A0A096MJJ6_RAT Loading...

Acyl-CoA-binding domain-containing protein 5

Acyl-CoA binding protein which acts as the peroxisome receptor for pexophagy but is dispensable for aggrephagy and nonselective autophagy. Binds medium- and long-chain acyl-CoA esters.

AlphaFold DB , UniProt , Accession A0A096MJJ6, Species RAT (Rattus norvegicus, Rat), Gene Acbd5, Length 470 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.5	Very low	72.9	Confident	230 Å²	230	89.4 Å²	89.4	100%	1.133	48%	0.477	S	S	*	.				0	28.6	0	-67.5	-179.4	165.4	0	0	111.2
2	A	52.3	Low	74.4	Confident	76 Å²	76	83 Å²	83	63%	0.628	44%	0.442	S	S	*	.			trans	-92.8	-25.8	178.5	0	0	0	0	0	111.7
3	D	59.2	Low	75.5	Confident	115 Å²	115	84.5 Å²	84.5	62%	0.615	44%	0.444	S	S	*	.	H	α-helix	trans	-86.7	-19.4	-154.9	-36.2	-86.6	0	0	0	112.7	R5 S6 V7	D3-R5 VanDerWaalsContact C-N 3.34Å; D3-R5 PolarHBondContact O-N 2.68Å; D3-S6 PolarHBondContact O-OG 2.92Å; D3-S6 VanDerWaalsContact O-OG 3.11Å; D3-V7 WeakPolarHBondContact O-CG2 3.05Å; D3-V7 PolarHBondContact O-N 3.35Å
4	T	64.1	Low	76.3	Confident	63 Å²	63	79.9 Å²	79.9	39%	0.387	43%	0.425	S	S	.	.	H	α-helix	trans	-68.2	-33.9	178.3	45.1	0	0	0	0	112.5	V7 Y8	T4-V7 PolarHBondContact O-N 3.3Å; T4-Y8 WeakPolarHBondContact O-CD2 3.47Å; T4-Y8 PolarHBondContact O-N 3.43Å; T4-Y8 VanDerWaalsContact O-N 3.16Å
5	R	66.9	Low	77	Confident	126 Å²	126	74.5 Å²	74.5	48%	0.475	40%	0.396	S	S	.	.	H	α-helix	trans	-65.2	-47.9	-177.1	-175.9	176.6	177.1	123.9	-6.7	111.9	D3 V7 Y8 E9 E78	D3-R5 VanDerWaalsContact C-N 3.34Å; D3-R5 PolarHBondContact O-N 2.68Å; R5-V7 VanDerWaalsContact C-N 3.27Å; R5-V7 PolarHBondContact O-N 3.41Å; R5-Y8 PolarHBondContact O-N 3.02Å; R5-E9 WeakPolarHBondContact O-CB 3.5Å; R5-E9 PolarHBondContact O-N 3.32Å; R5-E78 VanDerWaalsContact CD-OE1 3.28Å; R5-E78 WeakPolarHBondContact CD-OE1 3.33Å; R5-E78 HydrophobicContact CG-CG 4.29Å; R5-E78 IonicContact CZ-OE1 3.72Å; R5-E78 IonicContact NE-OE1 2.71Å; R5-E78 IonicContact NH1-OE1 3.41Å; R5-E78 PolarHBondContact NH1-OE1 3.05Å
6	S	78.4	Confident	77.7	Confident	63 Å²	63	70.8 Å²	70.8	44%	0.441	38%	0.377	S	S	.	.	H	α-helix	trans	-65.1	-30.5	177.5	54.1	0	0	0	0	112.7	D3 T10	D3-S6 PolarHBondContact O-OG 2.92Å; D3-S6 VanDerWaalsContact O-OG 3.11Å; S6-T10 VanDerWaalsContact O-CB 3.31Å; S6-T10 WeakPolarHBondContact O-CB 3.45Å; S6-T10 PolarHBondContact O-N 2.91Å; S6-T10 PolarHBondContact O-OG1 3.01Å
7	V	84.1	Confident	78.2	Confident	62 Å²	62	73.3 Å²	73.3	38%	0.376	38%	0.384	S	S	.	.	H	α-helix	trans	-65.8	-44.7	173.7	171.4	0	0	0	0	111.2	D3 T4 R5 R11	D3-V7 WeakPolarHBondContact O-CG2 3.05Å; D3-V7 PolarHBondContact O-N 3.35Å; T4-V7 PolarHBondContact O-N 3.3Å; R5-V7 VanDerWaalsContact C-N 3.27Å; R5-V7 PolarHBondContact O-N 3.41Å; V7-R11 VanDerWaalsContact CG1-NE 3.3Å; V7-R11 WeakPolarHBondContact O-CB 3.23Å; V7-R11 VanDerWaalsContact O-CD 3.31Å; V7-R11 WeakPolarHBondContact O-CD 3.37Å; V7-R11 WeakPolarHBondContact O-CG 3.2Å; V7-R11 PolarHBondContact O-N 2.87Å; V7-R11 VanDerWaalsContact O-N 3.12Å
8	Y	86.4	Confident	78.3	Confident	64 Å²	64	69.8 Å²	69.8	25%	0.251	37%	0.366	S	S	.	.	H	α-helix	trans	-67.7	-40.1	176.1	-62	-55.5	0	0	0	112.4	T4 R5 R11 F12 I82	T4-Y8 WeakPolarHBondContact O-CD2 3.47Å; T4-Y8 PolarHBondContact O-N 3.43Å; T4-Y8 VanDerWaalsContact O-N 3.16Å; R5-Y8 PolarHBondContact O-N 3.02Å; Y8-R11 PolarHBondContact O-N 3.49Å; Y8-F12 VanDerWaalsContact O-CB 3.32Å; Y8-F12 WeakPolarHBondContact O-CB 3.43Å; Y8-F12 PolarHBondContact O-N 3.4Å; Y8-I82 HydrophobicContact CD1-CD1 4.04Å; Y8-I82 HydrophobicContact CD1-CG1 3.49Å; Y8-I82 VanDerWaalsContact CD1-CG1 3.49Å; Y8-I82 HydrophobicContact CD2-CD1 4.09Å; Y8-I82 HydrophobicContact CD2-CG1 4.28Å; Y8-I82 HydrophobicContact CE1-CD1 3.87Å; Y8-I82 HydrophobicContact CE1-CG1 3.67Å; Y8-I82 HydrophobicContact CE2-CD1 3.95Å; Y8-I82 HydrophobicContact CE2-CG1 4.46Å; Y8-I82 HydrophobicContact CG-CD1 4.16Å; Y8-I82 HydrophobicContact CG-CG1 3.83Å
9	E	88.5	Confident	78.6	Confident	83 Å²	83	68.3 Å²	68.3	39%	0.388	36%	0.358	S	S	.	.	H	α-helix	trans	-63.4	-45	177.4	-166.7	158.4	-141.1	0	0	111.8	R5 R11 F12 E13 M81	R5-E9 WeakPolarHBondContact O-CB 3.5Å; R5-E9 PolarHBondContact O-N 3.32Å; E9-R11 PolarHBondContact O-N 3.33Å; E9-F12 PolarHBondContact O-N 3.12Å; E9-E13 PolarHBondContact O-N 2.95Å; E9-M81 HydrophobicContact CB-CE 4.45Å; E9-M81 HydrophobicContact CB-SD 4.18Å; E9-M81 HydrophobicContact CG-CE 4.05Å; E9-M81 HydrophobicContact CG-SD 4.43Å
10	T	87.8	Confident	78.7	Confident	72 Å²	72	71.3 Å²	71.3	44%	0.442	37%	0.37	S	S	.	.	H	α-helix	trans	-61.1	-43.8	174.5	-54.8	0	0	0	0	112.2	S6 E13 A14 I114	S6-T10 VanDerWaalsContact O-CB 3.31Å; S6-T10 WeakPolarHBondContact O-CB 3.45Å; S6-T10 PolarHBondContact O-N 2.91Å; S6-T10 PolarHBondContact O-OG1 3.01Å; T10-E13 PolarHBondContact O-N 3.27Å; T10-A14 PolarHBondContact O-N 2.72Å; T10-I114 HydrophobicContact CG2-CG2 4.15Å
11	R	86.4	Confident	78.7	Confident	29 Å²	29	71.1 Å²	71.1	11%	0.109	38%	0.375	C	S	.	.	H	α-helix	trans	-66	-40.5	178.1	-71.6	165.8	-178.5	-145.9	-4.8	111.9	V7 Y8 E9 A14 A15 V85 I114 V115	V7-R11 VanDerWaalsContact CG1-NE 3.3Å; V7-R11 WeakPolarHBondContact O-CB 3.23Å; V7-R11 VanDerWaalsContact O-CD 3.31Å; V7-R11 WeakPolarHBondContact O-CD 3.37Å; V7-R11 WeakPolarHBondContact O-CG 3.2Å; V7-R11 PolarHBondContact O-N 2.87Å; V7-R11 VanDerWaalsContact O-N 3.12Å; Y8-R11 PolarHBondContact O-N 3.49Å; E9-R11 PolarHBondContact O-N 3.33Å; R11-A14 PolarHBondContact O-N 3.21Å; R11-A15 WeakPolarHBondContact O-CB 3.23Å; R11-A15 PolarHBondContact O-N 3.49Å; R11-V85 HydrophobicContact CB-CG1 4.49Å; R11-V85 HydrophobicContact CB-CG2 3.97Å; R11-I114 HydrophobicContact CG-CG2 3.82Å; R11-I114 PolarHBondContact NE-O 2.76Å; R11-I114 PolarHBondContact NH2-O 3.5Å; R11-V115 HydrophobicContact CB-CG2 4.4Å; R11-V115 HydrophobicContact CG-CG2 3.89Å; R11-V115 VanDerWaalsContact CZ-CA 3.44Å; R11-V115 PolarHBondContact NH1-O 3.3Å; R11-V115 VanDerWaalsContact NH2-C 3.28Å; R11-V115 PolarHBondContact NH2-O 2.94Å
12	F	91.3	Very high	80	Confident	13 Å²	13	62 Å²	62	6%	0.057	33%	0.331	C	S	.	.	