	-178.5	-63.6	-61.9	-178	-95.1	-13.6	112.2	R178 K189 D193 I215 L224	R178-R219 VanDerWaalsContact CG-O 3.29Å; R178-R219 WeakPolarHBondContact CG-O 3.45Å; R178-R219 PolarHBondContact NH1-O 3.33Å; K189-R219 VanDerWaalsContact CE-NE 3.32Å; D193-R219 IonicContact OD1-CZ 3.13Å; D193-R219 IonicContact OD1-NE 3.37Å; D193-R219 PolarHBondContact OD1-NE 2.9Å; D193-R219 IonicContact OD1-NH2 2.65Å; D193-R219 PolarHBondContact OD1-NH2 2.93Å; D193-R219 WeakPolarHBondContact OD2-CD 3.44Å; D193-R219 IonicContact OD2-CZ 3.34Å; D193-R219 IonicContact OD2-NE 3.47Å; D193-R219 PolarHBondContact OD2-NE 3.42Å; D193-R219 IonicContact OD2-NH2 2.75Å; I215-R219 HydrophobicContact CG2-CG 4.08Å; I215-R219 WeakPolarHBondContact O-CB 3.2Å; I215-R219 VanDerWaalsContact O-CG 3.31Å; I215-R219 WeakPolarHBondContact O-CG 3.24Å; I215-R219 PolarHBondContact O-N 3.02Å; R219-L224 HydrophobicContact CB-CD1 4.15Å; R219-L224 HydrophobicContact CB-CD2 3.76Å; R219-L224 HydrophobicContact CB-CG 3.68Å; R219-L224 HydrophobicContact CG-CD2 4.32Å; R219-L224 WeakPolarHBondContact O-CD1 3.3Å
220	S	97	Very high	97.6	Very high	12 Å²	12	37.4 Å²	37.4	8%	0.084	19%	0.19	C	C	.	.			trans	-61.5	148.1	174.7	73.3	0	0	0	0	111	D179 H223 L224	D179-S220 VanDerWaalsContact O-CA 3.31Å; D179-S220 WeakPolarHBondContact O-CA 3.37Å; D179-S220 WeakPolarHBondContact O-CB 3.22Å; S220-H223 WeakPolarHBondContact O-CB 3.42Å; S220-H223 PolarHBondContact O-N 3.28Å; S220-H223 VanDerWaalsContact O-N 3.13Å; S220-H223 WeakPolarHBondContact OG-CB 3.42Å; S220-H223 PolarHBondContact OG-N 3.07Å; S220-L224 PolarHBondContact O-N 3.4Å
221	V	95.7	Very high	97.7	Very high	38 Å²	38	33.2 Å²	33.2	23%	0.23	17%	0.168	C	C	.	.	H	α-helix	trans	-59.1	-42.9	-178.7	178.3	0	0	0	0	112.3	H223 L224 R225 F262	V221-H223 VanDerWaalsContact C-N 3.3Å; V221-H223 PolarHBondContact O-N 3.17Å; V221-L224 PolarHBondContact O-N 2.86Å; V221-R225 PolarHBondContact O-N 2.87Å; V221-F262 HydrophobicContact CB-CD1 4.43Å; V221-F262 HydrophobicContact CG1-CB 4.07Å; V221-F262 HydrophobicContact CG1-CD1 4.03Å; V221-F262 HydrophobicContact CG1-CG 4.34Å; V221-F262 HydrophobicContact CG2-CD1 3.72Å; V221-F262 HydrophobicContact CG2-CE1 3.96Å
222	P	96	Very high	97.6	Very high	54 Å²	54	36.7 Å²	36.7	35%	0.351	18%	0.179	S	C	.	.	H	α-helix	trans	-61.6	-35.2	175.4	-25.2	36.8	0	0	0	113.7	P181 K226	P181-P222 HydrophobicContact CB-CG 4.19Å; P181-P222 HydrophobicContact CG-CG 4.4Å; P222-K226 PolarHBondContact O-N 3.46Å
223	H	97.4	Very high	97.6	Very high	20 Å²	20	40.2 Å²	40.2	9%	0.093	20%	0.204	C	C	.	.	H	α-helix	trans	-65.6	-48.3	173.7	-179.9	88.1	0	0	0	111.1	D193 S220 V221 R225 K226 V227	D193-H223 IonicContact OD2-CD2 3.31Å; D193-H223 IonicContact OD2-CE1 3.77Å; D193-H223 IonicContact OD2-NE2 2.67Å; D193-H223 PolarHBondContact OD2-NE2 2.97Å; S220-H223 WeakPolarHBondContact O-CB 3.42Å; S220-H223 PolarHBondContact O-N 3.28Å; S220-H223 VanDerWaalsContact O-N 3.13Å; S220-H223 WeakPolarHBondContact OG-CB 3.42Å; S220-H223 PolarHBondContact OG-N 3.07Å; V221-H223 VanDerWaalsContact C-N 3.3Å; V221-H223 PolarHBondContact O-N 3.17Å; H223-R225 VanDerWaalsContact C-N 3.33Å; H223-R225 PolarHBondContact O-N 2.88Å; H223-K226 PolarHBondContact O-N 2.87Å; H223-V227 WeakPolarHBondContact NE2-CG2 3.27Å; H223-V227 WeakPolarHBondContact O-CG2 3.47Å; H223-V227 PolarHBondContact O-N 3.29Å
224	L	98	Very high	97.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.8	-40	-179.6	-73.7	171.9	0	0	0	112.9	R178 I215 R219 S220 V221 K226 V227 F228 F262	R178-L224 VanDerWaalsContact NH1-CD1 3.35Å; I215-L224 HydrophobicContact CG2-CD2 3.92Å; R219-L224 HydrophobicContact CB-CD1 4.15Å; R219-L224 HydrophobicContact CB-CD2 3.76Å; R219-L224 HydrophobicContact CB-CG 3.68Å; R219-L224 HydrophobicContact CG-CD2 4.32Å; R219-L224 WeakPolarHBondContact O-CD1 3.3Å; S220-L224 PolarHBondContact O-N 3.4Å; V221-L224 PolarHBondContact O-N 2.86Å; L224-K226 VanDerWaalsContact C-N 3.3Å; L224-K226 PolarHBondContact O-N 3.36Å; L224-V227 WeakPolarHBondContact O-CB 3.2Å; L224-V227 PolarHBondContact O-N 3.37Å; L224-F228 HydrophobicContact CB-CE2 4.28Å; L224-F228 HydrophobicContact CB-CZ 4.07Å; L224-F228 HydrophobicContact CD2-CE1 4.36Å; L224-F228 HydrophobicContact CD2-CZ 4.36Å; L224-F228 WeakPolarHBondContact O-CD1 3.49Å; L224-F228 WeakPolarHBondContact O-CD2 3.34Å; L224-F228 WeakPolarHBondContact O-CG 3.36Å; L224-F228 PolarHBondContact O-N 3.21Å; L224-F262 HydrophobicContact CB-CD2 4.36Å; L224-F262 HydrophobicContact CD1-CD2 3.78Å; L224-F262 HydrophobicContact CD1-CE2 3.49Å; L224-F262 VanDerWaalsContact CD1-CE2 3.49Å; L224-F262 HydrophobicContact CD1-CG 4.45Å; L224-F262 HydrophobicContact CD1-CZ 3.93Å
225	R	97.5	Very high	97.4	Very high	90 Å²	90	40.6 Å²	40.6	34%	0.34	20%	0.2	S	C	.	.	H	α-helix	trans	-54.1	-47.3	172.8	-73.3	177.4	175.5	149	10.5	111.4	V221 H223 F228 D229 F262	V221-R225 PolarHBondContact O-N 2.87Å; H223-R225 VanDerWaalsContact C-N 3.33Å; H223-R225 PolarHBondContact O-N 2.88Å; R225-F228 PolarHBondContact O-N 3.16Å; R225-D229 PolarHBondContact O-N 3.25Å; R225-F262 PolarHBondContact NE-O 3.45Å; R225-F262 PolarHBondContact NH2-O 2.9Å
226	K	97.8	Very high	97.3	Very high	80 Å²	80	45 Å²	45	35%	0.348	23%	0.228	S	C	.	.	H	α-helix	trans	-69.5	-35.4	178.6	-63.4	-174.8	180	-160.2	0	112.8	V185 I190 P222 H223 L224 F228 D229 K230	V185-K226 HydrophobicContact CG1-CD 3.83Å; I190-K226 HydrophobicContact CD1-CB 3.7Å; I190-K226 HydrophobicContact CD1-CD 3.7Å; I190-K226 HydrophobicContact CD1-CG 4.35Å; I190-K226 HydrophobicContact CG1-CB 4.14Å; I190-K226 HydrophobicContact CG2-CB 4.27Å; P222-K226 PolarHBondContact O-N 3.46Å; H223-K226 PolarHBondContact O-N 2.87Å; L224-K226 VanDerWaalsContact C-N 3.3Å; L224-K226 PolarHBondContact O-N 3.36Å; K226-F228 VanDerWaalsContact C-N 3.33Å; K226-D229 PolarHBondContact O-N 3.47Å; K226-K230 WeakPolarHBondContact O-CB 3.26Å; K226-K230 PolarHBondContact O-N 3.17Å
227	V	98.4	Very high	97.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.4	-43.8	172.6	168.8	0	0	0	0	110.6	I190 D193 A194 L197 H223 L224 D229 K230 Y231	I190-V227 HydrophobicContact CB-CG2 4.46Å; I190-V227 HydrophobicContact CG1-CG2 4.41Å; I190-V227 HydrophobicContact CG2-CG2 4.29Å; D193-V227 HydrophobicContact CB-CG1 4.27Å; D193-V227 HydrophobicContact CB-CG2 3.92Å; A194-V227 HydrophobicContact CB-CG1 4.11Å; L197-V227 HydrophobicContact CD1-CG1 3.72Å; H223-V227 WeakPolarHBondContact NE2-CG2 3.27Å; H223-V227 WeakPolarHBondContact O-CG2 3.47Å; H223-V227 PolarHBondContact O-N 3.29Å; L224-V227 WeakPolarHBondContact O-CB 3.2Å; L224-V227 PolarHBondContact O-N 3.37Å; V227-D229 VanDerWaalsContact C-N 3.35Å; V227-D229 PolarHBondContact O-N 2.94Å; V227-K230 PolarHBondContact O-N 3.47Å; V227-Y231 VanDerWaalsContact O-CB 3.27Å; V227-Y231 WeakPolarHBondContact O-CB 3.34Å; V227-Y231 PolarHBondContact O-N 2.91Å
228	F	98.2	Very high	97.2	Very high	3 Å²	3	52 Å²	52	1%	0.013	26%	0.26	C	S	.	.	H	α-helix	trans	-66.7	-35.6	179.1	-57.9	-22.8	0	0	0	112.7	M216 L224 R225 K226 M239 V259 F262 E263	M216-F228 HydrophobicContact CE-CE1 4.39Å; L224-F228 HydrophobicContact CB-CE2 4.28Å; L224-F228 HydrophobicContact CB-CZ 4.07Å; L224-F228 HydrophobicContact CD2-CE1 4.36Å; L224-F228 HydrophobicContact CD2-CZ 4.36Å; L224-F228 WeakPolarHBondContact O-CD1 3.49Å; L224-F228 WeakPolarHBondContact O-CD2 3.34Å; L224-F228 WeakPolarHBondContact O-CG 3.36Å; L224-F228 PolarHBondContact O-N 3.21Å; R225-F228 PolarHBondContact O-N 3.16Å; K226-F228 VanDerWaalsContact C-N 3.33Å; F228-M239 HydrophobicContact CD1-CB 4.19Å; F228-M239 HydrophobicContact CD1-CE 3.94Å; F228-M239 HydrophobicContact CD1-CG 3.88Å; F228-M239 HydrophobicContact CE1-CE 4.25Å; F228-M239 HydrophobicContact CE1-CG 3.92Å; F228-M239 HydrophobicContact CG-CB 4.36Å; F228-M239 HydrophobicContact CG-CG 4.41Å; F228-M239 HydrophobicContact CZ-CG 4.49Å; F228-V259 HydrophobicContact CD2-CG1 4.19Å; F228-V259 HydrophobicContact CE1-CG2 4.46Å; F228-V259 HydrophobicContact CE2-CB 4.31Å; F228-V259 HydrophobicContact CE2-CG1 3.96Å; F228-V259 HydrophobicContact CE2-CG2 4.03Å; F228-V259 HydrophobicContact CZ-CG2 3.8Å; F228-F262 HydrophobicContact CE2-CB 4.13Å; F228-F262 AromaticContact CE2-CD2 3.95Å; F228-F262 HydrophobicContact CE2-CD2 3.95Å; F228-F262 AromaticContact CZ-CD2 3.96Å; F228-F262 HydrophobicContact CZ-CD2 3.96Å; F228-E263 HydrophobicContact CD2-CG 4.47Å
229	D	97.4	Very high	97.3	Very high	101 Å²	101	48.8 Å²	48.8	54%	0.54	25%	0.245	S	C	.	.	H	α-helix	trans	-67.1	-43.1	172	-75.1	-30.9	0	0	0	112.2	R225 K226 V227 Y231 K232	R225-D229 PolarHBondContact O-N 3.25Å; K226-D229 PolarHBondContact O-N 3.47Å; V227-D229 VanDerWaalsContact C-N 3.35Å; V227-D229 PolarHBondContact O-N 2.94Å; D229-Y231 VanDerWaalsContact C-N 3.34Å; D229-Y231 PolarHBondContact O-N 3.26Å; D229-K232 WeakPolarHBondContact O-CB 3.37Å; D229-K232 PolarHBondContact O-N 3.28Å; D229-K232 IonicContact OD1-NZ 3.6Å; D229-K232 PolarHBondContact OD1-NZ 2.74Å
230	K	98.3	Very high	97.3	Very high	78 Å²	78	49.3 Å²	49.3	34%	0.339	25%	0.249	S	C	.	.	H	α-helix	trans	-67.1	-34.3	177.3	-177.8	58	177.5	170.4	0	112.6	I190 D191 A194 K226 V227 K232 S233 Y234	I190-K230 HydrophobicContact CG2-CB 3.8Å; I190-K230 HydrophobicContact CG2-CG 4.17Å; D191-K230 WeakPolarHBondContact OD1-CE 3.39Å; D191-K230 IonicContact OD1-NZ 2.92Å; D191-K230 PolarHBondContact OD1-NZ 3.41Å; A194-K230 HydrophobicContact CB-CB 3.97Å; A194-K230 HydrophobicContact CB-CG 3.77Å; K226-K230 WeakPolarHBondContact O-CB 3.26Å; K226-K230 PolarHBondContact O-N 3.17Å; V227-K230 PolarHBondContact O-N 3.47Å; K230-K232 PolarHBondContact O-N 2.94Å; K230-S233 WeakPolarHBondContact O-CB 3.14Å; K230-S233 PolarHBondContact O-N 3.48Å; K230-S233 PolarHBondContact O-OG 2.94Å; K230-Y234 HydrophobicContact CG-CE2 4.34Å
231	Y	98.1	Very high	97.3	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-55.5	-33.3	178.7	180	-94.8	0	0	0	112.7	L197 V202 V227 D229 S233 Y234 S235 Y237 M239 S242	L197-Y231 HydrophobicContact CB-CD2 4.06Å; L197-Y231 HydrophobicContact CB-CE2 3.98Å; V202-Y231 WeakPolarHBondContact CG2-OH 3.34Å; V227-Y231 VanDerWaalsContact O-CB 3.27Å; V227-Y231 WeakPolarHBondContact O-CB 3.34Å; V227-Y231 PolarHBondContact O-N 2.91Å; D229-Y231 VanDerWaalsContact C-N 3.34Å; D229-Y231 PolarHBondContact O-N 3.26Å; Y231-S233 PolarHBondContact O-N 2.92Å; Y231-S233 VanDerWaalsContact O-N 3.1Å; Y231-Y234 PolarHBondContact O-N 3.09Å; Y231-S235 WeakPolarHBondContact CE1-OG 3.06Å; Y231-S235 VanDerWaalsContact CZ-CB 3.49Å; Y231-S235 PolarHBondContact O-N 2.86Å; Y231-Y237 WeakPolarHBondContact CE1-O 3.47Å; Y231-M239 HydrophobicContact CD1-CE 3.73Å; Y231-M239 HydrophobicContact CD2-CE 3.47Å; Y231-M239 VanDerWaalsContact CD2-CE 3.47Å; Y231-M239 HydrophobicContact CE1-CE 3.9Å; Y231-M239 HydrophobicContact CE2-CE 3.65Å; Y231-M239 HydrophobicContact CG-CE 3.51Å; Y231-S242 WeakPolarHBondContact CE1-OG 3.29Å; Y231-S242 VanDerWaalsContact OH-CB 3.3Å; Y231-S242 WeakPolarHBondContact OH-CB 3.39Å; Y231-S242 PolarHBondContact OH-OG 3.36Å
232	K	96.8	Very high	97.4	Very high	114 Å²	114	50.8 Å²	50.8	50%	0.496	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.9	175.8	-60.8	166.3	-173.7	162.3	0	113.7	D229 K230	D229-K232 WeakPolarHBondContact O-CB 3.37Å; D229-K232 PolarHBondContact O-N 3.28Å; D229-K232 IonicContact OD1-NZ 3.6Å; D229-K232 PolarHBondContact OD1-NZ 2.74Å; K230-K232 PolarHBondContact O-N 2.94Å
233	S	97.4	Very high	97.5	Very high	75 Å²	75	48.2 Å²	48.2	52%	0.524	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-15	174	69	0	0	0	0	114.1	K230 Y231	K230-S233 WeakPolarHBondContact O-CB 3.14Å; K230-S233 PolarHBondContact O-N 3.48Å; K230-S233 PolarHBondContact O-OG 2.94Å; Y231-S233 PolarHBondContact O-N 2.92Å; Y231-S233 VanDerWaalsContact O-N 3.1Å
234	Y	97.1	Very high	97.5	Very high	58 Å²	58	50.1 Å²	50.1	23%	0.227	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-41.9	179.5	-66.8	-66.9	0	0	0	112.3	D191 A194 R195 Y198 K230 Y231	D191-Y234 PolarHBondContact OD1-OH 3.46Å; D191-Y234 PolarHBondContact OD2-OH 2.85Å; A194-Y234 HydrophobicContact CB-CD2 4.18Å; A194-Y234 HydrophobicContact CB-CE2 4.13Å; R195-Y234 HydrophobicContact CB-CE1 4.45Å; R195-Y234 HydrophobicContact CB-CE2 4.11Å; R195-Y234 HydrophobicContact CG-CE1 4.4Å; R195-Y234 PolarHBondContact NE-OH 3.31Å; R195-Y234 PolarHBondContact NH2-OH 3.18Å; Y198-Y234 WeakPolarHBondContact CE2-O 3.23Å; K230-Y234 HydrophobicContact CG-CE2 4.34Å; Y231-Y234 PolarHBondContact O-N 3.09Å