H	α-helix	trans	-64.1	-46.6	175.1	171.9	-103.4	0	0	0	111.6	Y8 E9 A14 A15 V16 Y42 A45 T46 M81 Y84 V85	Y8-F12 VanDerWaalsContact O-CB 3.32Å; Y8-F12 WeakPolarHBondContact O-CB 3.43Å; Y8-F12 PolarHBondContact O-N 3.4Å; E9-F12 PolarHBondContact O-N 3.12Å; F12-A14 VanDerWaalsContact C-N 3.31Å; F12-A14 PolarHBondContact O-N 2.87Å; F12-A15 PolarHBondContact O-N 3.46Å; F12-V16 HydrophobicContact CD1-CG2 4.35Å; F12-V16 HydrophobicContact CD2-CG2 4.16Å; F12-V16 HydrophobicContact CE1-CG2 4.02Å; F12-V16 HydrophobicContact CE2-CG2 3.81Å; F12-V16 HydrophobicContact CG-CG2 4.42Å; F12-V16 HydrophobicContact CZ-CG2 3.74Å; F12-V16 WeakPolarHBondContact O-CB 3.45Å; F12-V16 VanDerWaalsContact O-CG2 3.31Å; F12-V16 WeakPolarHBondContact O-CG2 3.36Å; F12-V16 PolarHBondContact O-N 3.34Å; F12-Y42 HydrophobicContact CE2-CD2 4.4Å; F12-Y42 AromaticContact CZ-CD2 3.7Å; F12-Y42 HydrophobicContact CZ-CD2 3.7Å; F12-Y42 HydrophobicContact CZ-CE2 4.27Å; F12-A45 HydrophobicContact CE1-CB 4.12Å; F12-A45 HydrophobicContact CE2-CB 3.87Å; F12-A45 HydrophobicContact CZ-CB 3.61Å; F12-T46 HydrophobicContact CE1-CG2 4.48Å; F12-T46 HydrophobicContact CZ-CG2 4.48Å; F12-M81 HydrophobicContact CB-CB 3.95Å; F12-M81 HydrophobicContact CB-CG 3.86Å; F12-M81 HydrophobicContact CD1-CE 4.13Å; F12-M81 HydrophobicContact CD1-CG 4Å; F12-M81 HydrophobicContact CD2-CB 4.27Å; F12-M81 HydrophobicContact CD2-CG 4.03Å; F12-M81 HydrophobicContact CE1-CE 4.48Å; F12-M81 HydrophobicContact CG-CB 4.15Å; F12-M81 HydrophobicContact CG-CG 3.7Å; F12-Y84 AromaticContact CD2-CD1 3.8Å; F12-Y84 HydrophobicContact CD2-CD1 3.8Å; F12-Y84 HydrophobicContact CD2-CD2 4.43Å; F12-Y84 HydrophobicContact CD2-CE1 4.44Å; F12-Y84 AromaticContact CD2-CG 3.8Å; F12-Y84 HydrophobicContact CD2-CG 3.8Å; F12-Y84 HydrophobicContact CE2-CD1 4Å; F12-Y84 AromaticContact CE2-CD2 3.88Å; F12-Y84 HydrophobicContact CE2-CD2 3.88Å; F12-Y84 HydrophobicContact CE2-CE1 4.43Å; F12-Y84 HydrophobicContact CE2-CE2 4.34Å; F12-Y84 AromaticContact CE2-CG 3.71Å; F12-Y84 HydrophobicContact CE2-CG 3.71Å; F12-V85 HydrophobicContact CB-CG2 4.48Å
13	E	89.3	Confident	80.9	Confident	102 Å²	102	62.8 Å²	62.8	48%	0.477	33%	0.329	S	S	.	.	H	α-helix	trans	-57.2	-43.4	174.3	-88.6	-160	-148.2	0	0	112.6	E9 T10 V16 K17	E9-E13 PolarHBondContact O-N 2.95Å; T10-E13 PolarHBondContact O-N 3.27Å; E13-V16 PolarHBondContact O-N 3.24Å; E13-K17 WeakPolarHBondContact O-CB 3.31Å; E13-K17 WeakPolarHBondContact O-CD 3.17Å; E13-K17 VanDerWaalsContact O-CG 3.22Å; E13-K17 WeakPolarHBondContact O-CG 3.31Å; E13-K17 PolarHBondContact O-N 2.75Å; E13-K17 IonicContact OE2-NZ 3.53Å; E13-K17 PolarHBondContact OE2-NZ 3.19Å
14	A	86	Confident	81.3	Confident	20 Å²	20	64.5 Å²	64.5	17%	0.165	33%	0.331	C	S	.	.	H	α-helix	trans	-64.8	-43.3	177.2	0	0	0	0	0	111.7	T10 R11 F12 K17 V18 F111	T10-A14 PolarHBondContact O-N 2.72Å; R11-A14 PolarHBondContact O-N 3.21Å; F12-A14 VanDerWaalsContact C-N 3.31Å; F12-A14 PolarHBondContact O-N 2.87Å; A14-K17 PolarHBondContact O-N 3.38Å; A14-V18 WeakPolarHBondContact O-CG2 3.49Å; A14-V18 PolarHBondContact O-N 3.17Å; A14-F111 HydrophobicContact CB-CB 4.23Å; A14-F111 HydrophobicContact CB-CD2 3.99Å
15	A	86.6	Confident	81.1	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-62.8	-41.7	175.1	0	0	0	0	0	113	R11 F12 K17 V18 I19 Y84 V85 M88 F111	R11-A15 WeakPolarHBondContact O-CB 3.23Å; R11-A15 PolarHBondContact O-N 3.49Å; F12-A15 PolarHBondContact O-N 3.46Å; A15-K17 VanDerWaalsContact C-N 3.35Å; A15-V18 WeakPolarHBondContact O-CB 3.46Å; A15-V18 PolarHBondContact O-N 3.35Å; A15-I19 PolarHBondContact O-N 3.44Å; A15-Y84 HydrophobicContact CB-CD1 3.8Å; A15-Y84 HydrophobicContact CB-CE1 3.67Å; A15-V85 HydrophobicContact CB-CG2 4.34Å; A15-M88 HydrophobicContact CB-CE 3.58Å; A15-M88 HydrophobicContact CB-SD 3.8Å; A15-F111 HydrophobicContact CB-CD2 4.16Å; A15-F111 HydrophobicContact CB-CE2 3.77Å; A15-F111 HydrophobicContact CB-CZ 4.49Å
16	V	88.5	Confident	80.9	Confident	14 Å²	14	63.5 Å²	63.5	9%	0.085	34%	0.338	C	S	.	.	H	α-helix	trans	-62.8	-42.4	175.7	169.3	0	0	0	0	110.7	F12 E13 I19 Q20 Y42 Y84	F12-V16 HydrophobicContact CD1-CG2 4.35Å; F12-V16 HydrophobicContact CD2-CG2 4.16Å; F12-V16 HydrophobicContact CE1-CG2 4.02Å; F12-V16 HydrophobicContact CE2-CG2 3.81Å; F12-V16 HydrophobicContact CG-CG2 4.42Å; F12-V16 HydrophobicContact CZ-CG2 3.74Å; F12-V16 WeakPolarHBondContact O-CB 3.45Å; F12-V16 VanDerWaalsContact O-CG2 3.31Å; F12-V16 WeakPolarHBondContact O-CG2 3.36Å; F12-V16 PolarHBondContact O-N 3.34Å; E13-V16 PolarHBondContact O-N 3.24Å; V16-I19 PolarHBondContact O-N 3.25Å; V16-Q20 HydrophobicContact CG1-CG 4.36Å; V16-Q20 WeakPolarHBondContact O-CB 3.43Å; V16-Q20 VanDerWaalsContact O-CG 3.23Å; V16-Q20 WeakPolarHBondContact O-CG 3.34Å; V16-Q20 PolarHBondContact O-N 3.11Å; V16-Y42 HydrophobicContact CG1-CE2 4.11Å; V16-Y42 HydrophobicContact CG2-CD2 3.92Å; V16-Y42 HydrophobicContact CG2-CE2 4.16Å; V16-Y84 HydrophobicContact CG2-CD1 4.5Å; V16-Y84 HydrophobicContact CG2-CE1 3.72Å; V16-Y84 HydrophobicContact CG2-CE2 4.41Å
17	K	85.5	Confident	79.9	Confident	114 Å²	114	64.3 Å²	64.3	50%	0.496	34%	0.344	S	S	.	.	H	α-helix	trans	-63.3	-43.5	175.8	-71.1	160.4	-166.1	163.7	0	111.7	E13 A14 A15 Q20 S21	E13-K17 WeakPolarHBondContact O-CB 3.31Å; E13-K17 WeakPolarHBondContact O-CD 3.17Å; E13-K17 VanDerWaalsContact O-CG 3.22Å; E13-K17 WeakPolarHBondContact O-CG 3.31Å; E13-K17 PolarHBondContact O-N 2.75Å; E13-K17 IonicContact OE2-NZ 3.53Å; E13-K17 PolarHBondContact OE2-NZ 3.19Å; A14-K17 PolarHBondContact O-N 3.38Å; A15-K17 VanDerWaalsContact C-N 3.35Å; K17-Q20 PolarHBondContact O-N 3.38Å; K17-S21 WeakPolarHBondContact O-CB 3.34Å; K17-S21 PolarHBondContact O-N 3.49Å; K17-S21 PolarHBondContact O-OG 3.42Å
18	V	81.4	Confident	79	Confident	10 Å²	10	63.9 Å²	63.9	6%	0.061	34%	0.337	C	S	.	.	H	α-helix	trans	-55	-56.9	172.2	165.7	0	0	0	0	110.3	A14 A15 Q20 S21 L22 M88 I108 F111	A14-V18 WeakPolarHBondContact O-CG2 3.49Å; A14-V18 PolarHBondContact O-N 3.17Å; A15-V18 WeakPolarHBondContact O-CB 3.46Å; A15-V18 PolarHBondContact O-N 3.35Å; V18-Q20 VanDerWaalsContact C-N 3.3Å; V18-Q20 PolarHBondContact O-N 3.49Å; V18-S21 PolarHBondContact O-N 2.66Å; V18-S21 PolarHBondContact O-OG 2.91Å; V18-L22 WeakPolarHBondContact O-CG 3.22Å; V18-L22 PolarHBondContact O-N 3.34Å; V18-M88 HydrophobicContact CB-CE 4.49Å; V18-M88 HydrophobicContact CB-SD 4.14Å; V18-M88 HydrophobicContact CG1-CE 4.42Å; V18-M88 HydrophobicContact CG1-SD 3.85Å; V18-I108 HydrophobicContact CB-CG1 4.49Å; V18-I108 HydrophobicContact CG1-CD1 3.97Å; V18-I108 HydrophobicContact CG1-CG1 3.56Å; V18-I108 HydrophobicContact CG2-CG1 4.04Å; V18-F111 HydrophobicContact CG2-CB 4.46Å
19	I	82.9	Confident	78.2	Confident	42 Å²	42	67.5 Å²	67.5	22%	0.215	36%	0.356	C	S	.	.	H	α-helix	trans	-64.3	-33.3	-175	-73.8	162.7	0	0	0	112.3	A15 V16 F38 Y84 M88	A15-I19 PolarHBondContact O-N 3.44Å; V16-I19 PolarHBondContact O-N 3.25Å; I19-F38 HydrophobicContact CD1-CD1 3.66Å; I19-F38 HydrophobicContact CD1-CD2 4.1Å; I19-F38 HydrophobicContact CD1-CE1 3.43Å; I19-F38 VanDerWaalsContact CD1-CE1 3.43Å; I19-F38 HydrophobicContact CD1-CE2 3.86Å; I19-F38 HydrophobicContact CD1-CG 4Å; I19-F38 HydrophobicContact CD1-CZ 3.51Å; I19-F38 HydrophobicContact CG1-CZ 4.49Å; I19-Y84 HydrophobicContact CD1-CE1 3.68Å; I19-Y84 WeakPolarHBondContact CD1-OH 3.24Å; I19-M88 HydrophobicContact CD1-CB 4.4Å; I19-M88 HydrophobicContact CD1-CG 4.01Å; I19-M88 HydrophobicContact CD1-SD 3.64Å; I19-M88 HydrophobicContact CG1-CG 4.46Å; I19-M88 HydrophobicContact CG1-SD 3.81Å
20	Q	81.9	Confident	77.6	Confident	127 Å²	127	65.3 Å²	65.3	59%	0.593	35%	0.349	S	S	*	.	H	α-helix	trans	-71.9	-28.1	172.7	-73	175.3	-1.1	0	0	113.6	V16 K17 V18	V16-Q20 HydrophobicContact CG1-CG 4.36Å; V16-Q20 WeakPolarHBondContact O-CB 3.43Å; V16-Q20 VanDerWaalsContact O-CG 3.23Å; V16-Q20 WeakPolarHBondContact O-CG 3.34Å; V16-Q20 PolarHBondContact O-N 3.11Å; K17-Q20 PolarHBondContact O-N 3.38Å; V18-Q20 VanDerWaalsContact C-N 3.3Å; V18-Q20 PolarHBondContact O-N 3.49Å