235	S	96.6	Very high	97.4	Very high	8 Å²	8	54.2 Å²	54.2	6%	0.056	27%	0.266	C	S	.	.			trans	-99.4	141.5	-175.2	178.5	0	0	0	0	111.8	Y231 Y237	Y231-S235 WeakPolarHBondContact CE1-OG 3.06Å; Y231-S235 VanDerWaalsContact CZ-CB 3.49Å; Y231-S235 PolarHBondContact O-N 2.86Å; S235-Y237 VanDerWaalsContact CB-O 3.27Å; S235-Y237 WeakPolarHBondContact CB-O 3.32Å; S235-Y237 PolarHBondContact O-N 3.48Å; S235-Y237 PolarHBondContact OG-N 3.41Å; S235-Y237 PolarHBondContact OG-O 3Å
236	P	95.7	Very high	97.3	Very high	98 Å²	98	52.1 Å²	52.1	64%	0.636	26%	0.26	S	S	*	.	S	Bend	trans	-71.7	-11.3	168.8	32.4	-36	0	0	0	113.1
237	Y	96.8	Very high	97.2	Very high	78 Å²	78	48.7 Å²	48.7	31%	0.306	25%	0.246	S	C	.	.	S	Bend	trans	-114.9	149.5	179.7	-49.6	-58	0	0	0	110.3	V202 Y231 S235 E241 K245	V202-Y237 HydrophobicContact CG1-CD2 4.14Å; V202-Y237 HydrophobicContact CG1-CE2 4.24Å; V202-Y237 HydrophobicContact CG2-CD2 4.36Å; Y231-Y237 WeakPolarHBondContact CE1-O 3.47Å; S235-Y237 VanDerWaalsContact CB-O 3.27Å; S235-Y237 WeakPolarHBondContact CB-O 3.32Å; S235-Y237 PolarHBondContact O-N 3.48Å; S235-Y237 PolarHBondContact OG-N 3.41Å; S235-Y237 PolarHBondContact OG-O 3Å; Y237-E241 HydrophobicContact CD1-CG 4.04Å; Y237-E241 WeakPolarHBondContact CD1-OE1 3.44Å; Y237-E241 WeakPolarHBondContact CD1-OE2 3.38Å; Y237-E241 WeakPolarHBondContact CE1-OE1 3.42Å; Y237-E241 HydrophobicContact CG-CG 4.14Å; Y237-K245 HydrophobicContact CD1-CD 4.41Å; Y237-K245 HydrophobicContact CD2-CD 3.75Å; Y237-K245 HydrophobicContact CE1-CD 4.23Å; Y237-K245 VanDerWaalsContact CE1-CE 3.4Å; Y237-K245 HydrophobicContact CE2-CD 3.55Å; Y237-K245 HydrophobicContact CG-CD 4.17Å; Y237-K245 VanDerWaalsContact CZ-CE 3.45Å; Y237-K245 VanDerWaalsContact CZ-NZ 3.28Å; Y237-K245 PolarHBondContact OH-NZ 3.07Å
238	D	97	Very high	97.1	Very high	75 Å²	75	55.3 Å²	55.3	40%	0.401	28%	0.275	S	S	.	.			trans	-68.6	175.6	167.9	73	32.8	0	0	0	111.7	Q240 E241 S242	D238-Q240 PolarHBondContact O-N 2.89Å; D238-Q240 PolarHBondContact OD1-N 3Å; D238-E241 PolarHBondContact OD1-N 3.32Å; D238-S242 VanDerWaalsContact O-CB 3.29Å; D238-S242 WeakPolarHBondContact O-CB 3.43Å; D238-S242 PolarHBondContact O-N 3.37Å; D238-S242 PolarHBondContact O-OG 3.03Å
239	M	97.6	Very high	97	Very high	5 Å²	5	57.2 Å²	57.2	3%	0.025	30%	0.295	C	S	.	.	H	α-helix	trans	-64.5	-39.7	-177.3	-174.5	55.5	59.3	0	0	112.4	L197 M216 F228 Y231 S242 I243 V259	L197-M239 HydrophobicContact CB-CE 4.21Å; L197-M239 HydrophobicContact CD1-CE 3.64Å; L197-M239 HydrophobicContact CG-CE 4.49Å; M216-M239 HydrophobicContact CE-CG 4.12Å; M216-M239 HydrophobicContact CE-SD 3.6Å; M216-M239 VanDerWaalsContact CE-SD 3.6Å; F228-M239 HydrophobicContact CD1-CB 4.19Å; F228-M239 HydrophobicContact CD1-CE 3.94Å; F228-M239 HydrophobicContact CD1-CG 3.88Å; F228-M239 HydrophobicContact CE1-CE 4.25Å; F228-M239 HydrophobicContact CE1-CG 3.92Å; F228-M239 HydrophobicContact CG-CB 4.36Å; F228-M239 HydrophobicContact CG-CG 4.41Å; F228-M239 HydrophobicContact CZ-CG 4.49Å; Y231-M239 HydrophobicContact CD1-CE 3.73Å; Y231-M239 HydrophobicContact CD2-CE 3.47Å; Y231-M239 VanDerWaalsContact CD2-CE 3.47Å; Y231-M239 HydrophobicContact CE1-CE 3.9Å; Y231-M239 HydrophobicContact CE2-CE 3.65Å; Y231-M239 HydrophobicContact CG-CE 3.51Å; M239-S242 PolarHBondContact O-N 3.5Å; M239-I243 HydrophobicContact CG-CD1 4.1Å; M239-I243 WeakPolarHBondContact O-CD1 3.27Å; M239-I243 VanDerWaalsContact O-CG1 3.25Å; M239-I243 WeakPolarHBondContact O-CG1 3.39Å; M239-I243 PolarHBondContact O-N 3.18Å; M239-I243 HydrophobicContact SD-CD1 4.49Å; M239-V259 HydrophobicContact CB-CG1 4.39Å; M239-V259 HydrophobicContact CG-CG1 4.24Å; M239-V259 HydrophobicContact CG-CG2 3.78Å
240	Q	97.9	Very high	97.1	Very high	49 Å²	49	54.4 Å²	54.4	23%	0.229	28%	0.28	C	S	.	.	H	α-helix	trans	-68.4	-44.3	-179.2	-62.6	-171.4	35.6	0	0	111.1	D238 S242 I243 V244 L256 V259 E263	D238-Q240 PolarHBondContact O-N 2.89Å; D238-Q240 PolarHBondContact OD1-N 3Å; Q240-S242 VanDerWaalsContact C-N 3.35Å; Q240-I243 WeakPolarHBondContact O-CB 3.22Å; Q240-I243 PolarHBondContact O-N 2.95Å; Q240-V244 WeakPolarHBondContact O-CG2 3.38Å; Q240-V244 PolarHBondContact O-N 3.39Å; Q240-V244 VanDerWaalsContact O-N 3.08Å; Q240-L256 HydrophobicContact CB-CD2 3.89Å; Q240-L256 HydrophobicContact CG-CD2 4.32Å; Q240-V259 HydrophobicContact CG-CB 4.39Å; Q240-V259 HydrophobicContact CG-CG1 3.67Å; Q240-E263 PolarHBondContact NE2-OE2 2.95Å
241	E	97.5	Very high	97	Very high	81 Å²	81	51.5 Å²	51.5	38%	0.379	27%	0.268	S	S	.	.	H	α-helix	trans	-64.6	-39.6	175.2	-178.6	176.9	-174.4	0	0	111.5	Y237 D238 I243 V244 K245	Y237-E241 HydrophobicContact CD1-CG 4.04Å; Y237-E241 WeakPolarHBondContact CD1-OE1 3.44Å; Y237-E241 WeakPolarHBondContact CD1-OE2 3.38Å; Y237-E241 WeakPolarHBondContact CE1-OE1 3.42Å; Y237-E241 HydrophobicContact CG-CG 4.14Å; D238-E241 PolarHBondContact OD1-N 3.32Å; E241-I243 PolarHBondContact O-N 3.06Å; E241-V244 PolarHBondContact O-N 3.36Å; E241-K245 HydrophobicContact CG-CD 4.32Å; E241-K245 WeakPolarHBondContact O-CG 3.4Å; E241-K245 PolarHBondContact O-N 3.17Å; E241-K245 VanDerWaalsContact O-N 3.09Å; E241-K245 WeakPolarHBondContact OE1-CE 3.43Å; E241-K245 IonicContact OE1-NZ 3.06Å; E241-K245 PolarHBondContact OE1-NZ 3.32Å
242	S	97.5	Very high	97.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.8	-47	173.6	-59.5	0	0	0	0	110.9	Y231 D238 M239 Q240 V244 K245 E246	Y231-S242 WeakPolarHBondContact CE1-OG 3.29Å; Y231-S242 VanDerWaalsContact OH-CB 3.3Å; Y231-S242 WeakPolarHBondContact OH-CB 3.39Å; Y231-S242 PolarHBondContact OH-OG 3.36Å; D238-S242 VanDerWaalsContact O-CB 3.29Å; D238-S242 WeakPolarHBondContact O-CB 3.43Å; D238-S242 PolarHBondContact O-N 3.37Å; D238-S242 PolarHBondContact O-OG 3.03Å; M239-S242 PolarHBondContact O-N 3.5Å; Q240-S242 VanDerWaalsContact C-N 3.35Å; S242-V244 VanDerWaalsContact C-N 3.31Å; S242-V244 PolarHBondContact O-N 3.01Å; S242-K245 PolarHBondContact O-N 2.92Å; S242-K245 VanDerWaalsContact O-N 3.12Å; S242-E246 VanDerWaalsContact O-CB 3.31Å; S242-E246 WeakPolarHBondContact O-CB 3.24Å; S242-E246 VanDerWaalsContact O-CG 3.24Å; S242-E246 WeakPolarHBondContact O-CG 3.42Å; S242-E246 PolarHBondContact O-N 3.33Å
243	I	97.8	Very high	97.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-56.2	-45.6	176	-70.4	156.8	0	0	0	111.4	W212 M216 M239 Q240 E241 K245 E246 V247 Q252 F255 L256 V259	W212-I243 HydrophobicContact CE3-CG1 4.34Å; W212-I243 HydrophobicContact CH2-CG1 4.13Å; W212-I243 HydrophobicContact CZ3-CB 4.2Å; W212-I243 HydrophobicContact CZ3-CG1 3.48Å; W212-I243 VanDerWaalsContact CZ3-CG1 3.48Å; M216-I243 HydrophobicContact CE-CD1 4.35Å; M239-I243 HydrophobicContact CG-CD1 4.1Å; M239-I243 WeakPolarHBondContact O-CD1 3.27Å; M239-I243 VanDerWaalsContact O-CG1 3.25Å; M239-I243 WeakPolarHBondContact O-CG1 3.39Å; M239-I243 PolarHBondContact O-N 3.18Å; M239-I243 HydrophobicContact SD-CD1 4.49Å; Q240-I243 WeakPolarHBondContact O-CB 3.22Å; Q240-I243 PolarHBondContact O-N 2.95Å; E241-I243 PolarHBondContact O-N 3.06Å; I243-K245 VanDerWaalsContact C-N 3.26Å; I243-K245 PolarHBondContact O-N 3.46Å; I243-E246 PolarHBondContact O-N 2.88Å; I243-V247 HydrophobicContact CG2-CG2 3.82Å; I243-V247 VanDerWaalsContact O-CG2 3.24Å; I243-V247 WeakPolarHBondContact O-CG2 3.28Å; I243-V247 PolarHBondContact O-N 2.87Å; I243-V247 VanDerWaalsContact O-N 3.11Å; I243-Q252 HydrophobicContact CG2-CG 3.95Å; I243-F255 HydrophobicContact CD1-CB 3.81Å; I243-F255 HydrophobicContact CG1-CB 3.96Å; I243-F255 HydrophobicContact CG2-CB 3.72Å; I243-L256 HydrophobicContact CB-CD2 4.14Å; I243-L256 HydrophobicContact CD1-CD2 4.38Å; I243-L256 HydrophobicContact CG2-CD2 4Å; I243-L256 HydrophobicContact CG2-CG 3.82Å; I243-V259 HydrophobicContact CD1-CB 4.28Å; I243-V259 HydrophobicContact CD1-CG2 3.53Å
244	V	97.4	Very high	97.2	Very high	59 Å²	59	49.5 Å²	49.5	36%	0.358	25%	0.251	S	S	.	.	H	α-helix	trans	-62	-34.2	-179.9	172.6	0	0	0	0	112	Q240 E241 S242 K248 L256	Q240-V244 WeakPolarHBondContact O-CG2 3.38Å; Q240-V244 PolarHBondContact O-N 3.39Å; Q240-V244 VanDerWaalsContact O-N 3.08Å; E241-V244 PolarHBondContact O-N 3.36Å; S242-V244 VanDerWaalsContact C-N 3.31Å; S242-V244 PolarHBondContact O-N 3.01Å; V244-K248 PolarHBondContact O-NZ 3.32Å; V244-L256 HydrophobicContact CG2-CD1 4.07Å; V244-L256 HydrophobicContact CG2-CD2 4.21Å
245	K	95.7	Very high	97.3	Very high	87 Å²	87	46.8 Å²	46.8	38%	0.378	24%	0.24	S	C	.	.	H	α-helix	trans	-79.3	-39.8	179.6	-69.6	174	-163.9	-101.6	0	112.4	Y237 E241 S242 I243	Y237-K245 HydrophobicContact CD1-CD 4.41Å; Y237-K245 HydrophobicContact CD2-CD 3.75Å; Y237-K245 HydrophobicContact CE1-CD 4.23Å; Y237-K245 VanDerWaalsContact CE1-CE 3.4Å; Y237-K245 HydrophobicContact CE2-CD 3.55Å; Y237-K245 HydrophobicContact CG-CD 4.17Å; Y237-K245 VanDerWaalsContact CZ-CE 3.45Å; Y237-K245 VanDerWaalsContact CZ-NZ 3.28Å; Y237-K245 PolarHBondContact OH-NZ 3.07Å; E241-K245 HydrophobicContact CG-CD 4.32Å; E241-K245 WeakPolarHBondContact O-CG 3.4Å; E241-K245 PolarHBondContact O-N 3.17Å; E241-K245 VanDerWaalsContact O-N 3.09Å; E241-K245 WeakPolarHBondContact OE1-CE 3.43Å; E241-K245 IonicContact OE1-NZ 3.06Å; E241-K245 PolarHBondContact OE1-NZ 3.32Å; S242-K245 PolarHBondContact O-N 2.92Å; S242-K245 VanDerWaalsContact O-N 3.12Å; I243-K245 VanDerWaalsContact C-N 3.26Å; I243-K245 PolarHBondContact O-N 3.46Å
246	E	95.6	Very high	97.4	Very high	45 Å²	45	47.8 Å²	47.8	21%	0.21	25%	0.245	C	C	.	.	H	α-helix	trans	-84.2	-40	-168.5	-70.9	-53.7	120.2	0	0	114	G201 V202 T207 W212 S242 I243	G201-E246 WeakPolarHBondContact CA-OE2 3.39Å; V202-E246 HydrophobicContact CG2-CG 4.32Å; T207-E246 HydrophobicContact CG2-CB 4.12Å; T207-E246 WeakPolarHBondContact OG1-CB 3.34Å; T207-E246 PolarHBondContact OG1-O 3.33Å; T207-E246 PolarHBondContact OG1-OE2 3.31Å; W212-E246 HydrophobicContact CH2-CB 3.88Å; W212-E246 HydrophobicContact CH2-CG 3.96Å; W212-E246 HydrophobicContact CZ2-CB 4.41Å; W212-E246 HydrophobicContact CZ2-CG 4.18Å; W212-E246 HydrophobicContact CZ3-CB 4.43Å; S242-E246 VanDerWaalsContact O-CB 3.31Å; S242-E246 WeakPolarHBondContact O-CB 3.24Å; S242-E246 VanDerWaalsContact O-CG 3.24Å; S242-E246 WeakPolarHBondContact O-CG 3.42Å; S242-E246 PolarHBondContact O-N 3.33Å; I243-E246 PolarHBondContact O-N 2.88Å
247	V	96.1	Very high	97.5	Very high	8 Å²	8	43.8 Å²	43.8	5%	0.048	22%	0.218	C	C	.	.			trans	-125.7	158.8	-176	-66.8	0	0	0	0	111.6	T207 V209 I243 L251 Q252 F255	T207-V247 HydrophobicContact CG2-CG1 4.41Å; V209-V247 HydrophobicContact CG2-CG1 4.07Å; I243-V247 HydrophobicContact CG2-CG2 3.82Å; I243-V247 VanDerWaalsContact O-CG2 3.24Å; I243-V247 WeakPolarHBondContact O-CG2 3.28Å; I243-V247 PolarHBondContact O-N 2.87Å; I243-V247 VanDerWaalsContact O-N 3.11Å; V247-L251 HydrophobicContact CB-CD2 4.06Å; V247-L251 HydrophobicContact CB-CG 4.33Å; V247-L251 HydrophobicContact CG1-CD2 3.77Å; V247-L251 HydrophobicContact CG1-CG 4.41Å; V247-Q252 HydrophobicContact CG2-CB 3.96Å; V247-Q252 HydrophobicContact CG2-CG 4.26Å; V247-Q252 WeakPolarHBondContact O-CB 3.48Å; V247-Q252 WeakPolarHBondContact O-CG 3.22Å; V247-Q252 PolarHBondContact O-OE1 2.89Å; V247-Q252 VanDerWaalsContact O-OE1 3.08Å; V247-F255 HydrophobicContact CG2-CD2 4.16Å
248	K	95.8	Very high	97.6	Very high	140 Å²	140	40.1 Å²	40.1	61%	0.609	20%	0.204	S	C	*	.			trans	-131	166.8	-177.6	-58.9	-63.1	173.2	-166.1	0	112.3	V244	V244-K248 PolarHBondContact O-NZ 3.32Å
249	G	97.6	Very high	97.6	Very high	42 Å²	42	36.6 Å²	36.6	43%	0.433	19%	0.185	S	C	.	.	H	α-helix	trans	65.4	-143	175.4	0	0	0	0	0	112.6	L251 Q252 K253	G249-L251 VanDerWaalsContact C-N 3.31Å; G249-L251 PolarHBondContact O-N 3.32Å; G249-Q252 WeakPolarHBondContact O-CB 3.34Å; G249-Q252 PolarHBondContact O-N 3.41Å; G249-K253 PolarHBondContact O-N 2.88Å; G249-K253 VanDerWaalsContact O-N 3.14Å