21	S	78	Confident	77.5	Confident	69 Å²	69	65.4 Å²	65.4	48%	0.483	35%	0.35	S	S	.	.	H	α-helix	trans	-81.6	-11.2	178.2	72.4	0	0	0	0	114.3	K17 V18	K17-S21 WeakPolarHBondContact O-CB 3.34Å; K17-S21 PolarHBondContact O-N 3.49Å; K17-S21 PolarHBondContact O-OG 3.42Å; V18-S21 PolarHBondContact O-N 2.66Å; V18-S21 PolarHBondContact O-OG 2.91Å
22	L	74	Confident	77.6	Confident	38 Å²	38	67.7 Å²	67.7	20%	0.199	36%	0.364	C	S	.	.	S	Bend	trans	-62.4	127.9	-179	-62.9	-177.7	0	0	0	111	V18 K24 L104	V18-L22 WeakPolarHBondContact O-CG 3.22Å; V18-L22 PolarHBondContact O-N 3.34Å; L22-K24 PolarHBondContact O-N 3.48Å; L22-L104 HydrophobicContact CD2-CD1 3.5Å
23	P	72.2	Confident	77.5	Confident	92 Å²	92	73.2 Å²	73.2	60%	0.597	39%	0.39	S	S	*	.			trans	-66.8	118	177.4	25.9	-32.5	0	0	0	109.9	N25 G26	P23-N25 PolarHBondContact O-N 2.68Å; P23-N25 VanDerWaalsContact O-N 3.13Å; P23-G26 WeakPolarHBondContact O-CA 3.41Å; P23-G26 PolarHBondContact O-N 2.9Å
24	K	66.8	Low	77.5	Confident	151 Å²	151	69.9 Å²	69.9	66%	0.657	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-36.6	-178.5	-60.1	-177.2	179.9	-176.3	0	113.3	L22	L22-K24 PolarHBondContact O-N 3.48Å
25	N	60.6	Low	77.6	Confident	146 Å²	146	72.4 Å²	72.4	78%	0.781	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	18.1	-179.6	-56.6	20.7	0	0	0	111.7	P23	P23-N25 PolarHBondContact O-N 2.68Å; P23-N25 VanDerWaalsContact O-N 3.13Å
26	G	62.2	Low	78	Confident	22 Å²	22	73.8 Å²	73.8	23%	0.227	39%	0.392	C	S	.	.	S	Bend	trans	-70.1	170.2	177.5	0	0	0	0	0	112.5	P23 F28	P23-G26 WeakPolarHBondContact O-CA 3.41Å; P23-G26 PolarHBondContact O-N 2.9Å; G26-F28 PolarHBondContact O-N 3.12Å
27	S	58.5	Low	78.2	Confident	81 Å²	81	77.3 Å²	77.3	57%	0.566	40%	0.403	S	S	*	.	S	Bend	trans	-70.3	3.8	175.3	52.9	0	0	0	0	114.7	K100	S27-K100 WeakPolarHBondContact OG-CB 3.5Å; S27-K100 WeakPolarHBondContact OG-CD 3.49Å; S27-K100 WeakPolarHBondContact OG-CG 3.5Å
28	F	64.7	Low	78.6	Confident	53 Å²	53	72.7 Å²	72.7	23%	0.232	38%	0.383	C	S	.	.			trans	-129.6	115.3	171.7	177	-114.4	0	0	0	108.9	G26 P30 M34 I91 M95	G26-F28 PolarHBondContact O-N 3.12Å; F28-P30 HydrophobicContact CD1-CG 4.47Å; F28-P30 HydrophobicContact CE1-CG 3.96Å; F28-P30 HydrophobicContact CZ-CG 4.47Å; F28-M34 HydrophobicContact CE2-CE 4.31Å; F28-M34 HydrophobicContact CZ-CE 3.71Å; F28-I91 HydrophobicContact CE1-CG2 4.39Å; F28-I91 HydrophobicContact CZ-CG2 3.73Å; F28-M95 HydrophobicContact CB-CE 3.66Å; F28-M95 HydrophobicContact CD2-CE 3.48Å; F28-M95 VanDerWaalsContact CD2-CE 3.48Å; F28-M95 HydrophobicContact CD2-SD 3.91Å; F28-M95 HydrophobicContact CE2-CE 4.23Å; F28-M95 HydrophobicContact CE2-SD 4.09Å; F28-M95 HydrophobicContact CG-CE 3.64Å; F28-M95 HydrophobicContact CG-SD 4.16Å
29	Q	69.1	Low	79.3	Confident	139 Å²	139	74.5 Å²	74.5	65%	0.65	39%	0.389	S	S	*	.			trans	-112.5	116.3	172.4	-66.8	177.7	0.2	0	0	107.2	T31	Q29-T31 PolarHBondContact O-N 3.34Å
30	P	76	Confident	79.9	Confident	37 Å²	37	72.7 Å²	72.7	24%	0.24	38%	0.381	C	S	.	.			trans	-57.5	138.1	174	-24.8	34.8	0	0	0	110.6	F28 M34 M35	F28-P30 HydrophobicContact CD1-CG 4.47Å; F28-P30 HydrophobicContact CE1-CG 3.96Å; F28-P30 HydrophobicContact CZ-CG 4.47Å; P30-M34 HydrophobicContact CB-CB 4.31Å; P30-M34 HydrophobicContact CB-CE 4.01Å; P30-M35 HydrophobicContact CB-CG 3.9Å
31	T	85.9	Confident	80.6	Confident	75 Å²	75	67.9 Å²	67.9	46%	0.46	36%	0.358	S	S	.	.			trans	-64.4	156.4	177	71.2	0	0	0	0	110.8	Q29 E33 M34 M35	Q29-T31 PolarHBondContact O-N 3.34Å; T31-E33 PolarHBondContact O-N 3.01Å; T31-E33 VanDerWaalsContact O-N 3.14Å; T31-M34 HydrophobicContact CG2-SD 3.82Å; T31-M34 WeakPolarHBondContact O-CA 3.23Å; T31-M34 WeakPolarHBondContact O-CB 3.42Å; T31-M34 PolarHBondContact O-N 3.22Å; T31-M34 WeakPolarHBondContact OG1-CG 3.33Å; T31-M34 PolarHBondContact OG1-N 2.94Å; T31-M34 PolarHBondContact OG1-SD 3.31Å; T31-M35 PolarHBondContact O-N 3.37Å
32	N	87.3	Confident	81.5	Confident	76 Å²	76	68.5 Å²	68.5	41%	0.406	35%	0.35	S	S	.	.	H	α-helix	trans	-54.4	-35	178.1	-67.8	-44.5	0	0	0	112.7	M35 L36 M266	N32-M35 VanDerWaalsContact OD1-CE 3.22Å; N32-M35 WeakPolarHBondContact OD1-CE 3.48Å; N32-L36 WeakPolarHBondContact O-CB 3.43Å; N32-L36 VanDerWaalsContact O-CG 3.25Å; N32-L36 WeakPolarHBondContact O-CG 3.24Å; N32-L36 PolarHBondContact O-N 3.06Å; N32-M266 HydrophobicContact CB-CE 4.49Å; N32-M266 WeakPolarHBondContact ND2-CE 3.48Å; N32-M266 WeakPolarHBondContact OD1-CE 3.43Å
33	E	90.1	Very high	82.6	Confident	130 Å²	130	66.8 Å²	66.8	61%	0.607	34%	0.341	S	S	*	.	H	α-helix	trans	-66.1	-43.2	173.7	-65.2	-170.7	-168	0	0	112.8	T31 L36 R37	T31-E33 PolarHBondContact O-N 3.01Å; T31-E33 VanDerWaalsContact O-N 3.14Å; E33-L36 PolarHBondContact O-N 3.48Å; E33-R37 WeakPolarHBondContact O-CG 3.32Å; E33-R37 PolarHBondContact O-N 2.73Å; E33-R37 IonicContact OE2-NH2 2.69Å
34	M	88.8	Confident	83.7	Confident	31 Å²	31	62.4 Å²	62.4	15%	0.153	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-43.4	177	-68.6	152.8	57.4	0	0	110.9	F28 P30 T31 L36 R37 F38 I91	F28-M34 HydrophobicContact CE2-CE 4.31Å; F28-M34 HydrophobicContact CZ-CE 3.71Å; P30-M34 HydrophobicContact CB-CB 4.31Å; P30-M34 HydrophobicContact CB-CE 4.01Å; T31-M34 HydrophobicContact CG2-SD 3.82Å; T31-M34 WeakPolarHBondContact O-CA 3.23Å; T31-M34 WeakPolarHBondContact O-CB 3.42Å; T31-M34 PolarHBondContact O-N 3.22Å; T31-M34 WeakPolarHBondContact OG1-CG 3.33Å; T31-M34 PolarHBondContact OG1-N 2.94Å; T31-M34 PolarHBondContact OG1-SD 3.31Å; M34-L36 VanDerWaalsContact C-N 3.34Å; M34-L36 PolarHBondContact O-N 3.47Å; M34-R37 PolarHBondContact O-N 2.93Å; M34-F38 VanDerWaalsContact O-CD2 3.22Å; M34-F38 WeakPolarHBondContact O-CD2 3.48Å; M34-F38 PolarHBondContact O-N 2.79Å; M34-I91 HydrophobicContact CB-CD1 4.27Å; M34-I91 HydrophobicContact CE-CD1 3.68Å; M34-I91 HydrophobicContact CE-CG1 3.87Å; M34-I91 HydrophobicContact CE-CG2 3.86Å; M34-I91 HydrophobicContact CG-CD1 4.01Å
35	M	89.4	Confident	85.1	Confident	74 Å²	74	55.3 Å²	55.3	37%	0.365	28%	0.282	S	S	.	.	H	α-helix	trans	-60.7	-41.5	174.8	-67.1	-163.7	-76.2	0	0	112.2	P30 T31 N32 F38 Y39	P30-M35 HydrophobicContact CB-CG 3.9Å; T31-M35 PolarHBondContact O-N 3.37Å; N32-M35 VanDerWaalsContact OD1-CE 3.22Å; N32-M35 WeakPolarHBondContact OD1-CE 3.48Å; M35-F38 PolarHBondContact O-N 3.42Å; M35-Y39 WeakPolarHBondContact O-CB 3.18Å; M35-Y39 PolarHBondContact O-N 2.84Å
36	L	93.9	Very high	86.7	Confident	29 Å²	29	50.8 Å²	50.8	15%	0.152	26%	0.26	C	S	.	.	H	α-helix	trans	-67.6	-35.7	177.1	-74.4	168.7	0	0	0	113	N32 E33 M34 S40 K65 A68 F269	N32-L36 WeakPolarHBondContact O-CB 3.43Å; N32-L36 VanDerWaalsContact O-CG 3.25Å; N32-L36 WeakPolarHBondContact O-CG 3.24Å; N32-L36 PolarHBondContact O-N 3.06Å; E33-L36 PolarHBondContact O-N 3.48Å; M34-L36 VanDerWaalsContact C-N 3.34Å; M34-L36 PolarHBondContact O-N 3.47Å; L36-S40 PolarHBondContact O-N 2.97Å; L36-S40 PolarHBondContact O-OG 2.94Å; L36-K65 HydrophobicContact CD2-CG 4.22Å; L36-A68 HydrophobicContact CB-CB 4.14Å; L36-A68 HydrophobicContact CD2-CB 4.34Å; L36-F269 HydrophobicContact CD2-CE1 4Å