250	D	98	Very high	97.7	Very high	43 Å²	43	38.7 Å²	38.7	23%	0.23	20%	0.195	C	C	.	.	H	α-helix	trans	-71.3	-26.8	-172.8	-60.5	-38.6	0	0	0	113.4	I128 F166 K253 S254	I128-D250 HydrophobicContact CD1-CB 4.01Å; F166-D250 HydrophobicContact CD1-CB 4.13Å; F166-D250 HydrophobicContact CD2-CB 3.94Å; F166-D250 HydrophobicContact CE1-CB 4.17Å; F166-D250 HydrophobicContact CE2-CB 3.99Å; F166-D250 HydrophobicContact CG-CB 4.01Å; F166-D250 HydrophobicContact CZ-CB 4.09Å; D250-K253 PolarHBondContact O-N 3.05Å; D250-K253 IonicContact OD1-NZ 3.62Å; D250-K253 PolarHBondContact OD1-NZ 3.4Å; D250-S254 WeakPolarHBondContact O-CB 3.36Å; D250-S254 PolarHBondContact O-N 3.04Å; D250-S254 PolarHBondContact O-OG 3.19Å
251	L	98.1	Very high	97.7	Very high	17 Å²	17	36.6 Å²	36.6	9%	0.089	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-43.9	170.4	-177.3	65.7	0	0	0	111.5	N165 L169 V209 V247 G249 S254 F255	N165-L251 HydrophobicContact CB-CD1 4.41Å; N165-L251 HydrophobicContact CB-CD2 3.82Å; L169-L251 HydrophobicContact CB-CD1 4.2Å; L169-L251 HydrophobicContact CD2-CD1 3.95Å; V209-L251 HydrophobicContact CG1-CD1 4.36Å; V209-L251 HydrophobicContact CG1-CD2 3.74Å; V209-L251 HydrophobicContact CG2-CD2 4.14Å; V247-L251 HydrophobicContact CB-CD2 4.06Å; V247-L251 HydrophobicContact CB-CG 4.33Å; V247-L251 HydrophobicContact CG1-CD2 3.77Å; V247-L251 HydrophobicContact CG1-CG 4.41Å; G249-L251 VanDerWaalsContact C-N 3.31Å; G249-L251 PolarHBondContact O-N 3.32Å; L251-S254 PolarHBondContact O-N 3.45Å; L251-F255 HydrophobicContact CD1-CD2 3.88Å; L251-F255 HydrophobicContact CD1-CE2 3.49Å; L251-F255 VanDerWaalsContact CD1-CE2 3.49Å; L251-F255 HydrophobicContact CD1-CZ 4.27Å; L251-F255 HydrophobicContact CD2-CE2 4.28Å; L251-F255 HydrophobicContact CG-CD2 3.91Å; L251-F255 HydrophobicContact CG-CE2 3.78Å; L251-F255 WeakPolarHBondContact O-CD2 3.46Å; L251-F255 PolarHBondContact O-N 3.35Å
252	Q	98.3	Very high	97.6	Very high	36 Å²	36	33.3 Å²	33.3	17%	0.168	17%	0.17	C	C	.	.	H	α-helix	trans	-61.1	-48.9	175.8	-171.8	-163.4	-39.5	0	0	111	I243 V247 G249 S254 F255 L256	I243-Q252 HydrophobicContact CG2-CG 3.95Å; V247-Q252 HydrophobicContact CG2-CB 3.96Å; V247-Q252 HydrophobicContact CG2-CG 4.26Å; V247-Q252 WeakPolarHBondContact O-CB 3.48Å; V247-Q252 WeakPolarHBondContact O-CG 3.22Å; V247-Q252 PolarHBondContact O-OE1 2.89Å; V247-Q252 VanDerWaalsContact O-OE1 3.08Å; G249-Q252 WeakPolarHBondContact O-CB 3.34Å; G249-Q252 PolarHBondContact O-N 3.41Å; Q252-S254 VanDerWaalsContact C-N 3.28Å; Q252-S254 PolarHBondContact O-N 3.44Å; Q252-F255 PolarHBondContact O-N 2.97Å; Q252-L256 HydrophobicContact CG-CD1 4.22Å; Q252-L256 WeakPolarHBondContact O-CG 3.43Å; Q252-L256 PolarHBondContact O-N 2.64Å
253	K	98.6	Very high	97.5	Very high	111 Å²	111	37.2 Å²	37.2	48%	0.483	19%	0.188	S	C	.	.	H	α-helix	trans	-57.7	-42.3	177.3	-65.7	175.1	-164.8	158.5	0	111.6	I128 G249 D250 L256 V257	I128-K253 HydrophobicContact CD1-CB 3.95Å; I128-K253 HydrophobicContact CD1-CD 4.41Å; G249-K253 PolarHBondContact O-N 2.88Å; G249-K253 VanDerWaalsContact O-N 3.14Å; D250-K253 PolarHBondContact O-N 3.05Å; D250-K253 IonicContact OD1-NZ 3.62Å; D250-K253 PolarHBondContact OD1-NZ 3.4Å; K253-L256 PolarHBondContact O-N 2.96Å; K253-V257 WeakPolarHBondContact O-CG2 3.43Å; K253-V257 PolarHBondContact O-N 2.86Å
254	S	98.5	Very high	97.5	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.5	-50.2	179.9	-57.1	0	0	0	0	112.3	I128 F166 L169 D250 L251 Q252 L256 V257 L258	I128-S254 WeakPolarHBondContact CG1-OG 3.46Å; F166-S254 WeakPolarHBondContact CE2-OG 3.44Å; L169-S254 VanDerWaalsContact CD2-CB 3.46Å; D250-S254 WeakPolarHBondContact O-CB 3.36Å; D250-S254 PolarHBondContact O-N 3.04Å; D250-S254 PolarHBondContact O-OG 3.19Å; L251-S254 PolarHBondContact O-N 3.45Å; Q252-S254 VanDerWaalsContact C-N 3.28Å; Q252-S254 PolarHBondContact O-N 3.44Å; S254-L256 VanDerWaalsContact C-N 3.34Å; S254-L256 PolarHBondContact O-N 3.26Å; S254-V257 PolarHBondContact O-N 3Å; S254-L258 WeakPolarHBondContact O-CG 3.16Å; S254-L258 PolarHBondContact O-N 3.38Å
255	F	98.6	Very high	97.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.4	-38	177.8	-79.3	-55.3	0	0	0	112.7	L169 V209 W212 I213 M216 I243 V247 L251 Q252 L258 V259	L169-F255 HydrophobicContact CD1-CE1 4Å; L169-F255 HydrophobicContact CD1-CZ 4.44Å; L169-F255 HydrophobicContact CD2-CD1 3.96Å; L169-F255 HydrophobicContact CD2-CD2 4.34Å; L169-F255 HydrophobicContact CD2-CE1 3.94Å; L169-F255 HydrophobicContact CD2-CE2 4.33Å; L169-F255 HydrophobicContact CD2-CG 4.19Å; L169-F255 HydrophobicContact CD2-CZ 4.14Å; V209-F255 HydrophobicContact CG1-CE2 4.31Å; W212-F255 HydrophobicContact CB-CE1 4.21Å; W212-F255 HydrophobicContact CB-CE2 4.43Å; W212-F255 HydrophobicContact CB-CZ 3.75Å; W212-F255 HydrophobicContact CE3-CD2 4.34Å; W212-F255 HydrophobicContact CE3-CE2 4.22Å; W212-F255 HydrophobicContact CE3-CZ 4.42Å; I213-F255 HydrophobicContact CG1-CZ 3.81Å; M216-F255 HydrophobicContact CB-CE1 4.24Å; M216-F255 HydrophobicContact CE-CD1 4.34Å; M216-F255 HydrophobicContact CG-CD1 4.44Å; M216-F255 HydrophobicContact CG-CE1 4.28Å; M216-F255 HydrophobicContact SD-CD1 3.3Å; M216-F255 WeakPolarHBondContact SD-CD1 3.39Å; M216-F255 HydrophobicContact SD-CE1 3.68Å; M216-F255 HydrophobicContact SD-CG 4.3Å; I243-F255 HydrophobicContact CD1-CB 3.81Å; I243-F255 HydrophobicContact CG1-CB 3.96Å; I243-F255 HydrophobicContact CG2-CB 3.72Å; V247-F255 HydrophobicContact CG2-CD2 4.16Å; L251-F255 HydrophobicContact CD1-CD2 3.88Å; L251-F255 HydrophobicContact CD1-CE2 3.49Å; L251-F255 VanDerWaalsContact CD1-CE2 3.49Å; L251-F255 HydrophobicContact CD1-CZ 4.27Å; L251-F255 HydrophobicContact CD2-CE2 4.28Å; L251-F255 HydrophobicContact CG-CD2 3.91Å; L251-F255 HydrophobicContact CG-CE2 3.78Å; L251-F255 WeakPolarHBondContact O-CD2 3.46Å; L251-F255 PolarHBondContact O-N 3.35Å; Q252-F255 PolarHBondContact O-N 2.97Å; F255-L258 HydrophobicContact CD1-CD1 4.15Å; F255-L258 PolarHBondContact O-N 2.88Å; F255-V259 WeakPolarHBondContact O-CG2 3.39Å; F255-V259 PolarHBondContact O-N 2.74Å
256	L	98.7	Very high	97.6	Very high	30 Å²	30	34.8 Å²	34.8	16%	0.157	18%	0.175	C	C	.	.	H	α-helix	trans	-61.3	-45.2	174.6	-73.6	174.6	0	0	0	111.6	Q240 I243 V244 Q252 K253 S254 L258 V259 Q260	Q240-L256 HydrophobicContact CB-CD2 3.89Å; Q240-L256 HydrophobicContact CG-CD2 4.32Å; I243-L256 HydrophobicContact CB-CD2 4.14Å; I243-L256 HydrophobicContact CD1-CD2 4.38Å; I243-L256 HydrophobicContact CG2-CD2 4Å; I243-L256 HydrophobicContact CG2-CG 3.82Å; V244-L256 HydrophobicContact CG2-CD1 4.07Å; V244-L256 HydrophobicContact CG2-CD2 4.21Å; Q252-L256 HydrophobicContact CG-CD1 4.22Å; Q252-L256 WeakPolarHBondContact O-CG 3.43Å; Q252-L256 PolarHBondContact O-N 2.64Å; K253-L256 PolarHBondContact O-N 2.96Å; S254-L256 VanDerWaalsContact C-N 3.34Å; S254-L256 PolarHBondContact O-N 3.26Å; L256-L258 VanDerWaalsContact C-N 3.35Å; L256-L258 PolarHBondContact O-N 2.83Å; L256-V259 PolarHBondContact O-N 2.74Å; L256-Q260 VanDerWaalsContact O-CB 3.3Å; L256-Q260 WeakPolarHBondContact O-CB 3.21Å; L256-Q260 WeakPolarHBondContact O-CG 3.05Å; L256-Q260 PolarHBondContact O-N 3.39Å
257	V	98.8	Very high	97.7	Very high	13 Å²	13	34.5 Å²	34.5	8%	0.079	18%	0.175	C	C	.	.	H	α-helix	trans	-63.1	-42.4	178.1	174.5	0	0	0	0	110.9	I128 C132 K253 S254 C261 Y268	I128-V257 HydrophobicContact CG2-CB 4.18Å; I128-V257 HydrophobicContact CG2-CG2 3.78Å; C132-V257 HydrophobicContact CB-CB 3.92Å; C132-V257 HydrophobicContact CB-CG1 3.53Å; K253-V257 WeakPolarHBondContact O-CG2 3.43Å; K253-V257 PolarHBondContact O-N 2.86Å; S254-V257 PolarHBondContact O-N 3Å; V257-C261 VanDerWaalsContact O-CB 3.26Å; V257-C261 WeakPolarHBondContact O-CB 3.44Å; V257-C261 PolarHBondContact O-N 3.23Å; V257-C261 PolarHBondContact O-SG 3.39Å; V257-Y268 HydrophobicContact CB-CE2 4.26Å; V257-Y268 HydrophobicContact CG1-CE1 4.2Å; V257-Y268 HydrophobicContact CG1-CE2 3.93Å; V257-Y268 HydrophobicContact CG2-CE2 3.83Å
258	L	98.2	Very high	97.8	Very high	2 Å²	2	35 Å²	35	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-57.9	-54.2	175.3	-75.9	170.5	0	0	0	111.3	C132 L169 L173 S254 F255 L256 Q260 C261 F262	C132-L258 HydrophobicContact CB-CD2 3.91Å; C132-L258 HydrophobicContact CB-CG 3.87Å; C132-L258 WeakPolarHBondContact O-CD2 3.13Å; L169-L258 HydrophobicContact CD1-CD1 3.9Å; L169-L258 HydrophobicContact CD2-CD1 4.14Å; L169-L258 HydrophobicContact CG-CD1 4.43Å; L173-L258 HydrophobicContact CD1-CD1 4.33Å; L173-L258 HydrophobicContact CD1-CD2 4.06Å; L173-L258 HydrophobicContact CD2-CD2 3.89Å; S254-L258 WeakPolarHBondContact O-CG 3.16Å; S254-L258 PolarHBondContact O-N 3.38Å; F255-L258 HydrophobicContact CD1-CD1 4.15Å; F255-L258 PolarHBondContact O-N 2.88Å; L256-L258 VanDerWaalsContact C-N 3.35Å; L256-L258 PolarHBondContact O-N 2.83Å; L258-Q260 PolarHBondContact O-N 2.96Å; L258-C261 PolarHBondContact O-N 2.81Å; L258-F262 HydrophobicContact CB-CD2 4.44Å; L258-F262 HydrophobicContact CB-CE2 3.82Å; L258-F262 HydrophobicContact CB-CZ 4.01Å; L258-F262 HydrophobicContact CD2-CE1 4.2Å; L258-F262 HydrophobicContact CD2-CE2 4.31Å; L258-F262 HydrophobicContact CD2-CZ 3.65Å; L258-F262 HydrophobicContact CG-CZ 4.36Å; L258-F262 WeakPolarHBondContact O-CB 3.26Å; L258-F262 WeakPolarHBondContact O-CD1 3.32Å; L258-F262 WeakPolarHBondContact O-CD2 3.42Å; L258-F262 WeakPolarHBondContact O-CG 3.49Å; L258-F262 PolarHBondContact O-N 3.22Å
259	V	98.3	Very high	98	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.3	-45.9	-178.3	172.9	0	0	0	0	111.1	M216 F228 M239 Q240 I243 F255 L256 C261 F262 E263	M216-V259 HydrophobicContact CE-CG2 4.13Å; M216-V259 HydrophobicContact SD-CG2 4.15Å; F228-V259 HydrophobicContact CD2-CG1 4.19Å; F228-V259 HydrophobicContact CE1-CG2 4.46Å; F228-V259 HydrophobicContact CE2-CB 4.31Å; F228-V259 HydrophobicContact CE2-CG1 3.96Å; F228-V259 HydrophobicContact CE2-CG2 4.03Å; F228-V259 HydrophobicContact CZ-CG2 3.8Å; M239-V259 HydrophobicContact CB-CG1 4.39Å; M239-V259 HydrophobicContact CG-CG1 4.24Å; M239-V259 HydrophobicContact CG-CG2 3.78Å; Q240-V259 HydrophobicContact CG-CB 4.39Å; Q240-V259 HydrophobicContact CG-CG1 3.67Å; I243-V259 HydrophobicContact CD1-CB 4.28Å; I243-V259 HydrophobicContact CD1-CG2 3.53Å; F255-V259 WeakPolarHBondContact O-CG2 3.39Å; F255-V259 PolarHBondContact O-N 2.74Å; L256-V259 PolarHBondContact O-N 2.74Å; V259-C261 VanDerWaalsContact C-N 3.32Å; V259-C261 PolarHBondContact O-N 3.18Å; V259-F262 PolarHBondContact O-N 2.88Å; V259-E263 HydrophobicContact CG1-CG 4.46Å; V259-E263 WeakPolarHBondContact O-CG 3.43Å; V259-E263 PolarHBondContact O-N 3.32Å
260	Q	98.4	Very high	98	Very high	49 Å²	49	26.3 Å²	26.3	23%	0.229	13%	0.126	C	C	.	.	H	α-helix	trans	-60.9	-40.9	177.4	-71.7	171.9	-10.4	0	0	112	L256 L258 E263 N264 Y268	L256-Q260 VanDerWaalsContact O-CB 3.3Å; L256-Q260 WeakPolarHBondContact O-CB 3.21Å; L256-Q260 WeakPolarHBondContact O-CG 3.05Å; L256-Q260 PolarHBondContact O-N 3.39Å; L258-Q260 PolarHBondContact O-N 2.96Å; Q260-E263 PolarHBondContact O-N 2.87Å; Q260-N264 CarbonylContact O-C 3.52Å; Q260-N264 VanDerWaalsContact O-C 3.22Å; Q260-N264 PolarHBondContact O-N 3.28Å; Q260-Y268 HydrophobicContact CB-CD2 4.06Å; Q260-Y268 VanDerWaalsContact OE1-CD2 3.32Å
261	C	98.1	Very high	98	Very high	6 Å²	6	28.2 Å²	28.2	4%	0.041	13%	0.133	C	C	.	.	H	α-helix	trans	-71.7	-34.9	177.3	-70.4	0	0	0	0	112.8	S133 V257 L258 V259 K265 Y268	S133-C261 WeakPolarHBondContact CB-SG 3.43Å; V257-C261 VanDerWaalsContact O-CB 3.26Å; V257-C261 WeakPolarHBondContact O-CB 3.44Å; V257-C261 PolarHBondContact O-N 3.23Å; V257-C261 PolarHBondContact O-SG 3.39Å; L258-C261 PolarHBondContact O-N 2.81Å; V259-C261 VanDerWaalsContact C-N 3.32Å; V259-C261 PolarHBondContact O-N 3.18Å; C261-K265 HydrophobicContact CB-CB 4.41Å; C261-K265 HydrophobicContact CB-CG 4.4Å; C261-K265 PolarHBondContact O-N 3.46Å; C261-Y268 VanDerWaalsContact SG-CD1 3.53Å
262	F	96.6	Very high	98.1	Very high	11 Å²	11	28.3 Å²	28.3	5%	0.048	13%	0.132	C	C	.	.	H	α-helix	trans	-65.6	-42.5	173.3	-61.7	-24.8	0	0	0	110.6	M216 V221 L224 R225 F228 L258 V259	M216-F262 WeakPolarHBondContact O-CZ 3.34Å; V221-F262 HydrophobicContact CB-CD1 4.43Å; V221-F262 HydrophobicContact CG1-CB 4.07Å; V221-F262 HydrophobicContact CG1-CD1 4.03Å; V221-F262 HydrophobicContact CG1-CG 4.34Å; V221-F262 HydrophobicContact CG2-CD1 3.72Å; V221-F262 HydrophobicContact CG2-CE1 3.96Å; L224-F262 HydrophobicContact CB-CD2 4.36Å; L224-F262 HydrophobicContact CD1-CD2 3.78Å; L224-F262 HydrophobicContact CD1-CE2 3.49Å; L224-F262 VanDerWaalsContact CD1-CE2 3.49Å; L224-F262 HydrophobicContact CD1-CG 4.45Å; L224-F262 HydrophobicContact CD1-CZ 3.93Å; R225-F262 PolarHBondContact NE-O 3.45Å; R225-F262 PolarHBondContact NH2-O 2.9Å; F228-F262 HydrophobicContact CE2-CB 4.13Å; F228-F262 AromaticContact CE2-CD2 3.95Å; F228-F262 HydrophobicContact CE2-CD2 3.95Å; F228-F262 AromaticContact CZ-CD2 3.96Å; F228-F262 HydrophobicContact CZ-CD2 3.96Å; L258-F262 HydrophobicContact CB-CD2 4.44Å; L258-F262 HydrophobicContact CB-CE2 3.82Å; L258-F262 HydrophobicContact CB-CZ 4.01Å; L258-F262 HydrophobicContact CD2-CE1 4.2Å; L258-F262 HydrophobicContact CD2-CE2 4.31Å; L258-F262 HydrophobicContact CD2-CZ 3.65Å; L258-F262 HydrophobicContact CG-CZ 4.36Å; L258-F262 WeakPolarHBondContact O-CB 3.26Å; L258-F262 WeakPolarHBondContact O-CD1 3.32Å; L258-F262 WeakPolarHBondContact O-CD2 3.42Å; L258-F262 WeakPolarHBondContact O-CG 3.49Å; L258-F262 PolarHBondContact O-N 3.22Å; V259-F262 PolarHBondContact O-N 2.88Å
263	E	95.4	Very high	98.1	Very high	82 Å²	82	26.6 Å²	26.6	38%	0.383	12%	0.124	S	C	.	.	H	α-helix	trans	-68.8	-57.8	177.7	-71.1	174.3	157.8	0	0	111.8	F228 Q240 V259 Q260	F228-E263 HydrophobicContact CD2-CG 4.47Å; Q240-E263 PolarHBondContact NE2-OE2 2.95Å; V259-E263 HydrophobicContact CG1-CG 4.46Å; V259-E263 WeakPolarHBondContact O-CG 3.43Å; V259-E263 PolarHBondContact O-N 3.32Å; Q260-E263 PolarHBondContact O-N 2.87Å
264	N	96.4	Very high	98	Very high	39 Å²	39	21.9 Å²	21.9	21%	0.209	11%	0.105	C	C	.	.	H	α-helix	trans	-156.8	96.1	177	-173.9	-24.5	0	0	0	110.7	Q260 Q266 L267 Y268 E305	Q260-N264 CarbonylContact O-C 3.52Å; Q260-N264 VanDerWaalsContact O-C 3.22Å; Q260-N264 PolarHBondContact O-N 3.28Å; N264-Q266 VanDerWaalsContact C-N 3.3Å; N264-Q266 PolarHBondContact O-N 3.46Å; N264-Q266 PolarHBondContact OD1-N 3.35Å; N264-Q266 VanDerWaalsContact OD1-N 3.11Å; N264-L267 HydrophobicContact CB-CB 3.84Å; N264-L267 VanDerWaalsContact CG-CB 3.41Å; N264-L267 PolarHBondContact O-N 2.75Å; N264-L267 PolarHBondContact OD1-N 3.18Å; N264-Y268 PolarHBondContact O-N 2.93Å; N264-E305 PolarHBondContact ND2-OE1 3.48Å
265	K	97.3	Very high	97.9	Very high	22 Å²	22	27.9 Å²	27.9	10%	0.096	13%	0.133	C	C	.	.	H	α-helix	trans	-57.3	-39.4	177.6	-171.7	-175.1	-58.6	-171.1	0	112.9	S133 E138 C261 Y268 F269	S133-K265 WeakPolarHBondContact O-CE 3.49Å; S133-K265 PolarHBondContact O-NZ 2.96Å; E138-K265 IonicContact OE2-NZ 3.26Å; C261-K265 HydrophobicContact CB-CB 4.41Å; C261-K265 HydrophobicContact CB-CG 4.4Å; C261-K265 PolarHBondContact O-N 3.46Å; K265-Y268 WeakPolarHBondContact O-CB 3.4Å; K265-Y268 PolarHBondContact O-N 2.9Å; K265-F269 HydrophobicContact CD-CE2 4.09Å; K265-F269 HydrophobicContact CG-CD2 4.03Å; K265-F269 HydrophobicContact CG-CE2 3.7Å; K265-F269 VanDerWaalsContact O-CD2 3.29Å; K265-F269 WeakPolarHBondContact O-CD2 3.43Å; K265-F269 PolarHBondContact O-N 2.91Å; K265-F269 VanDerWaalsContact O-N 3.13Å
266	Q	98.1	Very high	97.8	Very high	35 Å²	35	28 Å²	28	16%	0.164	13%	0.134	C	C	.	.	H	α-helix	trans	-71.3	-37.7	-177.5	-65.9	79.7	22.7	0	0	111.5	N264 F269 A270 D298 K301 I302 E305	N264-Q266 VanDerWaalsContact C-N 3.3Å; N264-Q266 PolarHBondContact O-N 3.46Å; N264-Q266 PolarHBondContact OD1-N 3.35Å; N264-Q266 VanDerWaalsContact OD1-N 3.11Å; Q266-F269 PolarHBondContact O-N 2.98Å; Q266-A270 WeakPolarHBondContact O-CB 3.36Å; Q266-A270 PolarHBondContact O-N 2.67Å; Q266-D298 HydrophobicContact CG-CB 4.25Å; Q266-D298 PolarHBondContact NE2-OD2 2.95Å; Q266-K301 HydrophobicContact CB-CB 4.23Å; Q266-K301 HydrophobicContact CG-CB 3.74Å; Q266-I302 HydrophobicContact CB-CG1 3.9Å; Q266-I302 HydrophobicContact CG-CG1 3.97Å; Q266-E305 HydrophobicContact CB-CG 3.89Å
267	L	98.5	Very high	97.7	Very high	39 Å²	39	26.6 Å²	26.6	20%	0.204	13%	0.126	C	C	.	.	H	α-helix	trans	-65.2	-38.2	171.4	-179.1	60.6	0	0	0	112.2	N264 A270 K271 T309	N264-L267 HydrophobicContact CB-CB 3.84Å; N264-L267 VanDerWaalsContact CG-CB 3.41Å; N264-L267 PolarHBondContact O-N 2.75Å; N264-L267 PolarHBondContact OD1-N 3.18Å; L267-A270 PolarHBondContact O-N 3.34Å; L267-K271 HydrophobicContact CD1-CD 4.46Å; L267-K271 HydrophobicContact CD1-CG 4.29Å; L267-K271 HydrophobicContact CG-CD 4.31Å; L267-K271 WeakPolarHBondContact O-CG 3.47Å; L267-K271 PolarHBondContact O-N 3.16Å; L267-T309 HydrophobicContact CD1-CG2 4.21Å; L267-T309 WeakPolarHBondContact CD1-OG1 3.13Å
268	Y	98.6	Very high	97.2	Very high	17 Å²	17	32.7 Å²	32.7	7%	0.067	15%	0.151	C	C	.	.	H	α-helix	trans	-55.6	-52.9	172.8	165.7	-100.3	0	0	0	111.3	E129 V257 Q260 C261 N264 K265 A270 K271 K272	E129-Y268 HydrophobicContact CG-CE1 4.35Å; V257-Y268 HydrophobicContact CB-CE2 4.26Å; V257-Y268 HydrophobicContact CG1-CE1 4.2Å; V257-Y268 HydrophobicContact CG1-CE2 3.93Å; V257-Y268 HydrophobicContact CG2-CE2 3.83Å; Q260-Y268 HydrophobicContact CB-CD2 4.06Å; Q260-Y268 VanDerWaalsContact OE1-CD2 3.32Å; C261-Y268 VanDerWaalsContact SG-CD1 3.53Å; N264-Y268 PolarHBondContact O-N 2.93Å; K265-Y268 WeakPolarHBondContact O-CB 3.4Å; K265-Y268 PolarHBondContact O-N 2.9Å; Y268-A270 VanDerWaalsContact C-N 3.34Å; Y268-A270 PolarHBondContact O-N 3.5Å; Y268-K271 PolarHBondContact O-N 3.4Å; Y268-K272 HydrophobicContact CE1-CD 4.41Å; Y268-K272 WeakPolarHBondContact O-CB 3.2Å; Y268-K272 PolarHBondContact O-N 3.06Å
269	F	98.7	Very high	96.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.6	-36.3	178.9	-73.9	-59.5	0	0	0	112.5	E129 K265 Q266 K272 L273 I290 R294 I302	E129-F269 HydrophobicContact CG-CE1 4.2Å; K265-F269 HydrophobicContact CD-CE2 4.09Å; K265-F269 HydrophobicContact CG-CD2 4.03Å; K265-F269 HydrophobicContact CG-CE2 3.7Å; K265-F269 VanDerWaalsContact O-CD2 3.29Å; K265-F269 WeakPolarHBondContact O-CD2 3.43Å; K265-F269 PolarHBondContact O-N 2.91Å; K265-F269 VanDerWaalsContact O-N 3.13Å; Q266-F269 PolarHBondContact O-N 2.98Å; F269-K272 PolarHBondContact O-N 2.48Å; F269-L273 WeakPolarHBondContact O-CB 3.09Å; F269-L273 WeakPolarHBondContact O-CG 3.47Å; F269-L273 PolarHBondContact O-N 3.05Å; F269-I290 HydrophobicContact CB-CG2 4.08Å; F269-I290 HydrophobicContact CD1-CD1 4.14Å; F269-I290 HydrophobicContact CD1-CG1 3.96Å; F269-I290 HydrophobicContact CD1-CG2 3.87Å; F269-I290 HydrophobicContact CE1-CG1 4.36Å; F269-I290 HydrophobicContact CG-CG2 4.19Å; F269-R294 HydrophobicContact CD2-CG 4.37Å; F269-R294 HydrophobicContact CE2-CG 4.38Å; F269-I302 HydrophobicContact CB-CD1 3.69Å; F269-I302 HydrophobicContact CB-CG1 4.11Å; F269-I302 HydrophobicContact CB-CG2 4.16Å; F269-I302 HydrophobicContact CD2-CD1 3.94Å; F269-I302 HydrophobicContact CG-CD1 4.09Å
270	A	98.6	Very high	95.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.7	-46.6	175	0	0	0	0	0	111.8	Q266 L267 Y268 L273 N274 I302 E305 Y306	Q266-A270 WeakPolarHBondContact O-CB 3.36Å; Q266-A270 PolarHBondContact O-N 2.67Å; L267-A270 PolarHBondContact O-N 3.34Å; Y268-A270 VanDerWaalsContact C-N 3.34Å; Y268-A270 PolarHBondContact O-N 3.5Å; A270-L273 PolarHBondContact O-N 2.93Å; A270-N274 PolarHBondContact O-N 3.49Å; A270-I302 HydrophobicContact CB-CG2 4.24Å; A270-E305 HydrophobicContact CB-CB 4.17Å; A270-Y306 HydrophobicContact CB-CD2 4.05Å; A270-Y306 HydrophobicContact CB-CG 4.43Å; A270-Y306 VanDerWaalsContact O-CD2 3.29Å; A270-Y306 WeakPolarHBondContact O-CD2 3.35Å; A270-Y306 WeakPolarHBondContact O-CE2 3.35Å
271	K	98.4	Very high	94.3	Very high	83 Å²	83	45.3 Å²	45.3	36%	0.361	23%	0.232	S	C	.	.	H	α-helix	trans	-61.2	-44.5	174.8	-72.5	175.5	177.6	178.2	0	111.8	L267 Y268 L273 N274 E275 F310	L267-K271 HydrophobicContact CD1-CD 4.46Å; L267-K271 HydrophobicContact CD1-CG 4.29Å; L267-K271 HydrophobicContact CG-CD 4.31Å; L267-K271 WeakPolarHBondContact O-CG 3.47Å; L267-K271 PolarHBondContact O-N 3.16Å; Y268-K271 PolarHBondContact O-N 3.4Å; K271-L273 PolarHBondContact O-N 3.01Å; K271-N274 WeakPolarHBondContact O-CB 3.19Å; K271-N274 PolarHBondContact O-N 2.91Å; K271-E275 WeakPolarHBondContact O-CG 2.76Å; K271-E275 PolarHBondContact O-N 3.46Å; K271-F310 HydrophobicContact CG-CZ 4.12Å
272	K	98.3	Very high	94	Very high	19 Å²	19	46 Å²	46	8%	0.083	24%	0.238	C	C	.	.	H	α-helix	trans	-64	-39.7	179.2	-165.6	165.7	-167.8	172.4	0	112.9	E125 E129 Y268 F269 A276 I286 I290	E125-K272 WeakPolarHBondContact OE1-CE 3.48Å; E125-K272 IonicContact OE1-NZ 2.99Å; E129-K272 HydrophobicContact CG-CD 4.33Å; E129-K272 WeakPolarHBondContact OE2-CD 3.45Å; E129-K272 WeakPolarHBondContact OE2-CE 3.49Å; E129-K272 IonicContact OE2-NZ 3.58Å; E129-K272 PolarHBondContact OE2-NZ 3.38Å; Y268-K272 HydrophobicContact CE1-CD 4.41Å; Y268-K272 WeakPolarHBondContact O-CB 3.2Å; Y268-K272 PolarHBondContact O-N 3.06Å; F269-K272 PolarHBondContact O-N 2.48Å; K272-A276 VanDerWaalsContact O-CB 3.28Å; K272-A276 WeakPolarHBondContact O-CB 3.47Å; K272-A276 PolarHBondContact O-N 3.34Å; K272-I286 HydrophobicContact CD-CG2 4.37Å; K272-I286 HydrophobicContact CG-CG2 4.04Å; K272-I290 HydrophobicContact CB-CD1 3.98Å; K272-I290 HydrophobicContact CD-CD1 4.07Å; K272-I290 HydrophobicContact CG-CD1 3.86Å
273	L	98.4	Very high	94	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-44.1	172.9	-77.8	167.3	0	0	0	111.6	F269 A270 K271 A276 M277 V287 I290 I291 I302 Y306 L314	F269-L273 WeakPolarHBondContact O-CB 3.09Å; F269-L273 WeakPolarHBondContact O-CG 3.47Å; F269-L273 PolarHBondContact O-N 3.05Å; A270-L273 PolarHBondContact O-N 2.93Å; K271-L273 PolarHBondContact O-N 3.01Å; L273-A276 PolarHBondContact O-N 2.83Å; L273-M277 HydrophobicContact CB-CE 4.19Å; L273-M277 VanDerWaalsContact O-CE 3.24Å; L273-M277 WeakPolarHBondContact O-CE 3.27Å; L273-M277 PolarHBondContact O-N 3.47Å; L273-V287 HydrophobicContact CD2-CB 4.44Å; L273-V287 HydrophobicContact CD2-CG1 4.23Å; L273-V287 HydrophobicContact CD2-CG2 4.46Å; L273-I290 HydrophobicContact CD1-CG2 3.87Å; L273-I290 HydrophobicContact CD2-CB 3.99Å; L273-I290 HydrophobicContact CD2-CD1 4.09Å; L273-I290 HydrophobicContact CD2-CG2 4Å; L273-I290 HydrophobicContact CG-CB 4.33Å; L273-I290 HydrophobicContact CG-CD1 4Å; L273-I290 HydrophobicContact CG-CG2 3.88Å; L273-I291 HydrophobicContact CD2-CG1 4.34Å; L273-I302 HydrophobicContact CD1-CG2 3.78Å; L273-Y306 HydrophobicContact CB-CD2 4.32Å; L273-Y306 HydrophobicContact CB-CE2 4.04Å; L273-L314 HydrophobicContact CB-CD1 4.23Å; L273-L314 HydrophobicContact CD1-CD1 4.02Å; L273-L314 HydrophobicContact CD1-CD2 3.79Å
274	N	97.3	Very high	94	Very high	13 Å²	13	50.3 Å²	50.3	7%	0.07	26%	0.256	C	S	.	.	H	α-helix	trans	-64.8	-45.6	179.7	-176.1	-105.3	0	0	0	111.4	A270 K271 A276 M277 K278 Y306 F310	A270-N274 PolarHBondContact O-N 3.49Å; K271-N274 WeakPolarHBondContact O-CB 3.19Å; K271-N274 PolarHBondContact O-N 2.91Å; N274-A276 VanDerWaalsContact C-N 3.3Å; N274-A276 PolarHBondContact O-N 3.27Å; N274-M277 PolarHBondContact O-N 3.11Å; N274-M277 VanDerWaalsContact O-N 3.13Å; N274-K278 WeakPolarHBondContact O-CB 3.37Å; N274-K278 VanDerWaalsContact O-CG 3.32Å; N274-K278 WeakPolarHBondContact O-CG 3.36Å; N274-K278 PolarHBondContact O-N 2.82Å; N274-K278 VanDerWaalsContact OD1-CD 3.24Å; N274-K278 WeakPolarHBondContact OD1-CD 3.45Å; N274-K278 WeakPolarHBondContact OD1-CE 3.37Å; N274-K278 PolarHBondContact OD1-NZ 2.88Å; N274-Y306 HydrophobicContact CB-CE2 3.61Å; N274-Y306 PolarHBondContact ND2-OH 2.88Å; N274-F310 HydrophobicContact CB-CD2 3.98Å; N274-F310 HydrophobicContact CB-CE1 4.07Å; N274-F310 HydrophobicContact CB-CE2 3.42Å; N274-F310 VanDerWaalsContact CB-CE2 3.42Å; N274-F310 HydrophobicContact CB-CZ 3.47Å; N274-F310 VanDerWaalsContact CB-CZ 3.47Å; N274-F310 WeakPolarHBondContact OD1-CE1 3.29Å