37	R	93.6	Very high	88.2	Confident	87 Å²	87	54.3 Å²	54.3	33%	0.328	27%	0.27	S	S	.	.	H	α-helix	trans	-66	-47.5	172.4	-70.6	-179.9	-161.8	-176.9	13	112.2	E33 M34 Y39 S40 F41 E87	E33-R37 WeakPolarHBondContact O-CG 3.32Å; E33-R37 PolarHBondContact O-N 2.73Å; E33-R37 IonicContact OE2-NH2 2.69Å; M34-R37 PolarHBondContact O-N 2.93Å; R37-Y39 VanDerWaalsContact C-N 3.29Å; R37-Y39 PolarHBondContact O-N 2.99Å; R37-S40 PolarHBondContact O-N 3.39Å; R37-S40 PolarHBondContact O-OG 3.34Å; R37-F41 HydrophobicContact CB-CD2 4.43Å; R37-F41 HydrophobicContact CB-CE2 4.18Å; R37-F41 WeakPolarHBondContact O-CD2 3.44Å; R37-F41 WeakPolarHBondContact O-CG 3.2Å; R37-F41 PolarHBondContact O-N 2.95Å; R37-E87 WeakPolarHBondContact CD-OE1 3.3Å; R37-E87 IonicContact CZ-OE1 3.59Å; R37-E87 IonicContact CZ-OE2 3.61Å; R37-E87 IonicContact NE-OE1 2.66Å; R37-E87 IonicContact NH1-OE1 2.7Å; R37-E87 PolarHBondContact NH1-OE1 3.46Å; R37-E87 IonicContact NH1-OE2 3.3Å; R37-E87 PolarHBondContact NH1-OE2 3.11Å
38	F	93.8	Very high	89.9	Confident	18 Å²	18	50.6 Å²	50.6	8%	0.079	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-41.2	176	-73.4	-51.7	0	0	0	111.4	I19 M34 M35 Y42 Y84 E87 M88 I91	I19-F38 HydrophobicContact CD1-CD1 3.66Å; I19-F38 HydrophobicContact CD1-CD2 4.1Å; I19-F38 HydrophobicContact CD1-CE1 3.43Å; I19-F38 VanDerWaalsContact CD1-CE1 3.43Å; I19-F38 HydrophobicContact CD1-CE2 3.86Å; I19-F38 HydrophobicContact CD1-CG 4Å; I19-F38 HydrophobicContact CD1-CZ 3.51Å; I19-F38 HydrophobicContact CG1-CZ 4.49Å; M34-F38 VanDerWaalsContact O-CD2 3.22Å; M34-F38 WeakPolarHBondContact O-CD2 3.48Å; M34-F38 PolarHBondContact O-N 2.79Å; M35-F38 PolarHBondContact O-N 3.42Å; F38-Y42 WeakPolarHBondContact O-CB 3.34Å; F38-Y42 PolarHBondContact O-N 3.04Å; F38-Y84 HydrophobicContact CB-CE2 3.88Å; F38-Y84 HydrophobicContact CD1-CD1 4.48Å; F38-Y84 AromaticContact CD1-CD2 3.87Å; F38-Y84 HydrophobicContact CD1-CD2 3.87Å; F38-Y84 HydrophobicContact CD1-CE1 4.33Å; F38-Y84 AromaticContact CD1-CE2 3.68Å; F38-Y84 HydrophobicContact CD1-CE2 3.68Å; F38-Y84 HydrophobicContact CD1-CG 4.27Å; F38-Y84 AromaticContact CD1-CZ 3.92Å; F38-Y84 HydrophobicContact CG-CE2 4.19Å; F38-Y84 WeakPolarHBondContact O-CE2 3.45Å; F38-E87 HydrophobicContact CE1-CB 4.42Å; F38-E87 HydrophobicContact CE1-CG 4.5Å; F38-M88 HydrophobicContact CE1-CB 3.87Å; F38-M88 HydrophobicContact CE1-CG 4.5Å; F38-M88 HydrophobicContact CZ-CB 3.96Å; F38-M88 HydrophobicContact CZ-CG 4.24Å; F38-I91 HydrophobicContact CE2-CD1 3.57Å; F38-I91 HydrophobicContact CZ-CD1 3.47Å; F38-I91 VanDerWaalsContact CZ-CD1 3.47Å
39	Y	94.9	Very high	91.4	Very high	47 Å²	47	50.4 Å²	50.4	18%	0.184	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-48.4	174.2	175.5	-93.1	0	0	0	112.3	M35 R37 Y42 K43 K65 W69	M35-Y39 WeakPolarHBondContact O-CB 3.18Å; M35-Y39 PolarHBondContact O-N 2.84Å; R37-Y39 VanDerWaalsContact C-N 3.29Å; R37-Y39 PolarHBondContact O-N 2.99Å; Y39-Y42 PolarHBondContact O-N 3.45Å; Y39-K43 HydrophobicContact CD1-CG 4.45Å; Y39-K43 HydrophobicContact CD2-CG 4.23Å; Y39-K43 HydrophobicContact CE1-CG 3.93Å; Y39-K43 HydrophobicContact CE2-CD 3.97Å; Y39-K43 HydrophobicContact CE2-CG 3.71Å; Y39-K43 WeakPolarHBondContact O-CG 3.39Å; Y39-K43 PolarHBondContact O-N 3.18Å; Y39-K65 HydrophobicContact CD1-CB 4.01Å; Y39-K65 HydrophobicContact CD1-CG 4.15Å; Y39-K65 HydrophobicContact CE1-CB 3.55Å; Y39-K65 HydrophobicContact CE1-CG 4.06Å; Y39-K65 WeakPolarHBondContact CE1-O 3.21Å; Y39-K65 HydrophobicContact CG-CG 4.48Å; Y39-W69 HydrophobicContact CE1-CB 4.42Å
40	S	96.3	Very high	92.6	Very high	5 Å²	5	45.2 Å²	45.2	4%	0.035	23%	0.228	C	C	.	.	H	α-helix	trans	-65.2	-48.2	-177.6	63	0	0	0	0	112.2	L36 R37 Y42 K43 Q44 A68 L72	L36-S40 PolarHBondContact O-N 2.97Å; L36-S40 PolarHBondContact O-OG 2.94Å; R37-S40 PolarHBondContact O-N 3.39Å; R37-S40 PolarHBondContact O-OG 3.34Å; S40-Y42 VanDerWaalsContact C-N 3.33Å; S40-Y42 PolarHBondContact O-N 3.3Å; S40-K43 PolarHBondContact O-N 3.24Å; S40-Q44 WeakPolarHBondContact O-CB 3.28Å; S40-Q44 PolarHBondContact O-N 2.69Å; S40-A68 WeakPolarHBondContact CB-O 3.37Å; S40-L72 VanDerWaalsContact C-CD1 3.4Å; S40-L72 WeakPolarHBondContact O-CD1 3.41Å
41	F	96.9	Very high	93.5	Very high	26 Å²	26	51.6 Å²	51.6	11%	0.114	25%	0.252	C	S	.	.	H	α-helix	trans	-62.6	-38.7	175.9	-64.2	-43.6	0	0	0	111.9	R37 Q44 A45 L72 M75 A83 Y84 E87	R37-F41 HydrophobicContact CB-CD2 4.43Å; R37-F41 HydrophobicContact CB-CE2 4.18Å; R37-F41 WeakPolarHBondContact O-CD2 3.44Å; R37-F41 WeakPolarHBondContact O-CG 3.2Å; R37-F41 PolarHBondContact O-N 2.95Å; F41-Q44 PolarHBondContact O-N 3.45Å; F41-A45 WeakPolarHBondContact O-CB 3.4Å; F41-A45 PolarHBondContact O-N 2.76Å; F41-L72 HydrophobicContact CD1-CD1 3.72Å; F41-L72 HydrophobicContact CD1-CD2 4.03Å; F41-L72 HydrophobicContact CE1-CD1 4.23Å; F41-L72 HydrophobicContact CE1-CD2 3.66Å; F41-M75 HydrophobicContact CD1-SD 4.28Å; F41-M75 HydrophobicContact CE1-CE 4.35Å; F41-M75 HydrophobicContact CE1-SD 4.35Å; F41-A83 HydrophobicContact CD1-CB 3.76Å; F41-A83 HydrophobicContact CD2-CB 4.26Å; F41-A83 HydrophobicContact CE1-CB 3.54Å; F41-A83 HydrophobicContact CE2-CB 4.05Å; F41-A83 HydrophobicContact CG-CB 4.13Å; F41-A83 HydrophobicContact CZ-CB 3.7Å; F41-Y84 HydrophobicContact CB-CD2 3.95Å; F41-Y84 HydrophobicContact CB-CG 4.49Å; F41-E87 HydrophobicContact CE2-CB 4.29Å
42	Y	96.2	Very high	93.8	Very high	81 Å²	81	53.3 Å²	53.3	32%	0.318	26%	0.257	S	S	.	.	H	α-helix	trans	-60.7	-50	175.7	177	-96.2	0	0	0	112	F12 V16 F38 Y39 S40 A45 T46	F12-Y42 HydrophobicContact CE2-CD2 4.4Å; F12-Y42 AromaticContact CZ-CD2 3.7Å; F12-Y42 HydrophobicContact CZ-CD2 3.7Å; F12-Y42 HydrophobicContact CZ-CE2 4.27Å; V16-Y42 HydrophobicContact CG1-CE2 4.11Å; V16-Y42 HydrophobicContact CG2-CD2 3.92Å; V16-Y42 HydrophobicContact CG2-CE2 4.16Å; F38-Y42 WeakPolarHBondContact O-CB 3.34Å; F38-Y42 PolarHBondContact O-N 3.04Å; Y39-Y42 PolarHBondContact O-N 3.45Å; S40-Y42 VanDerWaalsContact C-N 3.33Å; S40-Y42 PolarHBondContact O-N 3.3Å; Y42-A45 PolarHBondContact O-N 3.01Å; Y42-T46 HydrophobicContact CD2-CG2 4.29Å; Y42-T46 HydrophobicContact CE1-CG2 4.21Å; Y42-T46 HydrophobicContact CE2-CG2 3.9Å; Y42-T46 WeakPolarHBondContact O-CG2 3.32Å; Y42-T46 PolarHBondContact O-N 2.93Å; Y42-T46 PolarHBondContact O-OG1 2.98Å
43	K	96.7	Very high	94.1	Very high	3 Å²	3	54.8 Å²	54.8	1%	0.013	27%	0.274	C	S	.	.	H	α-helix	trans	-67.5	-35.6	178.7	-59.8	-67.3	-89.4	-174.1	0	111.9	Y39 S40 T46 E47 G48 W69 E273	Y39-K43 HydrophobicContact CD1-CG 4.45Å; Y39-K43 HydrophobicContact CD2-CG 4.23Å; Y39-K43 HydrophobicContact CE1-CG 3.93Å; Y39-K43 HydrophobicContact CE2-CD 3.97Å; Y39-K43 HydrophobicContact CE2-CG 3.71Å; Y39-K43 WeakPolarHBondContact O-CG 3.39Å; Y39-K43 PolarHBondContact O-N 3.18Å; S40-K43 PolarHBondContact O-N 3.24Å; K43-T46 PolarHBondContact O-N 2.99Å; K43-E47 VanDerWaalsContact CE-OE1 3.24Å; K43-E47 WeakPolarHBondContact CE-OE1 3.48Å; K43-E47 IonicContact NZ-OE1 3.97Å; K43-E47 PolarHBondContact NZ-OE1 3.37Å; K43-E47 IonicContact NZ-OE2 2.9Å; K43-E47 WeakPolarHBondContact O-CA 3Å; K43-E47 WeakPolarHBondContact O-CB 3.31Å; K43-E47 PolarHBondContact O-N 3.24Å; K43-G48 PolarHBondContact O-N 2.89Å; K43-G48 VanDerWaalsContact O-N 3.16Å; K43-W69 HydrophobicContact CB-CD2 3.71Å; K43-W69 HydrophobicContact CB-CE3 4.13Å; K43-W69 HydrophobicContact CB-CG 4.06Å; K43-W69 HydrophobicContact CB-CH2 4.39Å; K43-W69 HydrophobicContact CB-CZ2 4Å; K43-W69 HydrophobicContact CB-CZ3 4.44Å; K43-W69 HydrophobicContact CG-CD2 4.45Å; K43-W69 HydrophobicContact CG-CE3 4.45Å; K43-E273 IonicContact NZ-OE1 2.67Å; K43-E273 PolarHBondContact NZ-OE1 3.29Å; K43-E273 IonicContact NZ-OE2 3.93Å; K43-E273 PolarHBondContact NZ-OE2 3.17Å
44	Q	96.7	Very high	94.3	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-66.9	-36.4	174.6	-162.5	78.2	-0.6	0	0	112	S40 F41 G48 W69 L72 G73 M75 A80	S40-Q44 WeakPolarHBondContact O-CB 3.28Å; S40-Q44 PolarHBondContact O-N 2.69Å; F41-Q44 PolarHBondContact O-N 3.45Å; Q44-G48 WeakPolarHBondContact O-CA 3.47Å; Q44-G48 PolarHBondContact O-N 3.37Å; Q44-G48 VanDerWaalsContact O-N 3.13Å; Q44-G48 PolarHBondContact OE1-O 3.16Å; Q44-G48 VanDerWaalsContact OE1-O 3.11Å; Q44-W69 VanDerWaalsContact OE1-CD1 3.27Å; Q44-L72 HydrophobicContact CB-CD1 3.7Å; Q44-L72 HydrophobicContact CG-CB 4.29Å; Q44-L72 HydrophobicContact CG-CD1 4.11Å; Q44-G73 PolarHBondContact NE2-O 3.5Å; Q44-M75 HydrophobicContact CG-CB 4.17Å; Q44-M75 HydrophobicContact CG-CG 4.26Å; Q44-M75 HydrophobicContact CG-SD 4.35Å; Q44-M75 PolarHBondContact NE2-O 3.35Å; Q44-A80 HydrophobicContact CB-CB 3.74Å; Q44-A80 HydrophobicContact CG-CB 3.87Å
45	A	95.3	Very high	94.6	Very high	2 Å²	2	54.2 Å²	54.2	2%	0.017	27%	0.269	C	S	.	.	H	α-helix	trans	-69.5	-45.4	173.8	0	0	0	0	0	112.6	F12 F41 Y42 K77 A80 M81	F12-A45 HydrophobicContact CE1-CB 4.12Å; F12-A45 HydrophobicContact CE2-CB 3.87Å; F12-A45 HydrophobicContact CZ-CB 3.61Å; F41-A45 WeakPolarHBondContact O-CB 3.4Å; F41-A45 PolarHBondContact O-N 2.76Å; Y42-A45 PolarHBondContact O-N 3.01Å; A45-K77 WeakPolarHBondContact O-CD 3.37Å; A45-K77 VanDerWaalsContact O-CE 3.24Å; A45-K77 WeakPolarHBondContact O-CE 3.24Å; A45-K77 WeakPolarHBondContact O-CG 3.39Å; A45-K77 PolarHBondContact O-NZ 3.02Å; A45-A80 HydrophobicContact CB-CB 4.06Å; A45-M81 HydrophobicContact CB-CE 4.46Å; A45-M81 HydrophobicContact CB-CG 3.78Å
46	T	94.1	Very high	94.9	Very high	51 Å²	51	51.6 Å²	51.6	31%	0.313	26%	0.261	S	S	.	.	H	α-helix	trans	-82.3	-42.1	-174.6	56.6	0	0	0	0	113.7	F12 Y42 K43 K77	F12-T46 HydrophobicContact CE1-CG2 4.48Å; F12-T46 HydrophobicContact CZ-CG2 4.48Å; Y42-T46 HydrophobicContact CD2-CG2 4.29Å; Y42-T46 HydrophobicContact CE1-CG2 4.21Å; Y42-T46 HydrophobicContact CE2-CG2 3.9Å; Y42-T46 WeakPolarHBondContact O-CG2 3.32Å; Y42-T46 PolarHBondContact O-N 2.93Å; Y42-T46 PolarHBondContact O-OG1 2.98Å; K43-T46 PolarHBondContact O-N 2.99Å; T46-K77 PolarHBondContact O-NZ 2.71Å
47	E	94.6	Very high	94.8	Very high	95 Å²	95	58 Å²	58	44%	0.444	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-24.4	-174.1	-69.7	169.9	-140.3	0	0	113.1	K43 W69	K43-E47 VanDerWaalsContact CE-OE1 3.24Å; K43-E47 WeakPolarHBondContact CE-OE1 3.48Å; K43-E47 IonicContact NZ-OE1 3.97Å; K43-E47 PolarHBondContact NZ-OE1 3.37Å; K43-E47 IonicContact NZ-OE2 2.9Å; K43-E47 WeakPolarHBondContact O-CA 3Å; K43-E47 WeakPolarHBondContact O-CB 3.31Å; K43-E47 PolarHBondContact O-N 3.24Å; E47-W69 HydrophobicContact CB-CH2 4.29Å; E47-W69 HydrophobicContact CB-CZ2 4.01Å; E47-W69 VanDerWaalsContact OE2-CH2 3.27Å; E47-W69 WeakPolarHBondContact OE2-CH2 3.3Å
48	G	93.4	Very high	94.7	Very high	3 Å²	3	63.4 Å²	63.4	3%	0.031	31%	0.308	C	S	.	.			trans	89.1	-160.7	-175.8	0	0	0	0	0	113	K43 Q44 C50 W69	K43-G48 PolarHBondContact O-N 2.89Å; K43-G48 VanDerWaalsContact O-N 3.16Å; Q44-G48 WeakPolarHBondContact O-CA 3.47Å; Q44-G48 PolarHBondContact O-N 3.37Å; Q44-G48 VanDerWaalsContact O-N 3.13Å; Q44-G48 PolarHBondContact OE1-O 3.16Å; Q44-G48 VanDerWaalsContact OE1-O 3.11Å; G48-C50 PolarHBondContact O-N 2.85Å; G48-W69 WeakPolarHBondContact O-CZ2 3.23Å; G48-W69 PolarHBondContact O-NE1 2.92Å
49	P	95.9	Very high	94.7	Very high	50 Å²	50	65 Å²	65	33%	0.325	32%	0.317	S	S	.	.	S	Bend	trans	-51	134	179.6	-32.3	37.8	0	0	0	114.1	K51 G73	P49-K51 WeakPolarHBondContact O-CE 3.45Å; P49-K51 WeakPolarHBondContact O-CG 3.49Å; P49-K51 PolarHBondContact O-N 3Å; P49-G73 VanDerWaalsContact CB-O 3.31Å; P49-G73 WeakPolarHBondContact CB-O 3.35Å
50	C	95.1	Very high	94.6	Very high	30 Å²	30	66 Å²	66	20%	0.203	33%	0.33	C	S	.	.			trans	-58.8	124.9	179.8	-173.8	0	0	0	0	111.8	G48 W66 W69	G48-C50 PolarHBondContact O-N 2.85Å; C50-W66 PolarHBondContact SG-NE1 3.31Å; C50-W66 VanDerWaalsContact SG-NE1 3.44Å; C50-W69 HydrophobicContact CB-CD2 3.69Å; C50-W69 HydrophobicContact CB-CE3 4.17Å; C50-W69 HydrophobicContact CB-CG 3.9Å; C50-W69 HydrophobicContact CB-CZ2 4.29Å
51	K	93.8	Very high	94.4	Very high	170 Å²	170	67.6 Å²	67.6	74%	0.739	34%	0.338	S	S	*	.			trans	-118.3	-0.6	179.5	-67.4	150.2	-166	158.6	0	113.3	P49	P49-K51 WeakPolarHBondContact O-CE 3.45Å; P49-K51 WeakPolarHBondContact O-CG 3.49Å; P49-K51 PolarHBondContact O-N 3Å
52	L	92.6	Very high	94.3	Very high	111 Å²	111	67 Å²	67	58%	0.581	34%	0.339	S	S	*	.	S	Bend	trans	-81.8	154.6	-177.6	-57.5	-178.2	0	0	0	110.6	W66 W69	L52-W66 PolarHBondContact O-NE1 3.05Å; L52-W69 HydrophobicContact CD1-CZ3 3.94Å; L52-W69 HydrophobicContact CG-CZ3 4.42Å
53	S	94.8	Very high	94.2	Very high	107 Å²	107	66.7 Å²	66.7	75%	0.748	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-75.9	136.6	170	55.7	0	0	0	0	111.2
54	R	94.4	Very high	94.2	Very high	115 Å²	115	73 Å²	73	43%	0.434	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-52.5	130.9	176.4	-171.1	174	-169.1	-131.1	0.6	112.1	W66 D67	R54-W66 HydrophobicContact CB-CD2 3.69Å; R54-W66 HydrophobicContact CB-CE3 3.66Å; R54-W66 HydrophobicContact CB-CG 4.4Å; R54-W66 HydrophobicContact CB-CH2 3.94Å; R54-W66 HydrophobicContact CB-CZ2 3.94Å; R54-W66 HydrophobicContact CB-CZ3 3.8Å; R54-W66 HydrophobicContact CG-CD2 3.83Å; R54-W66 HydrophobicContact CG-CE3 3.46Å; R54-W66 VanDerWaalsContact CG-CE3 3.46Å; R54-W66 HydrophobicContact CG-CG 4.42Å; R54-W66 HydrophobicContact CG-CH2 4.48Å; R54-W66 HydrophobicContact CG-CZ3 3.83Å; R54-D67 IonicContact CZ-OD1 3.18Å; R54-D67 VanDerWaalsContact CZ-OD1 3.3Å; R54-D67 IonicContact CZ-OD2 2.68Å; R54-D67 IonicContact NE-OD1 2.69Å; R54-D67 PolarHBondContact NE-OD1 2.81Å; R54-D67 IonicContact NE-OD2 3.97Å; R54-D67 VanDerWaalsContact NH2-CG 3.35Å; R54-D67 IonicContact NH2-OD1 3.58Å; R54-D67 PolarHBondContact NH2-OD1 2.65Å; R54-D67 IonicContact NH2-OD2 3.64Å; R54-D67 PolarHBondContact NH2-OD2 3.31Å
55	P	95.3	Very high	94.1	Very high	34 Å²	34	74.5 Å²	74.5	22%	0.221	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-61.9	161.5	-179.4	-28.2	37.8	0	0	0	115.6	D59 R63 W66	P55-D59 HydrophobicContact CB-CB 4.2Å; P55-D59 VanDerWaalsContact CB-OD2 3.26Å; P55-D59 WeakPolarHBondContact CB-OD2 3.47Å; P55-R63 HydrophobicContact CB-CG 4.2Å; P55-R63 PolarHBondContact O-NE 3.27Å; P55-W66 HydrophobicContact CG-CB 4.35Å