275	E	96.6	Very high	93.9	Very high	126 Å²	126	54 Å²	54	59%	0.589	27%	0.27	S	S	*	.	H	α-helix	trans	-60.7	-38	174.1	-72.3	172.6	-171	0	0	112.7	K271 M277	K271-E275 WeakPolarHBondContact O-CG 2.76Å; K271-E275 PolarHBondContact O-N 3.46Å; E275-M277 PolarHBondContact O-N 2.94Å
276	A	96.9	Very high	93.9	Very high	2 Å²	2	53.6 Å²	53.6	2%	0.017	27%	0.269	C	S	.	.	H	α-helix	trans	-66.7	-21.9	176.8	0	0	0	0	0	113.2	K272 L273 N274 K283 I286 V287	K272-A276 VanDerWaalsContact O-CB 3.28Å; K272-A276 WeakPolarHBondContact O-CB 3.47Å; K272-A276 PolarHBondContact O-N 3.34Å; L273-A276 PolarHBondContact O-N 2.83Å; N274-A276 VanDerWaalsContact C-N 3.3Å; N274-A276 PolarHBondContact O-N 3.27Å; A276-K283 HydrophobicContact CB-CB 4.15Å; A276-K283 PolarHBondContact O-N 3.12Å; A276-I286 HydrophobicContact CB-CB 4.04Å; A276-I286 HydrophobicContact CB-CG2 3.9Å; A276-V287 HydrophobicContact CB-CG2 3.88Å
277	M	95.9	Very high	93.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-108.8	-15	-178	-66	-176.6	-73.2	0	0	114.3	L273 N274 E275 G279 A282 V287 Y306 L314 T317 I318 H321	L273-M277 HydrophobicContact CB-CE 4.19Å; L273-M277 VanDerWaalsContact O-CE 3.24Å; L273-M277 WeakPolarHBondContact O-CE 3.27Å; L273-M277 PolarHBondContact O-N 3.47Å; N274-M277 PolarHBondContact O-N 3.11Å; N274-M277 VanDerWaalsContact O-N 3.13Å; E275-M277 PolarHBondContact O-N 2.94Å; M277-G279 PolarHBondContact O-N 3.05Å; M277-G279 VanDerWaalsContact O-N 3.11Å; M277-A282 HydrophobicContact CG-CB 4.09Å; M277-V287 HydrophobicContact CG-CG2 3.85Å; M277-V287 HydrophobicContact SD-CG2 4.31Å; M277-Y306 HydrophobicContact CE-CE2 4.4Å; M277-L314 HydrophobicContact CE-CD1 3.6Å; M277-T317 HydrophobicContact CB-CG2 3.89Å; M277-T317 HydrophobicContact CE-CG2 3.75Å; M277-T317 HydrophobicContact SD-CG2 3.94Å; M277-I318 HydrophobicContact CE-CG1 4.4Å; M277-I318 HydrophobicContact SD-CG1 3.95Å; M277-H321 HydrophobicContact CB-CB 4.17Å; M277-H321 HydrophobicContact CG-CB 4.45Å; M277-H321 PolarHBondContact O-CE1 3.37Å; M277-H321 PolarHBondContact O-ND1 3.3Å
278	K	87.4	Confident	93.9	Very high	141 Å²	141	50.2 Å²	50.2	61%	0.613	25%	0.252	S	S	*	.	S	Bend	trans	-62.4	-15.5	-179.5	-92	170.5	160.9	160	0	116.4	N274	N274-K278 WeakPolarHBondContact O-CB 3.37Å; N274-K278 VanDerWaalsContact O-CG 3.32Å; N274-K278 WeakPolarHBondContact O-CG 3.36Å; N274-K278 PolarHBondContact O-N 2.82Å; N274-K278 VanDerWaalsContact OD1-CD 3.24Å; N274-K278 WeakPolarHBondContact OD1-CD 3.45Å; N274-K278 WeakPolarHBondContact OD1-CE 3.37Å; N274-K278 PolarHBondContact OD1-NZ 2.88Å
279	G	78.9	Confident	93.9	Very high	45 Å²	45	49.4 Å²	49.4	46%	0.464	25%	0.249	S	C	.	.	S	Bend	trans	-92.9	-171.6	-172.3	0	0	0	0	0	115.4	M277 G281	M277-G279 PolarHBondContact O-N 3.05Å; M277-G279 VanDerWaalsContact O-N 3.11Å; G279-G281 VanDerWaalsContact C-N 3.35Å; G279-G281 PolarHBondContact O-N 3.32Å
280	K	78.1	Confident	93.9	Very high	224 Å²	224	49.4 Å²	49.4	97%	0.974	25%	0.249	S	C	*	.	S	Bend	trans	-70.4	91.6	168	-73.1	-172.9	-179.2	-179.5	0	109.3
281	G	78	Confident	93.9	Very high	48 Å²	48	49.4 Å²	49.4	50%	0.495	25%	0.249	S	C	.	.	S	Bend	trans	85.6	149.8	-174.9	0	0	0	0	0	112.5	G279	G279-G281 VanDerWaalsContact C-N 3.35Å; G279-G281 PolarHBondContact O-N 3.32Å
282	A	91.4	Very high	94	Very high	19 Å²	19	45.9 Å²	45.9	16%	0.157	24%	0.235	C	C	.	.			trans	-72	139.9	176.9	0	0	0	0	0	111.2	M277 E284 H321 T322	M277-A282 HydrophobicContact CG-CB 4.09Å; A282-E284 HydrophobicContact CB-CG 4.29Å; A282-E284 PolarHBondContact O-N 3.39Å; A282-H321 HydrophobicContact CB-CB 4.47Å; A282-T322 HydrophobicContact CB-CG2 3.92Å
283	K	95.8	Very high	94	Very high	122 Å²	122	45 Å²	45	53%	0.53	23%	0.231	S	C	.	.			trans	-74.3	75.5	165.6	-63.1	-178.4	-178.2	178.1	0	108.9	A276 K285 I286 V287	A276-K283 HydrophobicContact CB-CB 4.15Å; A276-K283 PolarHBondContact O-N 3.12Å; K283-K285 PolarHBondContact O-N 3.24Å; K283-I286 HydrophobicContact CB-CB 4.45Å; K283-I286 HydrophobicContact CB-CD1 4.06Å; K283-I286 HydrophobicContact CB-CG1 4.34Å; K283-I286 HydrophobicContact CD-CD1 3.72Å; K283-I286 PolarHBondContact O-N 2.65Å; K283-V287 PolarHBondContact O-N 2.68Å; K283-V287 VanDerWaalsContact O-N 3.16Å
284	E	95.4	Very high	94	Very high	62 Å²	62	45.1 Å²	45.1	29%	0.29	23%	0.231	S	C	.	.	H	α-helix	trans	-55.8	-29.7	-170.1	-63.8	-174.7	164.5	0	0	113.6	S93 A282 I286 V287 T288 Y326	S93-E284 WeakPolarHBondContact CB-OE2 3.2Å; S93-E284 PolarHBondContact OG-OE2 3.41Å; A282-E284 HydrophobicContact CB-CG 4.29Å; A282-E284 PolarHBondContact O-N 3.39Å; E284-I286 PolarHBondContact O-N 3.4Å; E284-V287 PolarHBondContact O-N 3.13Å; E284-T288 WeakPolarHBondContact O-CB 2.83Å; E284-T288 PolarHBondContact O-N 3.11Å; E284-T288 PolarHBondContact O-OG1 3.41Å; E284-Y326 HydrophobicContact CB-CE1 4.14Å; E284-Y326 HydrophobicContact CG-CD1 4.3Å; E284-Y326 HydrophobicContact CG-CE1 3.62Å; E284-Y326 PolarHBondContact O-OH 3.17Å; E284-Y326 WeakPolarHBondContact OE1-CD1 3.36Å
285	K	95.7	Very high	94	Very high	117 Å²	117	44.6 Å²	44.6	51%	0.509	23%	0.228	S	C	.	.	H	α-helix	trans	-58.5	-46.5	173.4	-171.8	-176.3	-178	-173.1	0	112	D123 K283 R289	D123-K285 IonicContact OD2-NZ 2.74Å; D123-K285 PolarHBondContact OD2-NZ 3.29Å; K283-K285 PolarHBondContact O-N 3.24Å; K285-R289 VanDerWaalsContact O-CB 3.32Å; K285-R289 WeakPolarHBondContact O-CB 3.35Å; K285-R289 PolarHBondContact O-N 3.39Å
286	I	97.4	Very high	94.1	Very high	13 Å²	13	40.6 Å²	40.6	7%	0.067	21%	0.21	C	C	.	.	H	α-helix	trans	-70.4	-47.8	-179.9	-59.9	175.4	0	0	0	109.8	E125 K272 A276 K283 E284 T288 R289 I290	E125-I286 VanDerWaalsContact OE1-CD1 3.26Å; E125-I286 WeakPolarHBondContact OE1-CD1 3.42Å; K272-I286 HydrophobicContact CD-CG2 4.37Å; K272-I286 HydrophobicContact CG-CG2 4.04Å; A276-I286 HydrophobicContact CB-CB 4.04Å; A276-I286 HydrophobicContact CB-CG2 3.9Å; K283-I286 HydrophobicContact CB-CB 4.45Å; K283-I286 HydrophobicContact CB-CD1 4.06Å; K283-I286 HydrophobicContact CB-CG1 4.34Å; K283-I286 HydrophobicContact CD-CD1 3.72Å; K283-I286 PolarHBondContact O-N 2.65Å; E284-I286 PolarHBondContact O-N 3.4Å; I286-T288 VanDerWaalsContact C-N 3.34Å; I286-T288 PolarHBondContact O-N 3.19Å; I286-R289 PolarHBondContact O-N 3.3Å; I286-I290 HydrophobicContact CG2-CD1 3.69Å; I286-I290 HydrophobicContact CG2-CG1 4.4Å; I286-I290 WeakPolarHBondContact O-CG1 3.36Å; I286-I290 PolarHBondContact O-N 2.69Å
287	V	98.3	Very high	94.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.9	-47.7	-179.8	178	0	0	0	0	110.7	L273 A276 M277 K283 E284 I290 I291 M330	L273-V287 HydrophobicContact CD2-CB 4.44Å; L273-V287 HydrophobicContact CD2-CG1 4.23Å; L273-V287 HydrophobicContact CD2-CG2 4.46Å; A276-V287 HydrophobicContact CB-CG2 3.88Å; M277-V287 HydrophobicContact CG-CG2 3.85Å; M277-V287 HydrophobicContact SD-CG2 4.31Å; K283-V287 PolarHBondContact O-N 2.68Å; K283-V287 VanDerWaalsContact O-N 3.16Å; E284-V287 PolarHBondContact O-N 3.13Å; V287-I290 PolarHBondContact O-N 2.82Å; V287-I291 HydrophobicContact CG1-CD1 3.73Å; V287-I291 WeakPolarHBondContact O-CB 3.41Å; V287-I291 WeakPolarHBondContact O-CG1 3.16Å; V287-I291 PolarHBondContact O-N 2.81Å; V287-M330 HydrophobicContact CG1-SD 4.35Å
288	T	98.6	Very high	94.1	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.018	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-49.3	177.7	-58.3	0	0	0	0	111.4	T96 V97 E284 I286 I290 I291 V292 Y326	T96-T288 HydrophobicContact CG2-CG2 4.19Å; V97-T288 HydrophobicContact CB-CG2 4.47Å; V97-T288 HydrophobicContact CG2-CG2 3.66Å; E284-T288 WeakPolarHBondContact O-CB 2.83Å; E284-T288 PolarHBondContact O-N 3.11Å; E284-T288 PolarHBondContact O-OG1 3.41Å; I286-T288 VanDerWaalsContact C-N 3.34Å; I286-T288 PolarHBondContact O-N 3.19Å; T288-I290 VanDerWaalsContact C-N 3.34Å; T288-I290 PolarHBondContact O-N 3.12Å; T288-I291 PolarHBondContact O-N 2.89Å; T288-V292 HydrophobicContact CG2-CG2 3.94Å; T288-V292 VanDerWaalsContact O-CB 3.26Å; T288-V292 WeakPolarHBondContact O-CB 3.3Å; T288-V292 VanDerWaalsContact O-CG2 3.26Å; T288-V292 WeakPolarHBondContact O-CG2 3.39Å; T288-V292 PolarHBondContact O-N 2.86Å; T288-Y326 VanDerWaalsContact OG1-CE2 3.28Å; T288-Y326 WeakPolarHBondContact OG1-CE2 3.24Å; T288-Y326 PolarHBondContact OG1-OH 3.37Å
289	R	98.6	Very high	94.7	Very high	1 Å²	1	35 Å²	35	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-45.1	-178.6	179.4	178	57.6	-117.4	3.2	112	Y108 E112 T126 E129 K285 I286 S293	Y108-R289 HydrophobicContact CE1-CB 4.38Å; Y108-R289 HydrophobicContact CE1-CG 4.03Å; Y108-R289 WeakPolarHBondContact OH-CA 3.49Å; E112-R289 HydrophobicContact CG-CG 4.22Å; E112-R289 WeakPolarHBondContact OE2-CD 3.28Å; E112-R289 IonicContact OE2-NH1 3.6Å; T126-R289 PolarHBondContact OG1-NH1 3.44Å; E129-R289 VanDerWaalsContact CD-NE 3.35Å; E129-R289 IonicContact OE1-CZ 2.67Å; E129-R289 IonicContact OE1-NE 2.91Å; E129-R289 PolarHBondContact OE1-NE 2.86Å; E129-R289 IonicContact OE1-NH2 2.74Å; E129-R289 IonicContact OE2-CZ 2.86Å; E129-R289 IonicContact OE2-NE 3.66Å; E129-R289 PolarHBondContact OE2-NE 3.04Å; E129-R289 IonicContact OE2-NH2 2.85Å; E129-R289 PolarHBondContact OE2-NH2 2.76Å; K285-R289 VanDerWaalsContact O-CB 3.32Å; K285-R289 WeakPolarHBondContact O-CB 3.35Å; K285-R289 PolarHBondContact O-N 3.39Å; I286-R289 PolarHBondContact O-N 3.3Å; R289-S293 WeakPolarHBondContact O-CB 3.28Å; R289-S293 PolarHBondContact O-N 3.03Å; R289-S293 PolarHBondContact O-OG 3.33Å
290	I	98.8	Very high	95.6	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.9	-52.6	178.7	-63.5	170.8	0	0	0	109.9	F269 K272 L273 I286 V287 T288 V292 S293 R294	F269-I290 HydrophobicContact CB-CG2 4.08Å; F269-I290 HydrophobicContact CD1-CD1 4.14Å; F269-I290 HydrophobicContact CD1-CG1 3.96Å; F269-I290 HydrophobicContact CD1-CG2 3.87Å; F269-I290 HydrophobicContact CE1-CG1 4.36Å; F269-I290 HydrophobicContact CG-CG2 4.19Å; K272-I290 HydrophobicContact CB-CD1 3.98Å; K272-I290 HydrophobicContact CD-CD1 4.07Å; K272-I290 HydrophobicContact CG-CD1 3.86Å; L273-I290 HydrophobicContact CD1-CG2 3.87Å; L273-I290 HydrophobicContact CD2-CB 3.99Å; L273-I290 HydrophobicContact CD2-CD1 4.09Å; L273-I290 HydrophobicContact CD2-CG2 4Å; L273-I290 HydrophobicContact CG-CB 4.33Å; L273-I290 HydrophobicContact CG-CD1 4Å; L273-I290 HydrophobicContact CG-CG2 3.88Å; I286-I290 HydrophobicContact CG2-CD1 3.69Å; I286-I290 HydrophobicContact CG2-CG1 4.4Å; I286-I290 WeakPolarHBondContact O-CG1 3.36Å; I286-I290 PolarHBondContact O-N 2.69Å; V287-I290 PolarHBondContact O-N 2.82Å; T288-I290 VanDerWaalsContact C-N 3.34Å; T288-I290 PolarHBondContact O-N 3.12Å; I290-V292 PolarHBondContact O-N 2.87Å; I290-S293 PolarHBondContact O-N 2.85Å; I290-S293 PolarHBondContact O-OG 2.79Å; I290-R294 HydrophobicContact CG2-CG 4.16Å; I290-R294 VanDerWaalsContact O-CB 3.29Å; I290-R294 WeakPolarHBondContact O-CB 3.48Å; I290-R294 WeakPolarHBondContact O-CG 3.3Å; I290-R294 PolarHBondContact O-N 2.57Å
291	I	98.7	Very high	96.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.3	-45.6	-176.3	-69.4	176.4	0	0	0	111.3	L273 V287 T288 R294 C295 L299 I318 M330 L333	L273-I291 HydrophobicContact CD2-CG1 4.34Å; V287-I291 HydrophobicContact CG1-CD1 3.73Å; V287-I291 WeakPolarHBondContact O-CB 3.41Å; V287-I291 WeakPolarHBondContact O-CG1 3.16Å; V287-I291 PolarHBondContact O-N 2.81Å; T288-I291 PolarHBondContact O-N 2.89Å; I291-R294 PolarHBondContact O-N 3.48Å; I291-C295 WeakPolarHBondContact O-CB 3.15Å; I291-C295 PolarHBondContact O-N 2.68Å; I291-L299 HydrophobicContact CG2-CD2 3.98Å; I291-I318 HydrophobicContact CD1-CD1 3.8Å; I291-M330 HydrophobicContact CB-SD 4.13Å; I291-M330 HydrophobicContact CD1-CB 4.19Å; I291-M330 HydrophobicContact CD1-CG 4.33Å; I291-M330 HydrophobicContact CD1-SD 3.67Å; I291-M330 HydrophobicContact CG1-SD 4.46Å; I291-M330 HydrophobicContact CG2-CE 4.47Å; I291-M330 HydrophobicContact CG2-SD 4.11Å; I291-L333 HydrophobicContact CG2-CB 3.58Å; I291-L333 HydrophobicContact CG2-CD1 3.67Å; I291-L333 HydrophobicContact CG2-CG 4.28Å
292	V	98.8	Very high	97.5	Very high	9 Å²	9	27.9 Å²	27.9	6%	0.055	13%	0.13	C	C	.	.	H	α-helix	trans	-64.1	-47.2	179.6	172	0	0	0	0	111.3	V97 L101 Y108 T288 I290 R294 C295	V97-V292 HydrophobicContact CG1-CG2 4.34Å; L101-V292 HydrophobicContact CD2-CG1 4.23Å; L101-V292 HydrophobicContact CD2-CG2 4.26Å; Y108-V292 HydrophobicContact CD1-CG1 3.97Å; Y108-V292 HydrophobicContact CD2-CG1 4.05Å; Y108-V292 HydrophobicContact CE1-CB 4.05Å; Y108-V292 HydrophobicContact CE1-CG1 3.88Å; Y108-V292 HydrophobicContact CE2-CG1 4.02Å; Y108-V292 HydrophobicContact CG-CG1 4.04Å; T288-V292 HydrophobicContact CG2-CG2 3.94Å; T288-V292 VanDerWaalsContact O-CB 3.26Å; T288-V292 WeakPolarHBondContact O-CB 3.3Å; T288-V292 VanDerWaalsContact O-CG2 3.26Å; T288-V292 WeakPolarHBondContact O-CG2 3.39Å; T288-V292 PolarHBondContact O-N 2.86Å; I290-V292 PolarHBondContact O-N 2.87Å; V292-R294 VanDerWaalsContact C-N 3.31Å; V292-R294 PolarHBondContact O-N 2.79Å; V292-C295 PolarHBondContact O-SG 2.9Å
293	S	98.4	Very high	97.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-70.3	-25.5	-178.3	63.2	0	0	0	0	113.6	T105 R289 I290 V297	T105-S293 WeakPolarHBondContact CG2-O 3.17Å; R289-S293 WeakPolarHBondContact O-CB 3.28Å; R289-S293 PolarHBondContact O-N 3.03Å; R289-S293 PolarHBondContact O-OG 3.33Å; I290-S293 PolarHBondContact O-N 2.85Å; I290-S293 PolarHBondContact O-OG 2.79Å; S293-V297 WeakPolarHBondContact O-CG2 3.38Å
294	R	98.3	Very high	97.9	Very high	3 Å²	3	24.9 Å²	24.9	1%	0.011	12%	0.123	C	C	.	.	H	α-helix	trans	-103.4	-15.2	-174.3	-52.6	-45.2	-68.5	174.3	-5.1	114.5	E138 F269 I290 I291 V292 E296 V297 D298 L299 I302	E138-R294 IonicContact OE1-NH1 2.59Å; E138-R294 PolarHBondContact OE1-NH1 2.96Å; F269-R294 HydrophobicContact CD2-CG 4.37Å; F269-R294 HydrophobicContact CE2-CG 4.38Å; I290-R294 HydrophobicContact CG2-CG 4.16Å; I290-R294 VanDerWaalsContact O-CB 3.29Å; I290-R294 WeakPolarHBondContact O-CB 3.48Å; I290-R294 WeakPolarHBondContact O-CG 3.3Å; I290-R294 PolarHBondContact O-N 2.57Å; I291-R294 PolarHBondContact O-N 3.48Å; V292-R294 VanDerWaalsContact C-N 3.31Å; V292-R294 PolarHBondContact O-N 2.79Å; R294-E296 VanDerWaalsContact C-N 3.28Å; R294-E296 PolarHBondContact O-N 2.74Å; R294-V297 PolarHBondContact O-N 3.39Å; R294-D298 IonicContact CZ-OD1 3.55Å; R294-D298 VanDerWaalsContact CZ-OD1 3.31Å; R294-D298 IonicContact CZ-OD2 3.33Å; R294-D298 IonicContact NE-OD1 3.76Å; R294-D298 PolarHBondContact NE-OD1 3.24Å; R294-D298 IonicContact NE-OD2 2.84Å; R294-D298 IonicContact NH2-OD1 3.35Å; R294-D298 PolarHBondContact NH2-OD1 3.19Å; R294-D298 VanDerWaalsContact NH2-OD1 3.13Å; R294-D298 IonicContact NH2-OD2 3.79Å; R294-D298 PolarHBondContact NH2-OD2 3.34Å; R294-D298 PolarHBondContact O-N 2.84Å; R294-L299 HydrophobicContact CB-CB 4.24Å; R294-L299 WeakPolarHBondContact O-CB 3.28Å; R294-L299 PolarHBondContact O-N 3.48Å; R294-I302 HydrophobicContact CB-CD1 3.69Å; R294-I302 HydrophobicContact CG-CD1 3.66Å
295	C	98.5	Very high	98	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.007	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-31.1	-174.2	65.5	0	0	0	0	114.9	P24 T25 V26 I291 V292 L299 L333	P24-C295 WeakPolarHBondContact CA-O 3.42Å; P24-C295 WeakPolarHBondContact CB-O 3.37Å; T25-C295 PolarHBondContact N-O 3.26Å; T25-C295 PolarHBondContact OG1-O 3.44Å; V26-C295 HydrophobicContact CG2-CB 3.97Å; V26-C295 PolarHBondContact N-O 3.47Å; I291-C295 WeakPolarHBondContact O-CB 3.15Å; I291-C295 PolarHBondContact O-N 2.68Å; V292-C295 PolarHBondContact O-SG 2.9Å; C295-L299 HydrophobicContact CB-CD2 3.85Å; C295-L333 HydrophobicContact CB-CD2 4.28Å
296	E	97.6	Very high	98.1	Very high	43 Å²	43	19.2 Å²	19.2	20%	0.201	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	9.9	174.7	-68.7	-173.3	-133.4	0	0	113.1	V26 Y64 R67 R294	V26-E296 HydrophobicContact CB-CG 3.93Å; V26-E296 HydrophobicContact CG1-CG 4.12Å; Y64-E296 PolarHBondContact N-OE1 2.69Å; Y64-E296 PolarHBondContact N-OE2 2.9Å; R67-E296 IonicContact CZ-OE1 3.63Å; R67-E296 IonicContact NE-OE1 3.48Å; R67-E296 IonicContact NH2-OE1 3.45Å; R67-E296 PolarHBondContact NH2-OE1 3.06Å; R294-E296 VanDerWaalsContact C-N 3.28Å; R294-E296 PolarHBondContact O-N 2.74Å
297	V	97	Very high	98.1	Very high	18 Å²	18	22.5 Å²	22.5	11%	0.109	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.3	-73	-176.1	-173.1	0	0	0	0	111.1	L22 Y23 T105 S293 R294	L22-V297 CarbonylContact C-O 3.49Å; L22-V297 WeakPolarHBondContact CA-O 3.26Å; L22-V297 HydrophobicContact CD2-CG1 4.06Å; Y23-V297 CarbonylContact C-O 3.35Å; Y23-V297 PolarHBondContact N-O 2.92Å; T105-V297 HydrophobicContact CG2-CG2 4.29Å; S293-V297 WeakPolarHBondContact O-CG2 3.38Å; R294-V297 PolarHBondContact O-N 3.39Å
298	D	97.4	Very high	98.1	Very high	6 Å²	6	25.9 Å²	25.9	3%	0.032	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-149.3	15.7	-170.2	63.9	-4.5	0	0	0	114.2	Y23 Q266 R294 K300 K301 I302	Y23-D298 CarbonylContact O-C 3.23Å; Y23-D298 VanDerWaalsContact O-C 3.23Å; Y23-D298 VanDerWaalsContact O-CA 3.24Å; Y23-D298 WeakPolarHBondContact O-CA 3.49Å; Q266-D298 HydrophobicContact CG-CB 4.25Å; Q266-D298 PolarHBondContact NE2-OD2 2.95Å; R294-D298 IonicContact CZ-OD1 3.55Å; R294-D298 VanDerWaalsContact CZ-OD1 3.31Å; R294-D298 IonicContact CZ-OD2 3.33Å; R294-D298 IonicContact NE-OD1 3.76Å; R294-D298 PolarHBondContact NE-OD1 3.24Å; R294-D298 IonicContact NE-OD2 2.84Å; R294-D298 IonicContact NH2-OD1 3.35Å; R294-D298 PolarHBondContact NH2-OD1 3.19Å; R294-D298 VanDerWaalsContact NH2-OD1 3.13Å; R294-D298 IonicContact NH2-OD2 3.79Å; R294-D298 PolarHBondContact NH2-OD2 3.34Å; R294-D298 PolarHBondContact O-N 2.84Å; D298-K300 PolarHBondContact O-N 3.41Å; D298-K301 PolarHBondContact O-N 2.92Å; D298-I302 PolarHBondContact O-N 3.47Å; D298-I302 VanDerWaalsContact O-N 3.1Å; D298-I302 WeakPolarHBondContact OD1-CD1 3.44Å
299	L	98.3	Very high	98.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-55.2	-29.8	-178.2	-174.5	58.6	0	0	0	113	Y23 T25 I291 R294 C295 K301 I302 C303 L314 L333	Y23-L299 PolarHBondContact O-N 3.38Å; T25-L299 HydrophobicContact CG2-CB 3.99Å; T25-L299 HydrophobicContact CG2-CD2 4.36Å; T25-L299 HydrophobicContact CG2-CG 4.06Å; I291-L299 HydrophobicContact CG2-CD2 3.98Å; R294-L299 HydrophobicContact CB-CB 4.24Å; R294-L299 WeakPolarHBondContact O-CB 3.28Å; R294-L299 PolarHBondContact O-N 3.48Å; C295-L299 HydrophobicContact CB-CD2 3.85Å; L299-K301 VanDerWaalsContact C-N 3.33Å; L299-K301 PolarHBondContact O-N 3.13Å; L299-I302 HydrophobicContact CD1-CB 4.22Å; L299-I302 HydrophobicContact CD1-CD1 4.42Å; L299-I302 HydrophobicContact CD1-CG2 4.36Å; L299-I302 PolarHBondContact O-N 2.91Å; L299-C303 PolarHBondContact O-N 3.11Å; L299-C303 PolarHBondContact O-SG 3.19Å; L299-L314 HydrophobicContact CD1-CD2 4.37Å; L299-L333 WeakPolarHBondContact CD2-O 3.4Å
300	K	97.8	Very high	98	Very high	88 Å²	88	31.7 Å²	31.7	38%	0.383	18%	0.177	S	C	.	.	H	α-helix	trans	-63.9	-39.4	176.8	-173	-179.5	-179	179.4	0	111.8	Y23 T25 D298 S304	Y23-K300 WeakPolarHBondContact O-CB 3.4Å; Y23-K300 PolarHBondContact O-N 3.12Å; T25-K300 HydrophobicContact CG2-CB 3.97Å; D298-K300 PolarHBondContact O-N 3.41Å; K300-S304 PolarHBondContact O-N 2.94Å; K300-S304 VanDerWaalsContact O-N 3.16Å; K300-S304 PolarHBondContact O-OG 3.33Å
301	K	97.4	Very high	97.8	Very high	80 Å²	80	35.2 Å²	35.2	35%	0.348	21%	0.213	S	C	.	.	H	α-helix	trans	-72	-37.5	174.8	-78.5	-73.8	-173.3	175.4	0	111.4	Y23 Q266 D298 L299 C303 S304 E305	Y23-K301 HydrophobicContact CD1-CD 4.46Å; Y23-K301 HydrophobicContact CD1-CG 3.99Å; Y23-K301 HydrophobicContact CD2-CD 4.27Å; Y23-K301 HydrophobicContact CD2-CG 3.39Å; Y23-K301 VanDerWaalsContact CE1-CE 3.47Å; Y23-K301 HydrophobicContact CE2-CD 4.41Å; Y23-K301 HydrophobicContact CE2-CG 3.98Å; Y23-K301 HydrophobicContact CG-CD 4.29Å; Y23-K301 HydrophobicContact CG-CG 3.39Å; Y23-K301 VanDerWaalsContact CZ-CE 3.4Å; Q266-K301 HydrophobicContact CB-CB 4.23Å; Q266-K301 HydrophobicContact CG-CB 3.74Å; D298-K301 PolarHBondContact O-N 2.92Å; L299-K301 VanDerWaalsContact C-N 3.33Å; L299-K301 PolarHBondContact O-N 3.13Å; K301-C303 VanDerWaalsContact C-N 3.33Å; K301-C303 PolarHBondContact O-N 2.81Å; K301-S304 WeakPolarHBondContact O-CB 3.34Å; K301-S304 PolarHBondContact O-N 3.28Å; K301-S304 VanDerWaalsContact O-N 3.1Å; K301-E305 WeakPolarHBondContact O-CG 3.08Å; K301-E305 PolarHBondContact O-N 3Å
302	I	98.5	Very high	97.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.7	-45.4	172.9	-62.6	171.1	0	0	0	110.4	Q266 F269 A270 L273 R294 D298 L299 S304 E305 Y306	Q266-I302 HydrophobicContact CB-CG1 3.9Å; Q266-I302 HydrophobicContact CG-CG1 3.97Å; F269-I302 HydrophobicContact CB-CD1 3.69Å; F269-I302 HydrophobicContact CB-CG1 4.11Å; F269-I302 HydrophobicContact CB-CG2 4.16Å; F269-I302 HydrophobicContact CD2-CD1 3.94Å; F269-I302 HydrophobicContact CG-CD1 4.09Å; A270-I302 HydrophobicContact CB-CG2 4.24Å; L273-I302 HydrophobicContact CD1-CG2 3.78Å; R294-I302 HydrophobicContact CB-CD1 3.69Å; R294-I302 HydrophobicContact CG-CD1 3.66Å; D298-I302 PolarHBondContact O-N 3.47Å; D298-I302 VanDerWaalsContact O-N 3.1Å; D298-I302 WeakPolarHBondContact OD1-CD1 3.44Å; L299-I302 HydrophobicContact CD1-CB 4.22Å; L299-I302 HydrophobicContact CD1-CD1 4.42Å; L299-I302 HydrophobicContact CD1-CG2 4.36Å; L299-I302 PolarHBondContact O-N 2.91Å; I302-S304 VanDerWaalsContact C-N 3.29Å; I302-S304 PolarHBondContact O-N 2.99Å; I302-E305 PolarHBondContact O-N 2.61Å; I302-Y306 VanDerWaalsContact O-CB 3.22Å; I302-Y306 WeakPolarHBondContact O-CB 3.43Å; I302-Y306 PolarHBondContact O-N 3.5Å
303	C	98.2	Very high	97.6	Very high	14 Å²	14	37 Å²	37	10%	0.095	22%	0.221	C	C	.	.	H	α-helix	trans	-58.4	-40.7	174.4	-66.4	0	0	0	0	112.1	L299 K301 Y306 K307	L299-C303 PolarHBondContact O-N 3.11Å; L299-C303 PolarHBondContact O-SG 3.19Å; K301-C303 VanDerWaalsContact C-N 3.33Å; K301-C303 PolarHBondContact O-N 2.81Å; C303-Y306 PolarHBondContact O-N 2.95Å; C303-K307 PolarHBondContact O-N 3.45Å
304	S	97.5	Very high	97.6	Very high	65 Å²	65	37 Å²	37	46%	0.455	22%	0.221	S	C	.	.	H	α-helix	trans	-66.1	-47.7	178.8	-54.5	0	0	0	0	111.9	K300 K301 I302 Y306 K307 G308	K300-S304 PolarHBondContact O-N 2.94Å; K300-S304 VanDerWaalsContact O-N 3.16Å; K300-S304 PolarHBondContact O-OG 3.33Å; K301-S304 WeakPolarHBondContact O-CB 3.34Å; K301-S304 PolarHBondContact O-N 3.28Å; K301-S304 VanDerWaalsContact O-N 3.1Å; I302-S304 VanDerWaalsContact C-N 3.29Å; I302-S304 PolarHBondContact O-N 2.99Å; S304-Y306 VanDerWaalsContact C-N 3.32Å; S304-Y306 PolarHBondContact O-N 3.45Å; S304-K307 PolarHBondContact O-N 3.42Å; S304-G308 PolarHBondContact O-N 2.66Å
305	E	98.1	Very high	97.6	Very high	59 Å²	59	37.7 Å²	37.7	28%	0.276	23%	0.225	S	C	.	.	H	α-helix	trans	-62.7	-39.5	176.3	-69.9	-68.6	175.9	0	0	111.6	N264 Q266 A270 K301 I302 G308 T309	N264-E305 PolarHBondContact ND2-OE1 3.48Å; Q266-E305 HydrophobicContact CB-CG 3.89Å; A270-E305 HydrophobicContact CB-CB 4.17Å; K301-E305 WeakPolarHBondContact O-CG 3.08Å; K301-E305 PolarHBondContact O-N 3Å; I302-E305 PolarHBondContact O-N 2.61Å; E305-G308 PolarHBondContact O-N 3.33Å; E305-T309 VanDerWaalsContact O-CB 3.23Å; E305-T309 WeakPolarHBondContact O-CB 3.38Å; E305-T309 PolarHBondContact O-N 3.43Å; E305-T309 PolarHBondContact O-OG1 3.28Å