56	G	93.8	Very high	94.2	Very high	19 Å²	19	76.9 Å²	76.9	20%	0.196	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-64.8	165	179.9	0	0	0	0	0	113	W58 D59 R63	G56-W58 PolarHBondContact O-N 3.34Å; G56-D59 PolarHBondContact O-N 2.93Å; G56-D59 VanDerWaalsContact O-N 3.14Å; G56-R63 WeakPolarHBondContact O-CD 3.37Å; G56-R63 PolarHBondContact O-NE 3.15Å; G56-R63 VanDerWaalsContact O-NE 3.16Å
57	F	91.7	Very high	94.3	Very high	165 Å²	165	76.9 Å²	76.9	72%	0.724	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-16.9	-177.9	71.4	-93.9	0	0	0	113.9	D59	F57-D59 VanDerWaalsContact C-N 3.26Å
58	W	92.3	Very high	94.4	Very high	199 Å²	199	73.2 Å²	73.2	75%	0.754	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-7.5	175.1	59.8	80.9	0	0	0	113.5	G56 P60	G56-W58 PolarHBondContact O-N 3.34Å; W58-P60 WeakPolarHBondContact O-CD 3.35Å
59	D	94.1	Very high	94.6	Very high	51 Å²	51	73.4 Å²	73.4	27%	0.273	36%	0.361	S	S	.	.			trans	-119.1	84.1	178.7	173.9	20.4	0	0	0	109.6	P55 G56 F57 I61 G62 R63	P55-D59 HydrophobicContact CB-CB 4.2Å; P55-D59 VanDerWaalsContact CB-OD2 3.26Å; P55-D59 WeakPolarHBondContact CB-OD2 3.47Å; G56-D59 PolarHBondContact O-N 2.93Å; G56-D59 VanDerWaalsContact O-N 3.14Å; F57-D59 VanDerWaalsContact C-N 3.26Å; D59-I61 PolarHBondContact OD1-N 3.27Å; D59-G62 WeakPolarHBondContact OD1-CA 3.49Å; D59-G62 PolarHBondContact OD1-N 3.15Å; D59-G62 VanDerWaalsContact OD2-CA 3.31Å; D59-G62 WeakPolarHBondContact OD2-CA 3.24Å; D59-R63 VanDerWaalsContact O-CB 3.32Å; D59-R63 WeakPolarHBondContact O-CB 3.45Å; D59-R63 VanDerWaalsContact O-CG 3.23Å; D59-R63 WeakPolarHBondContact O-CG 3.44Å; D59-R63 PolarHBondContact O-N 3.13Å
60	P	92.3	Very high	94.7	Very high	70 Å²	70	73.3 Å²	73.3	46%	0.455	36%	0.362	S	S	.	.	H	α-helix	trans	-69.3	-37.3	177.9	27.5	-32.9	0	0	0	111.6	W58 R63 Y64	W58-P60 WeakPolarHBondContact O-CD 3.35Å; P60-R63 WeakPolarHBondContact O-CB 2.81Å; P60-R63 PolarHBondContact O-N 2.85Å; P60-Y64 HydrophobicContact CB-CE2 4.19Å; P60-Y64 WeakPolarHBondContact O-CD2 3.47Å; P60-Y64 PolarHBondContact O-N 3.32Å
61	I	92.1	Very high	94.7	Very high	37 Å²	37	76.3 Å²	76.3	19%	0.19	38%	0.383	C	S	.	.	H	α-helix	trans	-64	-53.9	-177.5	-69.9	179.1	0	0	0	110.6	D59 R63 Y64 K65 Q268 F269	D59-I61 PolarHBondContact OD1-N 3.27Å; I61-R63 VanDerWaalsContact C-N 3.27Å; I61-R63 PolarHBondContact O-N 3.48Å; I61-Y64 PolarHBondContact O-N 3.5Å; I61-K65 HydrophobicContact CG2-CD 4.06Å; I61-K65 WeakPolarHBondContact O-CG 3.32Å; I61-K65 PolarHBondContact O-N 2.99Å; I61-Q268 HydrophobicContact CD1-CB 4.12Å; I61-F269 HydrophobicContact CB-CE2 4.28Å; I61-F269 HydrophobicContact CB-CZ 4.18Å; I61-F269 HydrophobicContact CD1-CD2 4.34Å; I61-F269 HydrophobicContact CD1-CE2 4.09Å; I61-F269 HydrophobicContact CG1-CD2 4.43Å; I61-F269 HydrophobicContact CG1-CE2 3.75Å; I61-F269 HydrophobicContact CG1-CZ 4.08Å; I61-F269 HydrophobicContact CG2-CD1 4.1Å; I61-F269 HydrophobicContact CG2-CD2 4.12Å; I61-F269 HydrophobicContact CG2-CE1 3.85Å; I61-F269 HydrophobicContact CG2-CE2 3.87Å; I61-F269 HydrophobicContact CG2-CG 4.24Å; I61-F269 HydrophobicContact CG2-CZ 3.73Å
62	G	94.9	Very high	94.8	Very high	14 Å²	14	69.5 Å²	69.5	14%	0.144	35%	0.354	C	S	.	.	H	α-helix	trans	-64.7	-30	175.7	0	0	0	0	0	112.6	D59 W66	D59-G62 WeakPolarHBondContact OD1-CA 3.49Å; D59-G62 PolarHBondContact OD1-N 3.15Å; D59-G62 VanDerWaalsContact OD2-CA 3.31Å; D59-G62 WeakPolarHBondContact OD2-CA 3.24Å; G62-W66 WeakPolarHBondContact O-CB 3.19Å; G62-W66 PolarHBondContact O-N 3.26Å
63	R	95.1	Very high	94.9	Very high	74 Å²	74	66 Å²	66	28%	0.279	35%	0.345	S	S	.	.	H	α-helix	trans	-62.4	-51.7	169	-85.3	176.9	158.9	-153.3	-7.2	112.5	P55 G56 D59 P60 I61 K65 W66 D67	P55-R63 HydrophobicContact CB-CG 4.2Å; P55-R63 PolarHBondContact O-NE 3.27Å; G56-R63 WeakPolarHBondContact O-CD 3.37Å; G56-R63 PolarHBondContact O-NE 3.15Å; G56-R63 VanDerWaalsContact O-NE 3.16Å; D59-R63 VanDerWaalsContact O-CB 3.32Å; D59-R63 WeakPolarHBondContact O-CB 3.45Å; D59-R63 VanDerWaalsContact O-CG 3.23Å; D59-R63 WeakPolarHBondContact O-CG 3.44Å; D59-R63 PolarHBondContact O-N 3.13Å; P60-R63 WeakPolarHBondContact O-CB 2.81Å; P60-R63 PolarHBondContact O-N 2.85Å; I61-R63 VanDerWaalsContact C-N 3.27Å; I61-R63 PolarHBondContact O-N 3.48Å; R63-K65 VanDerWaalsContact C-N 3.32Å; R63-K65 PolarHBondContact O-N 3.31Å; R63-W66 PolarHBondContact O-N 3.1Å; R63-D67 WeakPolarHBondContact O-CB 3.34Å; R63-D67 PolarHBondContact O-N 3.42Å
64	Y	95.8	Very high	94.9	Very high	136 Å²	136	68 Å²	68	53%	0.533	35%	0.347	S	S	.	.	H	α-helix	trans	-60.9	-42	177.6	-65.8	-58.7	0	0	0	111.9	P60 I61 W66 D67 A68	P60-Y64 HydrophobicContact CB-CE2 4.19Å; P60-Y64 WeakPolarHBondContact O-CD2 3.47Å; P60-Y64 PolarHBondContact O-N 3.32Å; I61-Y64 PolarHBondContact O-N 3.5Å; Y64-W66 PolarHBondContact O-N 3.05Å; Y64-D67 PolarHBondContact O-N 3.24Å; Y64-A68 VanDerWaalsContact O-CB 3.24Å; Y64-A68 WeakPolarHBondContact O-CB 3.27Å; Y64-A68 PolarHBondContact O-N 2.78Å
65	K	95.6	Very high	94.9	Very high	31 Å²	31	64.9 Å²	64.9	14%	0.135	34%	0.338	C	S	.	.	H	α-helix	trans	-59	-45.8	173.7	-72.3	173.6	69.4	173.2	0	112	L36 Y39 I61 R63 W69 F269	L36-K65 HydrophobicContact CD2-CG 4.22Å; Y39-K65 HydrophobicContact CD1-CB 4.01Å; Y39-K65 HydrophobicContact CD1-CG 4.15Å; Y39-K65 HydrophobicContact CE1-CB 3.55Å; Y39-K65 HydrophobicContact CE1-CG 4.06Å; Y39-K65 WeakPolarHBondContact CE1-O 3.21Å; Y39-K65 HydrophobicContact CG-CG 4.48Å; I61-K65 HydrophobicContact CG2-CD 4.06Å; I61-K65 WeakPolarHBondContact O-CG 3.32Å; I61-K65 PolarHBondContact O-N 2.99Å; R63-K65 VanDerWaalsContact C-N 3.32Å; R63-K65 PolarHBondContact O-N 3.31Å; K65-W69 WeakPolarHBondContact O-CB 3.47Å; K65-W69 PolarHBondContact O-N 2.92Å; K65-W69 VanDerWaalsContact O-N 3.09Å; K65-F269 HydrophobicContact CD-CD1 4.04Å; K65-F269 HydrophobicContact CD-CE1 4.07Å; K65-F269 HydrophobicContact CG-CD1 4.19Å; K65-F269 HydrophobicContact CG-CE1 3.82Å
66	W	97.1	Very high	95	Very high	52 Å²	52	66.7 Å²	66.7	20%	0.197	35%	0.349	C	S	.	.	H	α-helix	trans	-69.6	-42.3	179.3	-174	95.6	0	0	0	112.3	C50 L52 R54 P55 G62 R63 Y64 W69 S70	C50-W66 PolarHBondContact SG-NE1 3.31Å; C50-W66 VanDerWaalsContact SG-NE1 3.44Å; L52-W66 PolarHBondContact O-NE1 3.05Å; R54-W66 HydrophobicContact CB-CD2 3.69Å; R54-W66 HydrophobicContact CB-CE3 3.66Å; R54-W66 HydrophobicContact CB-CG 4.4Å; R54-W66 HydrophobicContact CB-CH2 3.94Å; R54-W66 HydrophobicContact CB-CZ2 3.94Å; R54-W66 HydrophobicContact CB-CZ3 3.8Å; R54-W66 HydrophobicContact CG-CD2 3.83Å; R54-W66 HydrophobicContact CG-CE3 3.46Å; R54-W66 VanDerWaalsContact CG-CE3 3.46Å; R54-W66 HydrophobicContact CG-CG 4.42Å; R54-W66 HydrophobicContact CG-CH2 4.48Å; R54-W66 HydrophobicContact CG-CZ3 3.83Å; P55-W66 HydrophobicContact CG-CB 4.35Å; G62-W66 WeakPolarHBondContact O-CB 3.19Å; G62-W66 PolarHBondContact O-N 3.26Å; R63-W66 PolarHBondContact O-N 3.1Å; Y64-W66 PolarHBondContact O-N 3.05Å; W66-W69 PolarHBondContact O-N 2.93Å; W66-S70 WeakPolarHBondContact CH2-OG 3.35Å; W66-S70 WeakPolarHBondContact O-CB 3.08Å; W66-S70 PolarHBondContact O-N 2.88Å