306	Y	98.3	Very high	97.5	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.2	-52.4	176.4	-167.4	-76.4	0	0	0	111.2	A270 L273 N274 M277 I302 C303 S304 G308 T309 F310 Q312 L314 T317	A270-Y306 HydrophobicContact CB-CD2 4.05Å; A270-Y306 HydrophobicContact CB-CG 4.43Å; A270-Y306 VanDerWaalsContact O-CD2 3.29Å; A270-Y306 WeakPolarHBondContact O-CD2 3.35Å; A270-Y306 WeakPolarHBondContact O-CE2 3.35Å; L273-Y306 HydrophobicContact CB-CD2 4.32Å; L273-Y306 HydrophobicContact CB-CE2 4.04Å; N274-Y306 HydrophobicContact CB-CE2 3.61Å; N274-Y306 PolarHBondContact ND2-OH 2.88Å; M277-Y306 HydrophobicContact CE-CE2 4.4Å; I302-Y306 VanDerWaalsContact O-CB 3.22Å; I302-Y306 WeakPolarHBondContact O-CB 3.43Å; I302-Y306 PolarHBondContact O-N 3.5Å; C303-Y306 PolarHBondContact O-N 2.95Å; S304-Y306 VanDerWaalsContact C-N 3.32Å; S304-Y306 PolarHBondContact O-N 3.45Å; Y306-G308 PolarHBondContact O-N 2.9Å; Y306-T309 PolarHBondContact O-N 3.41Å; Y306-F310 AromaticContact CD1-CD2 3.83Å; Y306-F310 HydrophobicContact CD1-CD2 3.83Å; Y306-F310 AromaticContact CD2-CD2 3.88Å; Y306-F310 HydrophobicContact CD2-CD2 3.88Å; Y306-F310 AromaticContact CD2-CE2 3.93Å; Y306-F310 HydrophobicContact CD2-CE2 3.93Å; Y306-F310 HydrophobicContact CE1-CB 4.38Å; Y306-F310 AromaticContact CE1-CD2 3.84Å; Y306-F310 HydrophobicContact CE1-CD2 3.84Å; Y306-F310 HydrophobicContact CE1-CG 4.49Å; Y306-F310 AromaticContact CE2-CD2 3.89Å; Y306-F310 HydrophobicContact CE2-CD2 3.89Å; Y306-F310 AromaticContact CE2-CE2 3.99Å; Y306-F310 HydrophobicContact CE2-CE2 3.99Å; Y306-F310 AromaticContact CG-CD2 3.83Å; Y306-F310 HydrophobicContact CG-CD2 3.83Å; Y306-F310 HydrophobicContact CG-CE2 4.27Å; Y306-F310 AromaticContact CZ-CD2 3.86Å; Y306-F310 VanDerWaalsContact O-CD2 3.27Å; Y306-F310 WeakPolarHBondContact O-CD2 3.36Å; Y306-F310 PolarHBondContact O-N 3.4Å; Y306-Q312 VanDerWaalsContact CD1-O 3.32Å; Y306-Q312 WeakPolarHBondContact CD1-O 3.43Å; Y306-L314 HydrophobicContact CD1-CB 3.95Å; Y306-L314 HydrophobicContact CD2-CB 4.39Å; Y306-L314 HydrophobicContact CD2-CD1 3.91Å; Y306-L314 HydrophobicContact CE1-CB 4.38Å; Y306-L314 HydrophobicContact CE1-CD1 4.48Å; Y306-L314 HydrophobicContact CE2-CD1 3.76Å; Y306-L314 HydrophobicContact CG-CB 3.97Å; Y306-L314 HydrophobicContact CG-CD1 4.34Å; Y306-T317 WeakPolarHBondContact CE1-OG1 3.27Å; Y306-T317 WeakPolarHBondContact OH-CB 3.32Å; Y306-T317 VanDerWaalsContact OH-CG2 3.28Å; Y306-T317 WeakPolarHBondContact OH-CG2 3.32Å; Y306-T317 PolarHBondContact OH-OG1 3.3Å
307	K	97.5	Very high	97.4	Very high	83 Å²	83	40.1 Å²	40.1	36%	0.361	24%	0.236	S	C	.	.	H	α-helix	trans	-61.8	-44	178.5	-173.6	172.1	-179.4	169.5	0	111.8	C303 S304 T309 G311 Q312 D337 Q338	C303-K307 PolarHBondContact O-N 3.45Å; S304-K307 PolarHBondContact O-N 3.42Å; K307-T309 VanDerWaalsContact C-N 3.3Å; K307-T309 PolarHBondContact O-N 3.48Å; K307-G311 WeakPolarHBondContact O-CA 3.3Å; K307-G311 PolarHBondContact O-N 3.05Å; K307-Q312 WeakPolarHBondContact CA-O 3.49Å; K307-D337 IonicContact NZ-OD1 3.72Å; K307-Q338 PolarHBondContact NZ-O 3.49Å
308	G	97.8	Very high	97.4	Very high	70 Å²	70	39.2 Å²	39.2	72%	0.722	23%	0.231	S	C	*	.	H	α-helix	trans	-62.6	-35	177.2	0	0	0	0	0	113.5	S304 E305 Y306	S304-G308 PolarHBondContact O-N 2.66Å; E305-G308 PolarHBondContact O-N 3.33Å; Y306-G308 PolarHBondContact O-N 2.9Å
309	T	97.9	Very high	97.4	Very high	62 Å²	62	42.3 Å²	42.3	38%	0.38	25%	0.25	S	S	.	.	H	α-helix	trans	-84.3	-39.5	-177	-57.3	0	0	0	0	113.1	L267 E305 Y306 K307	L267-T309 HydrophobicContact CD1-CG2 4.21Å; L267-T309 WeakPolarHBondContact CD1-OG1 3.13Å; E305-T309 VanDerWaalsContact O-CB 3.23Å; E305-T309 WeakPolarHBondContact O-CB 3.38Å; E305-T309 PolarHBondContact O-N 3.43Å; E305-T309 PolarHBondContact O-OG1 3.28Å; Y306-T309 PolarHBondContact O-N 3.41Å; K307-T309 VanDerWaalsContact C-N 3.3Å; K307-T309 PolarHBondContact O-N 3.48Å
310	F	96.8	Very high	97.2	Very high	64 Å²	64	47.3 Å²	47.3	28%	0.281	27%	0.273	S	S	.	.	H	α-helix	trans	-107.9	-6.1	-171	-57	-61.1	0	0	0	114.1	K271 N274 Y306 Q312	K271-F310 HydrophobicContact CG-CZ 4.12Å; N274-F310 HydrophobicContact CB-CD2 3.98Å; N274-F310 HydrophobicContact CB-CE1 4.07Å; N274-F310 HydrophobicContact CB-CE2 3.42Å; N274-F310 VanDerWaalsContact CB-CE2 3.42Å; N274-F310 HydrophobicContact CB-CZ 3.47Å; N274-F310 VanDerWaalsContact CB-CZ 3.47Å; N274-F310 WeakPolarHBondContact OD1-CE1 3.29Å; Y306-F310 AromaticContact CD1-CD2 3.83Å; Y306-F310 HydrophobicContact CD1-CD2 3.83Å; Y306-F310 AromaticContact CD2-CD2 3.88Å; Y306-F310 HydrophobicContact CD2-CD2 3.88Å; Y306-F310 AromaticContact CD2-CE2 3.93Å; Y306-F310 HydrophobicContact CD2-CE2 3.93Å; Y306-F310 HydrophobicContact CE1-CB 4.38Å; Y306-F310 AromaticContact CE1-CD2 3.84Å; Y306-F310 HydrophobicContact CE1-CD2 3.84Å; Y306-F310 HydrophobicContact CE1-CG 4.49Å; Y306-F310 AromaticContact CE2-CD2 3.89Å; Y306-F310 HydrophobicContact CE2-CD2 3.89Å; Y306-F310 AromaticContact CE2-CE2 3.99Å; Y306-F310 HydrophobicContact CE2-CE2 3.99Å; Y306-F310 AromaticContact CG-CD2 3.83Å; Y306-F310 HydrophobicContact CG-CD2 3.83Å; Y306-F310 HydrophobicContact CG-CE2 4.27Å; Y306-F310 AromaticContact CZ-CD2 3.86Å; Y306-F310 VanDerWaalsContact O-CD2 3.27Å; Y306-F310 WeakPolarHBondContact O-CD2 3.36Å; Y306-F310 PolarHBondContact O-N 3.4Å; F310-Q312 PolarHBondContact O-N 3.14Å; F310-Q312 VanDerWaalsContact O-N 3.12Å
311	G	96	Very high	97.1	Very high	74 Å²	74	46.2 Å²	46.2	76%	0.763	27%	0.27	S	S	*	.	S	Bend	trans	70	1	-178.5	0	0	0	0	0	114.5	K307	K307-G311 WeakPolarHBondContact O-CA 3.3Å; K307-G311 PolarHBondContact O-N 3.05Å
312	Q	95.3	Very high	97	Very high	43 Å²	43	42.9 Å²	42.9	20%	0.201	26%	0.256	C	S	.	.	S	Bend	trans	-128.8	140.9	-179.8	-172.2	-172.4	48.4	0	0	108.8	Y306 K307 F310 Q316 T317 E320	Y306-Q312 VanDerWaalsContact CD1-O 3.32Å; Y306-Q312 WeakPolarHBondContact CD1-O 3.43Å; K307-Q312 WeakPolarHBondContact CA-O 3.49Å; F310-Q312 PolarHBondContact O-N 3.14Å; F310-Q312 VanDerWaalsContact O-N 3.12Å; Q312-Q316 HydrophobicContact CG-CB 3.86Å; Q312-Q316 HydrophobicContact CG-CG 3.93Å; Q312-T317 PolarHBondContact OE1-OG1 3.42Å; Q312-E320 PolarHBondContact NE2-OE1 3.41Å; Q312-E320 PolarHBondContact NE2-OE2 3.4Å
313	S	97.5	Very high	96.9	Very high	4 Å²	4	51.3 Å²	51.3	3%	0.028	29%	0.293	C	S	.	.			trans	-69.2	152	178.1	69.1	0	0	0	0	111.8	Q315 Q316 T317 D337	S313-Q315 PolarHBondContact O-N 3.1Å; S313-Q316 PolarHBondContact O-N 2.95Å; S313-Q316 WeakPolarHBondContact OG-CB 3.5Å; S313-Q316 PolarHBondContact OG-N 3.36Å; S313-Q316 VanDerWaalsContact OG-N 3.16Å; S313-T317 PolarHBondContact O-N 2.83Å; S313-T317 VanDerWaalsContact O-N 3.09Å; S313-T317 PolarHBondContact O-OG1 3.1Å; S313-D337 VanDerWaalsContact CB-CG 3.49Å; S313-D337 WeakPolarHBondContact CB-OD1 3.31Å; S313-D337 WeakPolarHBondContact CB-OD2 3.36Å; S313-D337 PolarHBondContact OG-OD2 3.08Å
314	L	97.8	Very high	96.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.5	-38.7	175.4	176	60	0	0	0	110.9	L273 M277 L299 Y306 Q316 T317 I318	L273-L314 HydrophobicContact CB-CD1 4.23Å; L273-L314 HydrophobicContact CD1-CD1 4.02Å; L273-L314 HydrophobicContact CD1-CD2 3.79Å; M277-L314 HydrophobicContact CE-CD1 3.6Å; L299-L314 HydrophobicContact CD1-CD2 4.37Å; Y306-L314 HydrophobicContact CD1-CB 3.95Å; Y306-L314 HydrophobicContact CD2-CB 4.39Å; Y306-L314 HydrophobicContact CD2-CD1 3.91Å; Y306-L314 HydrophobicContact CE1-CB 4.38Å; Y306-L314 HydrophobicContact CE1-CD1 4.48Å; Y306-L314 HydrophobicContact CE2-CD1 3.76Å; Y306-L314 HydrophobicContact CG-CB 3.97Å; Y306-L314 HydrophobicContact CG-CD1 4.34Å; L314-Q316 VanDerWaalsContact C-N 3.34Å; L314-Q316 PolarHBondContact O-N 3.1Å; L314-T317 PolarHBondContact O-N 2.71Å; L314-I318 HydrophobicContact CD1-CD1 4.09Å; L314-I318 HydrophobicContact CD1-CG1 4.26Å; L314-I318 HydrophobicContact CD2-CD1 4.48Å; L314-I318 HydrophobicContact CG-CD1 3.82Å; L314-I318 HydrophobicContact CG-CG1 4.44Å; L314-I318 WeakPolarHBondContact O-CB 3.44Å; L314-I318 VanDerWaalsContact O-CG1 3.27Å; L314-I318 WeakPolarHBondContact O-CG1 3.44Å; L314-I318 PolarHBondContact O-N 3.3Å
315	Q	97.7	Very high	96.8	Very high	17 Å²	17	51.9 Å²	51.9	8%	0.079	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-42.6	176.8	-67.4	87.8	-26.6	0	0	111.9	S313 I318 T319 L331 C334 G335 P336	S313-Q315 PolarHBondContact O-N 3.1Å; Q315-I318 PolarHBondContact O-N 3.33Å; Q315-T319 WeakPolarHBondContact O-CB 3.39Å; Q315-T319 PolarHBondContact O-N 2.98Å; Q315-T319 PolarHBondContact O-OG1 2.91Å; Q315-L331 HydrophobicContact CB-CD2 3.86Å; Q315-L331 HydrophobicContact CG-CD2 4.25Å; Q315-L331 VanDerWaalsContact O-CD2 3.31Å; Q315-L331 WeakPolarHBondContact O-CD2 3.25Å; Q315-C334 HydrophobicContact CG-CB 3.92Å; Q315-G335 PolarHBondContact NE2-O 2.73Å; Q315-P336 PolarHBondContact NE2-O 3.17Å
316	Q	96.6	Very high	96.9	Very high	91 Å²	91	49.6 Å²	49.6	43%	0.425	29%	0.289	S	S	.	.	H	α-helix	trans	-65.8	-46.4	176.5	-174.3	-177.5	-14.8	0	0	110.9	Q312 S313 L314 I318 T319 E320	Q312-Q316 HydrophobicContact CG-CB 3.86Å; Q312-Q316 HydrophobicContact CG-CG 3.93Å; S313-Q316 PolarHBondContact O-N 2.95Å; S313-Q316 WeakPolarHBondContact OG-CB 3.5Å; S313-Q316 PolarHBondContact OG-N 3.36Å; S313-Q316 VanDerWaalsContact OG-N 3.16Å; L314-Q316 VanDerWaalsContact C-N 3.34Å; L314-Q316 PolarHBondContact O-N 3.1Å; Q316-I318 VanDerWaalsContact C-N 3.32Å; Q316-I318 PolarHBondContact O-N 3Å; Q316-T319 WeakPolarHBondContact O-CB 3.24Å; Q316-T319 PolarHBondContact O-N 2.81Å; Q316-T319 VanDerWaalsContact O-N 3.07Å; Q316-E320 WeakPolarHBondContact CG-OE1 3.43Å; Q316-E320 PolarHBondContact NE2-OE1 2.96Å; Q316-E320 WeakPolarHBondContact O-CG 3.37Å; Q316-E320 PolarHBondContact O-N 2.79Å
317	T	96.4	Very high	96.8	Very high	4 Å²	4	51.5 Å²	51.5	3%	0.025	30%	0.298	C	S	.	.	H	α-helix	trans	-59.9	-42.3	175.9	-50.1	0	0	0	0	111.7	M277 Y306 Q312 S313 L314 T319 E320 H321	M277-T317 HydrophobicContact CB-CG2 3.89Å; M277-T317 HydrophobicContact CE-CG2 3.75Å; M277-T317 HydrophobicContact SD-CG2 3.94Å; Y306-T317 WeakPolarHBondContact CE1-OG1 3.27Å; Y306-T317 WeakPolarHBondContact OH-CB 3.32Å; Y306-T317 VanDerWaalsContact OH-CG2 3.28Å; Y306-T317 WeakPolarHBondContact OH-CG2 3.32Å; Y306-T317 PolarHBondContact OH-OG1 3.3Å; Q312-T317 PolarHBondContact OE1-OG1 3.42Å; S313-T317 PolarHBondContact O-N 2.83Å; S313-T317 VanDerWaalsContact O-N 3.09Å; S313-T317 PolarHBondContact O-OG1 3.1Å; L314-T317 PolarHBondContact O-N 2.71Å; T317-T319 VanDerWaalsContact C-N 3.26Å; T317-T319 PolarHBondContact O-N 2.96Å; T317-E320 PolarHBondContact O-N 2.73Å; T317-H321 WeakPolarHBondContact O-CB 2.92Å; T317-H321 PolarHBondContact O-CD2 3.08Å; T317-H321 VanDerWaalsContact O-CD2 3.26Å; T317-H321 PolarHBondContact O-N 3.16Å
318	I	96.9	Very high	96.9	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.6	-42.2	175.5	-72.5	164.7	0	0	0	110.6	M277 I291 L314 Q315 Q316 E320 H321 T322 Q327 M330 L331 C334	M277-I318 HydrophobicContact CE-CG1 4.4Å; M277-I318 HydrophobicContact SD-CG1 3.95Å; I291-I318 HydrophobicContact CD1-CD1 3.8Å; L314-I318 HydrophobicContact CD1-CD1 4.09Å; L314-I318 HydrophobicContact CD1-CG1 4.26Å; L314-I318 HydrophobicContact CD2-CD1 4.48Å; L314-I318 HydrophobicContact CG-CD1 3.82Å; L314-I318 HydrophobicContact CG-CG1 4.44Å; L314-I318 WeakPolarHBondContact O-CB 3.44Å; L314-I318 VanDerWaalsContact O-CG1 3.27Å; L314-I318 WeakPolarHBondContact O-CG1 3.44Å; L314-I318 PolarHBondContact O-N 3.3Å; Q315-I318 PolarHBondContact O-N 3.33Å; Q316-I318 VanDerWaalsContact C-N 3.32Å; Q316-I318 PolarHBondContact O-N 3Å; I318-E320 VanDerWaalsContact C-N 3.31Å; I318-E320 PolarHBondContact O-N 2.82Å; I318-H321 PolarHBondContact O-N 3.15Å; I318-T322 HydrophobicContact CG2-CG2 4.5Å; I318-T322 WeakPolarHBondContact CG2-OG1 3.05Å; I318-T322 WeakPolarHBondContact O-CB 3.36Å; I318-T322 PolarHBondContact O-N 3.49Å; I318-T322 PolarHBondContact O-OG1 3.42Å; I318-Q327 HydrophobicContact CG2-CG 4.26Å; I318-M330 HydrophobicContact CD1-CB 4.27Å; I318-M330 HydrophobicContact CG2-CB 3.84Å; I318-L331 HydrophobicContact CB-CD2 4.01Å; I318-L331 HydrophobicContact CG2-CD2 3.76Å; I318-L331 HydrophobicContact CG2-CG 3.97Å; I318-C334 VanDerWaalsContact CD1-SG 3.53Å
319	T	96.1	Very high	96.9	Very high	71 Å²	71	48.3 Å²	48.3	44%	0.436	26%	0.264	S	S	.	.	H	α-helix	trans	-64.2	-35.9	178.7	-62.8	0	0	0	0	112.7	Q315 Q316 T317	Q315-T319 WeakPolarHBondContact O-CB 3.39Å; Q315-T319 PolarHBondContact O-N 2.98Å; Q315-T319 PolarHBondContact O-OG1 2.91Å; Q316-T319 WeakPolarHBondContact O-CB 3.24Å; Q316-T319 PolarHBondContact O-N 2.81Å; Q316-T319 VanDerWaalsContact O-N 3.07Å; T317-T319 VanDerWaalsContact C-N 3.26Å; T317-T319 PolarHBondContact O-N 2.96Å
320	E	95.1	Very high	97	Very high	104 Å²	104	45.3 Å²	45.3	49%	0.486	25%	0.246	S	C	.	.	H	α-helix	trans	-77.1	-29.1	179.9	-70.9	168.7	-177	0	0	113	Q312 Q316 T317 I318	Q312-E320 PolarHBondContact NE2-OE1 3.41Å; Q312-E320 PolarHBondContact NE2-OE2 3.4Å; Q316-E320 WeakPolarHBondContact CG-OE1 3.43Å; Q316-E320 PolarHBondContact NE2-OE1 2.96Å; Q316-E320 WeakPolarHBondContact O-CG 3.37Å; Q316-E320 PolarHBondContact O-N 2.79Å; T317-E320 PolarHBondContact O-N 2.73Å; I318-E320 VanDerWaalsContact C-N 3.31Å; I318-E320 PolarHBondContact O-N 2.82Å