67	D	96.3	Very high	95	Very high	52 Å²	52	69.8 Å²	69.8	28%	0.278	36%	0.357	S	S	.	.	H	α-helix	trans	-63.6	-42.9	178.3	-68.3	-27.2	0	0	0	110.6	R54 R63 Y64 S71	R54-D67 IonicContact CZ-OD1 3.18Å; R54-D67 VanDerWaalsContact CZ-OD1 3.3Å; R54-D67 IonicContact CZ-OD2 2.68Å; R54-D67 IonicContact NE-OD1 2.69Å; R54-D67 PolarHBondContact NE-OD1 2.81Å; R54-D67 IonicContact NE-OD2 3.97Å; R54-D67 VanDerWaalsContact NH2-CG 3.35Å; R54-D67 IonicContact NH2-OD1 3.58Å; R54-D67 PolarHBondContact NH2-OD1 2.65Å; R54-D67 IonicContact NH2-OD2 3.64Å; R54-D67 PolarHBondContact NH2-OD2 3.31Å; R63-D67 WeakPolarHBondContact O-CB 3.34Å; R63-D67 PolarHBondContact O-N 3.42Å; Y64-D67 PolarHBondContact O-N 3.24Å; D67-S71 WeakPolarHBondContact O-CB 3.24Å; D67-S71 PolarHBondContact O-N 2.66Å
68	A	96.8	Very high	95.1	Very high	18 Å²	18	64.8 Å²	64.8	15%	0.149	34%	0.336	C	S	.	.	H	α-helix	trans	-64.8	-41.6	176.3	0	0	0	0	0	112.6	L36 S40 Y64 S71	L36-A68 HydrophobicContact CB-CB 4.14Å; L36-A68 HydrophobicContact CD2-CB 4.34Å; S40-A68 WeakPolarHBondContact CB-O 3.37Å; Y64-A68 VanDerWaalsContact O-CB 3.24Å; Y64-A68 WeakPolarHBondContact O-CB 3.27Å; Y64-A68 PolarHBondContact O-N 2.78Å; A68-S71 PolarHBondContact O-OG 2.99Å
69	W	97.4	Very high	95.2	Very high	7 Å²	7	60.2 Å²	60.2	3%	0.027	32%	0.323	C	S	.	.	H	α-helix	trans	-72.9	-42.4	176.7	-177.8	18.6	0	0	0	112.1	Y39 K43 Q44 E47 G48 C50 L52 K65 W66 S71 L72	Y39-W69 HydrophobicContact CE1-CB 4.42Å; K43-W69 HydrophobicContact CB-CD2 3.71Å; K43-W69 HydrophobicContact CB-CE3 4.13Å; K43-W69 HydrophobicContact CB-CG 4.06Å; K43-W69 HydrophobicContact CB-CH2 4.39Å; K43-W69 HydrophobicContact CB-CZ2 4Å; K43-W69 HydrophobicContact CB-CZ3 4.44Å; K43-W69 HydrophobicContact CG-CD2 4.45Å; K43-W69 HydrophobicContact CG-CE3 4.45Å; Q44-W69 VanDerWaalsContact OE1-CD1 3.27Å; E47-W69 HydrophobicContact CB-CH2 4.29Å; E47-W69 HydrophobicContact CB-CZ2 4.01Å; E47-W69 VanDerWaalsContact OE2-CH2 3.27Å; E47-W69 WeakPolarHBondContact OE2-CH2 3.3Å; G48-W69 WeakPolarHBondContact O-CZ2 3.23Å; G48-W69 PolarHBondContact O-NE1 2.92Å; C50-W69 HydrophobicContact CB-CD2 3.69Å; C50-W69 HydrophobicContact CB-CE3 4.17Å; C50-W69 HydrophobicContact CB-CG 3.9Å; C50-W69 HydrophobicContact CB-CZ2 4.29Å; L52-W69 HydrophobicContact CD1-CZ3 3.94Å; L52-W69 HydrophobicContact CG-CZ3 4.42Å; K65-W69 WeakPolarHBondContact O-CB 3.47Å; K65-W69 PolarHBondContact O-N 2.92Å; K65-W69 VanDerWaalsContact O-N 3.09Å; W66-W69 PolarHBondContact O-N 2.93Å; W69-S71 PolarHBondContact O-N 3.3Å; W69-L72 PolarHBondContact O-N 3.5Å
70	S	96.5	Very high	95.2	Very high	48 Å²	48	57.8 Å²	57.8	34%	0.336	31%	0.31	S	S	.	.	H	α-helix	trans	-67.2	-21.5	179.1	-171.5	0	0	0	0	113.4	W66 L72 G73	W66-S70 WeakPolarHBondContact CH2-OG 3.35Å; W66-S70 WeakPolarHBondContact O-CB 3.08Å; W66-S70 PolarHBondContact O-N 2.88Å; S70-L72 VanDerWaalsContact C-N 3.26Å; S70-L72 PolarHBondContact O-N 3.33Å; S70-G73 PolarHBondContact O-N 3.33Å
71	S	96.5	Very high	95.3	Very high	92 Å²	92	55.3 Å²	55.3	64%	0.643	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-17	176.3	72	0	0	0	0	113.7	D67 A68 W69 G73	D67-S71 WeakPolarHBondContact O-CB 3.24Å; D67-S71 PolarHBondContact O-N 2.66Å; A68-S71 PolarHBondContact O-OG 2.99Å; W69-S71 PolarHBondContact O-N 3.3Å; S71-G73 VanDerWaalsContact C-N 3.31Å
72	L	94.9	Very high	95.3	Very high	27 Å²	27	55.6 Å²	55.6	14%	0.141	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-12.4	175.3	-58.3	-176.6	0	0	0	113.6	S40 F41 Q44 W69 S70 D74 M75	S40-L72 VanDerWaalsContact C-CD1 3.4Å; S40-L72 WeakPolarHBondContact O-CD1 3.41Å; F41-L72 HydrophobicContact CD1-CD1 3.72Å; F41-L72 HydrophobicContact CD1-CD2 4.03Å; F41-L72 HydrophobicContact CE1-CD1 4.23Å; F41-L72 HydrophobicContact CE1-CD2 3.66Å; Q44-L72 HydrophobicContact CB-CD1 3.7Å; Q44-L72 HydrophobicContact CG-CB 4.29Å; Q44-L72 HydrophobicContact CG-CD1 4.11Å; W69-L72 PolarHBondContact O-N 3.5Å; S70-L72 VanDerWaalsContact C-N 3.26Å; S70-L72 PolarHBondContact O-N 3.33Å; L72-D74 PolarHBondContact O-N 3Å; L72-M75 HydrophobicContact CB-CB 4.44Å; L72-M75 HydrophobicContact CB-SD 4.4Å; L72-M75 HydrophobicContact CD1-SD 4.32Å; L72-M75 HydrophobicContact CD2-CE 4Å; L72-M75 HydrophobicContact CD2-SD 4.27Å; L72-M75 WeakPolarHBondContact O-CB 3.44Å; L72-M75 PolarHBondContact O-N 3.49Å
73	G	94.9	Very high	95.2	Very high	38 Å²	38	55.8 Å²	55.8	39%	0.392	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	-126.4	174.4	0	0	0	0	0	113.8	Q44 P49 S70 S71	Q44-G73 PolarHBondContact NE2-O 3.5Å; P49-G73 VanDerWaalsContact CB-O 3.31Å; P49-G73 WeakPolarHBondContact CB-O 3.35Å; S70-G73 PolarHBondContact O-N 3.33Å; S71-G73 VanDerWaalsContact C-N 3.31Å
74	D	95.5	Very high	95.2	Very high	149 Å²	149	52.7 Å²	52.7	80%	0.797	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	7.1	-177.2	59.6	-27.5	0	0	0	114.8	L72 T76	L72-D74 PolarHBondContact O-N 3Å; D74-T76 PolarHBondContact O-N 3.34Å
75	M	94.9	Very high	94.9	Very high	50 Å²	50	47 Å²	47	25%	0.246	26%	0.262	C	S	.	.			trans	-42.5	130.4	174.5	174.5	-176.3	-71.1	0	0	112.1	F41 Q44 L72 E79 A80	F41-M75 HydrophobicContact CD1-SD 4.28Å; F41-M75 HydrophobicContact CE1-CE 4.35Å; F41-M75 HydrophobicContact CE1-SD 4.35Å; Q44-M75 HydrophobicContact CG-CB 4.17Å; Q44-M75 HydrophobicContact CG-CG 4.26Å; Q44-M75 HydrophobicContact CG-SD 4.35Å; Q44-M75 PolarHBondContact NE2-O 3.35Å; L72-M75 HydrophobicContact CB-CB 4.44Å; L72-M75 HydrophobicContact CB-SD 4.4Å; L72-M75 HydrophobicContact CD1-SD 4.32Å; L72-M75 HydrophobicContact CD2-CE 4Å; L72-M75 HydrophobicContact CD2-SD 4.27Å; L72-M75 WeakPolarHBondContact O-CB 3.44Å; L72-M75 PolarHBondContact O-N 3.49Å; M75-E79 HydrophobicContact CG-CB 3.82Å; M75-A80 HydrophobicContact CG-CB 4.41Å; M75-A80 HydrophobicContact SD-CB 4.01Å
76	T	95.8	Very high	94.7	Very high	72 Å²	72	51.5 Å²	51.5	44%	0.442	28%	0.284	S	S	.	.			trans	-72.9	161.7	-177.6	69.4	0	0	0	0	112.1	D74 E78 E79 A80	D74-T76 PolarHBondContact O-N 3.34Å; T76-E78 VanDerWaalsContact C-N 3.27Å; T76-E78 PolarHBondContact O-N 3.5Å; T76-E79 VanDerWaalsContact CB-OE2 3.24Å; T76-E79 WeakPolarHBondContact CB-OE2 3.38Å; T76-E79 VanDerWaalsContact CG2-OE2 3.31Å; T76-E79 WeakPolarHBondContact CG2-OE2 3.48Å; T76-E79 PolarHBondContact N-OE2 2.9Å; T76-E79 PolarHBondContact O-N 3.11Å; T76-E79 VanDerWaalsContact OG1-CD 3.22Å; T76-E79 WeakPolarHBondContact OG1-CG 3.22Å; T76-E79 PolarHBondContact OG1-N 3.43Å; T76-E79 PolarHBondContact OG1-OE2 3.36Å; T76-A80 WeakPolarHBondContact O-CB 3.33Å; T76-A80 PolarHBondContact O-N 3.31Å
77	K	94.7	Very high	94.4	Very high	83 Å²	83	50.2 Å²	50.2	36%	0.361	28%	0.28	S	S	.	.	H	α-helix	trans	-59.8	-36.8	177.3	-66.2	-171	156.2	-149.6	0	113	A45 T46 A80 M81	A45-K77 WeakPolarHBondContact O-CD 3.37Å; A45-K77 VanDerWaalsContact O-CE 3.24Å; A45-K77 WeakPolarHBondContact O-CE 3.24Å; A45-K77 WeakPolarHBondContact O-CG 3.39Å; A45-K77 PolarHBondContact O-NZ 3.02Å; T46-K77 PolarHBondContact O-NZ 2.71Å; K77-A80 PolarHBondContact O-N 3.34Å; K77-M81 VanDerWaalsContact O-CG 3.24Å; K77-M81 WeakPolarHBondContact O-CG 3.43Å; K77-M81 PolarHBondContact O-N 3.2Å