321	H	95.4	Very high	97	Very high	65 Å²	65	44.4 Å²	44.4	30%	0.301	24%	0.244	S	C	.	.	H	α-helix	trans	-113.6	-5.8	-169.2	-70.2	-82.4	0	0	0	115.6	M277 A282 T317 I318	M277-H321 HydrophobicContact CB-CB 4.17Å; M277-H321 HydrophobicContact CG-CB 4.45Å; M277-H321 PolarHBondContact O-CE1 3.37Å; M277-H321 PolarHBondContact O-ND1 3.3Å; A282-H321 HydrophobicContact CB-CB 4.47Å; T317-H321 WeakPolarHBondContact O-CB 2.92Å; T317-H321 PolarHBondContact O-CD2 3.08Å; T317-H321 VanDerWaalsContact O-CD2 3.26Å; T317-H321 PolarHBondContact O-N 3.16Å; I318-H321 PolarHBondContact O-N 3.15Å
322	T	95.4	Very high	97.1	Very high	11 Å²	11	42.3 Å²	42.3	7%	0.067	22%	0.218	C	C	.	.			trans	-130	168.2	178.6	72.3	0	0	0	0	110.6	A282 I318 Y326 Q327	A282-T322 HydrophobicContact CB-CG2 3.92Å; I318-T322 HydrophobicContact CG2-CG2 4.5Å; I318-T322 WeakPolarHBondContact CG2-OG1 3.05Å; I318-T322 WeakPolarHBondContact O-CB 3.36Å; I318-T322 PolarHBondContact O-N 3.49Å; I318-T322 PolarHBondContact O-OG1 3.42Å; T322-Y326 HydrophobicContact CG2-CD1 4.17Å; T322-Y326 HydrophobicContact CG2-CE1 3.73Å; T322-Q327 PolarHBondContact O-OE1 3.34Å; T322-Q327 WeakPolarHBondContact OG1-CA 3.38Å; T322-Q327 VanDerWaalsContact OG1-CB 3.24Å; T322-Q327 WeakPolarHBondContact OG1-CB 3.44Å; T322-Q327 VanDerWaalsContact OG1-CG 3.32Å; T322-Q327 WeakPolarHBondContact OG1-CG 3.45Å
323	K	95.9	Very high	97.3	Very high	176 Å²	176	40.3 Å²	40.3	77%	0.765	21%	0.208	S	C	*	.			trans	-148.9	167.7	-179.1	64.4	-174.8	178.5	-178.6	0	113	Q327	K323-Q327 VanDerWaalsContact CA-OE1 3.31Å; K323-Q327 PolarHBondContact O-N 3.44Å
324	G	97.2	Very high	97.3	Very high	44 Å²	44	40.3 Å²	40.3	45%	0.454	21%	0.208	S	C	.	.	H	α-helix	trans	65.1	-154.5	172.3	0	0	0	0	0	113	Y326 Q327 K328	G324-Y326 VanDerWaalsContact C-N 3.26Å; G324-Y326 PolarHBondContact O-N 2.91Å; G324-Q327 WeakPolarHBondContact O-CB 3.37Å; G324-Q327 PolarHBondContact O-N 2.99Å; G324-Q327 VanDerWaalsContact O-N 3.16Å; G324-K328 PolarHBondContact O-N 3.41Å
325	D	98.3	Very high	97.1	Very high	47 Å²	47	41.2 Å²	41.2	25%	0.251	22%	0.218	S	C	.	.	H	α-helix	trans	-69.7	-24.1	-173.8	-60.8	-47	0	0	0	113.5	E52 I56 L94 K328 A329	E52-D325 HydrophobicContact CB-CB 4.35Å; I56-D325 HydrophobicContact CD1-CB 3.9Å; I56-D325 WeakPolarHBondContact CD1-O 3.33Å; L94-D325 HydrophobicContact CD1-CB 4.41Å; L94-D325 HydrophobicContact CD2-CB 3.75Å; L94-D325 HydrophobicContact CG-CB 4.48Å; D325-K328 PolarHBondContact O-N 3.34Å; D325-K328 WeakPolarHBondContact OD1-CE 3.41Å; D325-K328 IonicContact OD1-NZ 3.98Å; D325-K328 PolarHBondContact OD1-NZ 3.4Å; D325-A329 WeakPolarHBondContact O-CB 3.39Å; D325-A329 PolarHBondContact O-N 3.36Å
326	Y	98.3	Very high	96.7	Very high	11 Å²	11	45.2 Å²	45.2	4%	0.043	25%	0.245	C	C	.	.	H	α-helix	trans	-59.3	-50.5	168.6	175.4	-113	0	0	0	111.6	V97 E284 T288 T322 G324 K328 A329 M330	V97-Y326 HydrophobicContact CG2-CD2 3.7Å; V97-Y326 HydrophobicContact CG2-CE2 3.54Å; E284-Y326 HydrophobicContact CB-CE1 4.14Å; E284-Y326 HydrophobicContact CG-CD1 4.3Å; E284-Y326 HydrophobicContact CG-CE1 3.62Å; E284-Y326 PolarHBondContact O-OH 3.17Å; E284-Y326 WeakPolarHBondContact OE1-CD1 3.36Å; T288-Y326 VanDerWaalsContact OG1-CE2 3.28Å; T288-Y326 WeakPolarHBondContact OG1-CE2 3.24Å; T288-Y326 PolarHBondContact OG1-OH 3.37Å; T322-Y326 HydrophobicContact CG2-CD1 4.17Å; T322-Y326 HydrophobicContact CG2-CE1 3.73Å; G324-Y326 VanDerWaalsContact C-N 3.26Å; G324-Y326 PolarHBondContact O-N 2.91Å; Y326-K328 VanDerWaalsContact C-N 3.31Å; Y326-K328 PolarHBondContact O-N 3.11Å; Y326-A329 PolarHBondContact O-N 3.23Å; Y326-M330 HydrophobicContact CD1-CG 4.46Å; Y326-M330 HydrophobicContact CD2-CE 4.41Å; Y326-M330 HydrophobicContact CD2-CG 4.21Å; Y326-M330 HydrophobicContact CE1-CG 4.01Å; Y326-M330 HydrophobicContact CE2-CE 3.94Å; Y326-M330 HydrophobicContact CE2-CG 3.73Å; Y326-M330 HydrophobicContact CE2-SD 3.75Å; Y326-M330 WeakPolarHBondContact O-CG 3.22Å; Y326-M330 PolarHBondContact O-N 3.14Å
327	Q	97.9	Very high	96	Very high	40 Å²	40	45 Å²	45	19%	0.187	25%	0.247	C	C	.	.	H	α-helix	trans	-56.6	-46.9	176.1	179.8	-170.5	-12.4	0	0	110.9	I318 T322 K323 G324 A329 M330 L331	I318-Q327 HydrophobicContact CG2-CG 4.26Å; T322-Q327 PolarHBondContact O-OE1 3.34Å; T322-Q327 WeakPolarHBondContact OG1-CA 3.38Å; T322-Q327 VanDerWaalsContact OG1-CB 3.24Å; T322-Q327 WeakPolarHBondContact OG1-CB 3.44Å; T322-Q327 VanDerWaalsContact OG1-CG 3.32Å; T322-Q327 WeakPolarHBondContact OG1-CG 3.45Å; K323-Q327 VanDerWaalsContact CA-OE1 3.31Å; K323-Q327 PolarHBondContact O-N 3.44Å; G324-Q327 WeakPolarHBondContact O-CB 3.37Å; G324-Q327 PolarHBondContact O-N 2.99Å; G324-Q327 VanDerWaalsContact O-N 3.16Å; Q327-A329 VanDerWaalsContact C-N 3.31Å; Q327-A329 PolarHBondContact O-N 2.78Å; Q327-M330 PolarHBondContact O-N 3.17Å; Q327-L331 HydrophobicContact CG-CD1 3.81Å; Q327-L331 HydrophobicContact CG-CG 4.22Å; Q327-L331 WeakPolarHBondContact O-CB 2.9Å; Q327-L331 VanDerWaalsContact O-CG 3.29Å; Q327-L331 WeakPolarHBondContact O-CG 3.5Å; Q327-L331 PolarHBondContact O-N 2.99Å
328	K	98.5	Very high	94.3	Very high	86 Å²	86	52.3 Å²	52.3	37%	0.374	28%	0.281	S	S	.	.	H	α-helix	trans	-59.4	-42.2	179.8	-61.2	-176.8	-165.5	159.9	0	112	I56 G324 D325 Y326 S332	I56-K328 HydrophobicContact CD1-CB 4.21Å; G324-K328 PolarHBondContact O-N 3.41Å; D325-K328 PolarHBondContact O-N 3.34Å; D325-K328 WeakPolarHBondContact OD1-CE 3.41Å; D325-K328 IonicContact OD1-NZ 3.98Å; D325-K328 PolarHBondContact OD1-NZ 3.4Å; Y326-K328 VanDerWaalsContact C-N 3.31Å; Y326-K328 PolarHBondContact O-N 3.11Å; K328-S332 WeakPolarHBondContact O-CB 3.31Å; K328-S332 PolarHBondContact O-N 3.36Å
329	A	98.6	Very high	94.1	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.2	-45.6	176.6	0	0	0	0	0	112	I56 T60 L94 V97 D325 Y326 Q327 S332 L333	I56-A329 HydrophobicContact CD1-CB 4.38Å; I56-A329 HydrophobicContact CG1-CB 4.21Å; I56-A329 HydrophobicContact CG2-CB 4.32Å; T60-A329 HydrophobicContact CG2-CB 4.31Å; L94-A329 HydrophobicContact CD1-CB 3.97Å; V97-A329 HydrophobicContact CG1-CB 4.12Å; D325-A329 WeakPolarHBondContact O-CB 3.39Å; D325-A329 PolarHBondContact O-N 3.36Å; Y326-A329 PolarHBondContact O-N 3.23Å; Q327-A329 VanDerWaalsContact C-N 3.31Å; Q327-A329 PolarHBondContact O-N 2.78Å; A329-S332 PolarHBondContact O-N 3.06Å; A329-L333 WeakPolarHBondContact O-CG 3.24Å; A329-L333 PolarHBondContact O-N 3.23Å
330	M	98.4	Very high	94	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.6	-46.1	177.7	-65.1	-57.5	89.6	0	0	111.9	V97 V287 I291 I318 Y326 Q327 S332 L333 C334	V97-M330 HydrophobicContact CB-CE 3.95Å; V97-M330 HydrophobicContact CG1-CE 3.37Å; V97-M330 HydrophobicContact CG2-CE 3.24Å; V97-M330 HydrophobicContact CG2-SD 4.42Å; V287-M330 HydrophobicContact CG1-SD 4.35Å; I291-M330 HydrophobicContact CB-SD 4.13Å; I291-M330 HydrophobicContact CD1-CB 4.19Å; I291-M330 HydrophobicContact CD1-CG 4.33Å; I291-M330 HydrophobicContact CD1-SD 3.67Å; I291-M330 HydrophobicContact CG1-SD 4.46Å; I291-M330 HydrophobicContact CG2-CE 4.47Å; I291-M330 HydrophobicContact CG2-SD 4.11Å; I318-M330 HydrophobicContact CD1-CB 4.27Å; I318-M330 HydrophobicContact CG2-CB 3.84Å; Y326-M330 HydrophobicContact CD1-CG 4.46Å; Y326-M330 HydrophobicContact CD2-CE 4.41Å; Y326-M330 HydrophobicContact CD2-CG 4.21Å; Y326-M330 HydrophobicContact CE1-CG 4.01Å; Y326-M330 HydrophobicContact CE2-CE 3.94Å; Y326-M330 HydrophobicContact CE2-CG 3.73Å; Y326-M330 HydrophobicContact CE2-SD 3.75Å; Y326-M330 WeakPolarHBondContact O-CG 3.22Å; Y326-M330 PolarHBondContact O-N 3.14Å; Q327-M330 PolarHBondContact O-N 3.17Å; M330-S332 PolarHBondContact O-N 3.41Å; M330-L333 HydrophobicContact CE-CD1 3.89Å; M330-L333 PolarHBondContact O-N 3.48Å; M330-C334 PolarHBondContact O-N 2.89Å; M330-C334 PolarHBondContact O-SG 2.78Å; M330-C334 VanDerWaalsContact O-SG 3.41Å
331	L	98.4	Very high	94	Very high	45 Å²	45	51.3 Å²	51.3	24%	0.236	28%	0.276	C	S	.	.	H	α-helix	trans	-62.7	-41.8	177.4	-68.1	176.6	0	0	0	112	Q315 I318 Q327 L333 C334 G335	Q315-L331 HydrophobicContact CB-CD2 3.86Å; Q315-L331 HydrophobicContact CG-CD2 4.25Å; Q315-L331 VanDerWaalsContact O-CD2 3.31Å; Q315-L331 WeakPolarHBondContact O-CD2 3.25Å; I318-L331 HydrophobicContact CB-CD2 4.01Å; I318-L331 HydrophobicContact CG2-CD2 3.76Å; I318-L331 HydrophobicContact CG2-CG 3.97Å; Q327-L331 HydrophobicContact CG-CD1 3.81Å; Q327-L331 HydrophobicContact CG-CG 4.22Å; Q327-L331 WeakPolarHBondContact O-CB 2.9Å; Q327-L331 VanDerWaalsContact O-CG 3.29Å; Q327-L331 WeakPolarHBondContact O-CG 3.5Å; Q327-L331 PolarHBondContact O-N 2.99Å; L331-L333 VanDerWaalsContact C-N 3.33Å; L331-L333 PolarHBondContact O-N 2.93Å; L331-C334 PolarHBondContact O-N 2.95Å; L331-G335 PolarHBondContact O-N 3.12Å
332	S	98.4	Very high	93.9	Very high	30 Å²	30	50.5 Å²	50.5	21%	0.21	28%	0.275	C	S	.	.	H	α-helix	trans	-62.4	-40.7	176.8	-167.9	0	0	0	0	111.7	T60 K61 K328 A329 M330 G335	T60-S332 VanDerWaalsContact OG1-CB 3.26Å; T60-S332 WeakPolarHBondContact OG1-CB 3.49Å; T60-S332 PolarHBondContact OG1-OG 3.09Å; K61-S332 WeakPolarHBondContact CE-OG 3.46Å; K328-S332 WeakPolarHBondContact O-CB 3.31Å; K328-S332 PolarHBondContact O-N 3.36Å; A329-S332 PolarHBondContact O-N 3.06Å; M330-S332 PolarHBondContact O-N 3.41Å; S332-G335 PolarHBondContact O-N 3.06Å
333	L	98.6	Very high	93.8	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-69	-34	176.3	-69.9	173.4	0	0	0	113.3	T25 V26 T60 V97 L101 I291 C295 L299 A329 M330 L331 G335	T25-L333 WeakPolarHBondContact CB-O 3.39Å; T25-L333 PolarHBondContact OG1-O 3.47Å; V26-L333 HydrophobicContact CG2-CD2 3.8Å; T60-L333 HydrophobicContact CG2-CD2 4.09Å; T60-L333 HydrophobicContact CG2-CG 4.01Å; V97-L333 HydrophobicContact CG1-CD1 4.06Å; L101-L333 HydrophobicContact CD1-CD1 4.2Å; L101-L333 HydrophobicContact CD1-CD2 4.06Å; L101-L333 HydrophobicContact CD2-CD1 4.02Å; L101-L333 HydrophobicContact CD2-CD2 3.79Å; I291-L333 HydrophobicContact CG2-CB 3.58Å; I291-L333 HydrophobicContact CG2-CD1 3.67Å; I291-L333 HydrophobicContact CG2-CG 4.28Å; C295-L333 HydrophobicContact CB-CD2 4.28Å; L299-L333 WeakPolarHBondContact CD2-O 3.4Å; A329-L333 WeakPolarHBondContact O-CG 3.24Å; A329-L333 PolarHBondContact O-N 3.23Å; M330-L333 HydrophobicContact CE-CD1 3.89Å; M330-L333 PolarHBondContact O-N 3.48Å; L331-L333 VanDerWaalsContact C-N 3.33Å; L331-L333 PolarHBondContact O-N 2.93Å; L333-G335 PolarHBondContact O-N 2.68Å
334	C	97.6	Very high	93.6	Very high	4 Å²	4	44.8 Å²	44.8	3%	0.027	26%	0.256	C	S	.	.	H	α-helix	trans	-69.3	-19.1	174.2	-72.4	0	0	0	0	113	T25 Q315 I318 M330 L331	T25-C334 WeakPolarHBondContact CG2-O 3.37Å; Q315-C334 HydrophobicContact CG-CB 3.92Å; I318-C334 VanDerWaalsContact CD1-SG 3.53Å; M330-C334 PolarHBondContact O-N 2.89Å; M330-C334 PolarHBondContact O-SG 2.78Å; M330-C334 VanDerWaalsContact O-SG 3.41Å; L331-C334 PolarHBondContact O-N 2.95Å
335	G	92.9	Very high	93.4	Very high	20 Å²	20	44.9 Å²	44.9	21%	0.206	24%	0.242	C	C	.	.			trans	70.1	-174.9	-173.8	0	0	0	0	0	112.7	Q315 L331 S332 L333	Q315-G335 PolarHBondContact NE2-O 2.73Å; L331-G335 PolarHBondContact O-N 3.12Å; S332-G335 PolarHBondContact O-N 3.06Å; L333-G335 PolarHBondContact O-N 2.68Å
336	P	89.1	Confident	93	Very high	100 Å²	100	44.7 Å²	44.7	65%	0.649	24%	0.241	S	C	*	.	S	Bend	trans	-61.6	146.7	-178.1	27.1	-34.3	0	0	0	111.4	Q315 Q338	Q315-P336 PolarHBondContact NE2-O 3.17Å; P336-Q338 PolarHBondContact O-N 3.36Å
337	D	82.7	Confident	92.6	Very high	86 Å²	86	47.5 Å²	47.5	46%	0.46	26%	0.258	S	S	.	.			trans	-65.5	125.1	170.6	-163	-13.4	0	0	0	108.8	K307 S313	K307-D337 IonicContact NZ-OD1 3.72Å; S313-D337 VanDerWaalsContact CB-CG 3.49Å; S313-D337 WeakPolarHBondContact CB-OD1 3.31Å; S313-D337 WeakPolarHBondContact CB-OD2 3.36Å; S313-D337 PolarHBondContact OG-OD2 3.08Å
338	Q	59.7	Low	92.1	Very high	159 Å²	159	48.2 Å²	48.2	74%	0.743	26%	0.264	S	S	*	.			trans	-113.5	0	-176.2	-69.5	-173.1	-0.3	0	0	110.5	K307 P336	K307-Q338 PolarHBondContact NZ-O 3.49Å; P336-Q338 PolarHBondContact O-N 3.36Å

Retrieved 338 of 338 residues in 71.4 ms (Link to these results)

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