78	E	92.7	Very high	93.8	Very high	60 Å²	60	48 Å²	48	28%	0.28	27%	0.268	S	S	.	.	H	α-helix	trans	-70.5	-42.4	-179.9	-65.4	-177.9	-151.3	0	0	111.1	R5 T76 A80 M81 I82	R5-E78 VanDerWaalsContact CD-OE1 3.28Å; R5-E78 WeakPolarHBondContact CD-OE1 3.33Å; R5-E78 HydrophobicContact CG-CG 4.29Å; R5-E78 IonicContact CZ-OE1 3.72Å; R5-E78 IonicContact NE-OE1 2.71Å; R5-E78 IonicContact NH1-OE1 3.41Å; R5-E78 PolarHBondContact NH1-OE1 3.05Å; T76-E78 VanDerWaalsContact C-N 3.27Å; T76-E78 PolarHBondContact O-N 3.5Å; E78-A80 PolarHBondContact O-N 2.87Å; E78-M81 PolarHBondContact O-N 3.19Å; E78-I82 WeakPolarHBondContact O-CD1 3.35Å; E78-I82 VanDerWaalsContact O-CG1 3.27Å; E78-I82 WeakPolarHBondContact O-CG1 3.29Å; E78-I82 PolarHBondContact O-N 2.86Å
79	E	94.3	Very high	93.2	Very high	104 Å²	104	49.7 Å²	49.7	49%	0.486	27%	0.272	S	S	.	.	H	α-helix	trans	-63.2	-40.3	173.7	-68.7	160.1	141.2	0	0	111.9	M75 T76 I82 A83	M75-E79 HydrophobicContact CG-CB 3.82Å; T76-E79 VanDerWaalsContact CB-OE2 3.24Å; T76-E79 WeakPolarHBondContact CB-OE2 3.38Å; T76-E79 VanDerWaalsContact CG2-OE2 3.31Å; T76-E79 WeakPolarHBondContact CG2-OE2 3.48Å; T76-E79 PolarHBondContact N-OE2 2.9Å; T76-E79 PolarHBondContact O-N 3.11Å; T76-E79 VanDerWaalsContact OG1-CD 3.22Å; T76-E79 WeakPolarHBondContact OG1-CG 3.22Å; T76-E79 PolarHBondContact OG1-N 3.43Å; T76-E79 PolarHBondContact OG1-OE2 3.36Å; E79-I82 PolarHBondContact O-N 3.49Å; E79-A83 WeakPolarHBondContact O-CB 3.27Å; E79-A83 PolarHBondContact O-N 3Å
80	A	95.8	Very high	92.6	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65.3	-39.4	175.8	0	0	0	0	0	112.9	Q44 A45 M75 T76 K77 E78 A83 Y84	Q44-A80 HydrophobicContact CB-CB 3.74Å; Q44-A80 HydrophobicContact CG-CB 3.87Å; A45-A80 HydrophobicContact CB-CB 4.06Å; M75-A80 HydrophobicContact CG-CB 4.41Å; M75-A80 HydrophobicContact SD-CB 4.01Å; T76-A80 WeakPolarHBondContact O-CB 3.33Å; T76-A80 PolarHBondContact O-N 3.31Å; K77-A80 PolarHBondContact O-N 3.34Å; E78-A80 PolarHBondContact O-N 2.87Å; A80-A83 PolarHBondContact O-N 3.47Å; A80-Y84 WeakPolarHBondContact O-CB 3.31Å; A80-Y84 PolarHBondContact O-N 2.88Å
81	M	93.3	Very high	91.9	Very high	17 Å²	17	52.6 Å²	52.6	8%	0.084	28%	0.279	C	S	.	.	H	α-helix	trans	-62.3	-43.2	172.5	-73.8	172.8	174.5	0	0	111.6	E9 F12 A45 K77 E78 V85	E9-M81 HydrophobicContact CB-CE 4.45Å; E9-M81 HydrophobicContact CB-SD 4.18Å; E9-M81 HydrophobicContact CG-CE 4.05Å; E9-M81 HydrophobicContact CG-SD 4.43Å; F12-M81 HydrophobicContact CB-CB 3.95Å; F12-M81 HydrophobicContact CB-CG 3.86Å; F12-M81 HydrophobicContact CD1-CE 4.13Å; F12-M81 HydrophobicContact CD1-CG 4Å; F12-M81 HydrophobicContact CD2-CB 4.27Å; F12-M81 HydrophobicContact CD2-CG 4.03Å; F12-M81 HydrophobicContact CE1-CE 4.48Å; F12-M81 HydrophobicContact CG-CB 4.15Å; F12-M81 HydrophobicContact CG-CG 3.7Å; A45-M81 HydrophobicContact CB-CE 4.46Å; A45-M81 HydrophobicContact CB-CG 3.78Å; K77-M81 VanDerWaalsContact O-CG 3.24Å; K77-M81 WeakPolarHBondContact O-CG 3.43Å; K77-M81 PolarHBondContact O-N 3.2Å; E78-M81 PolarHBondContact O-N 3.19Å; M81-V85 VanDerWaalsContact O-CG2 3.3Å; M81-V85 WeakPolarHBondContact O-CG2 3.4Å; M81-V85 PolarHBondContact O-N 3.1Å
82	I	92.2	Very high	90.8	Very high	43 Å²	43	48.6 Å²	48.6	22%	0.221	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-50.3	176.3	-68.6	162.6	0	0	0	110.4	Y8 E78 E79 Y84 V85 E86	Y8-I82 HydrophobicContact CD1-CD1 4.04Å; Y8-I82 HydrophobicContact CD1-CG1 3.49Å; Y8-I82 VanDerWaalsContact CD1-CG1 3.49Å; Y8-I82 HydrophobicContact CD2-CD1 4.09Å; Y8-I82 HydrophobicContact CD2-CG1 4.28Å; Y8-I82 HydrophobicContact CE1-CD1 3.87Å; Y8-I82 HydrophobicContact CE1-CG1 3.67Å; Y8-I82 HydrophobicContact CE2-CD1 3.95Å; Y8-I82 HydrophobicContact CE2-CG1 4.46Å; Y8-I82 HydrophobicContact CG-CD1 4.16Å; Y8-I82 HydrophobicContact CG-CG1 3.83Å; E78-I82 WeakPolarHBondContact O-CD1 3.35Å; E78-I82 VanDerWaalsContact O-CG1 3.27Å; E78-I82 WeakPolarHBondContact O-CG1 3.29Å; E78-I82 PolarHBondContact O-N 2.86Å; E79-I82 PolarHBondContact O-N 3.49Å; I82-Y84 VanDerWaalsContact C-N 3.31Å; I82-Y84 PolarHBondContact O-N 3.49Å; I82-V85 WeakPolarHBondContact O-CB 3.33Å; I82-V85 PolarHBondContact O-N 2.91Å; I82-V85 VanDerWaalsContact O-N 3.11Å; I82-E86 HydrophobicContact CG2-CG 4.21Å; I82-E86 WeakPolarHBondContact CG2-OE1 3.15Å; I82-E86 WeakPolarHBondContact O-CG 3.43Å; I82-E86 PolarHBondContact O-N 3.49Å
83	A	94.1	Very high	90	Very high	19 Å²	19	53.1 Å²	53.1	16%	0.157	27%	0.271	C	S	.	.	H	α-helix	trans	-62.5	-35.3	-178.7	0	0	0	0	0	113.1	F41 E79 A80 E86 E87	F41-A83 HydrophobicContact CD1-CB 3.76Å; F41-A83 HydrophobicContact CD2-CB 4.26Å; F41-A83 HydrophobicContact CE1-CB 3.54Å; F41-A83 HydrophobicContact CE2-CB 4.05Å; F41-A83 HydrophobicContact CG-CB 4.13Å; F41-A83 HydrophobicContact CZ-CB 3.7Å; E79-A83 WeakPolarHBondContact O-CB 3.27Å; E79-A83 PolarHBondContact O-N 3Å; A80-A83 PolarHBondContact O-N 3.47Å; A83-E86 PolarHBondContact O-N 2.91Å; A83-E87 WeakPolarHBondContact O-CB 3.36Å; A83-E87 PolarHBondContact O-N 2.98Å
84	Y	93.4	Very high	88.9	Confident	8 Å²	8	56.2 Å²	56.2	3%	0.031	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-45.3	172.7	-169.1	-82.4	0	0	0	111.9	F12 A15 V16 I19 F38 F41 A80 I82 M88	F12-Y84 AromaticContact CD2-CD1 3.8Å; F12-Y84 HydrophobicContact CD2-CD1 3.8Å; F12-Y84 HydrophobicContact CD2-CD2 4.43Å; F12-Y84 HydrophobicContact CD2-CE1 4.44Å; F12-Y84 AromaticContact CD2-CG 3.8Å; F12-Y84 HydrophobicContact CD2-CG 3.8Å; F12-Y84 HydrophobicContact CE2-CD1 4Å; F12-Y84 AromaticContact CE2-CD2 3.88Å; F12-Y84 HydrophobicContact CE2-CD2 3.88Å; F12-Y84 HydrophobicContact CE2-CE1 4.43Å; F12-Y84 HydrophobicContact CE2-CE2 4.34Å; F12-Y84 AromaticContact CE2-CG 3.71Å; F12-Y84 HydrophobicContact CE2-CG 3.71Å; A15-Y84 HydrophobicContact CB-CD1 3.8Å; A15-Y84 HydrophobicContact CB-CE1 3.67Å; V16-Y84 HydrophobicContact CG2-CD1 4.5Å; V16-Y84 HydrophobicContact CG2-CE1 3.72Å; V16-Y84 HydrophobicContact CG2-CE2 4.41Å; I19-Y84 HydrophobicContact CD1-CE1 3.68Å; I19-Y84 WeakPolarHBondContact CD1-OH 3.24Å; F38-Y84 HydrophobicContact CB-CE2 3.88Å; F38-Y84 HydrophobicContact CD1-CD1 4.48Å; F38-Y84 AromaticContact CD1-CD2 3.87Å; F38-Y84 HydrophobicContact CD1-CD2 3.87Å; F38-Y84 HydrophobicContact CD1-CE1 4.33Å; F38-Y84 AromaticContact CD1-CE2 3.68Å; F38-Y84 HydrophobicContact CD1-CE2 3.68Å; F38-Y84 HydrophobicContact CD1-CG 4.27Å; F38-Y84 AromaticContact CD1-CZ 3.92Å; F38-Y84 HydrophobicContact CG-CE2 4.19Å; F38-Y84 WeakPolarHBondContact O-CE2 3.45Å; F41-Y84 HydrophobicContact CB-CD2 3.95Å; F41-Y84 HydrophobicContact CB-CG 4.49Å; A80-Y84 WeakPolarHBondContact O-CB 3.31Å; A80-Y84 PolarHBondContact O-N 2.88Å; I82-Y84 VanDerWaalsContact C-N 3.31Å; I82-Y84 PolarHBondContact O-N 3.49Å; Y84-M88 WeakPolarHBondContact O-CB 3.47Å; Y84-M88 PolarHBondContact O-N 3.13Å; Y84-M88 VanDerWaalsContact O-N 3.1Å
85	V	90.7	Very high	87.5	Confident	17 Å²	17	50.6 Å²	50.6	10%	0.103	25%	0.252	C	S	.	.	H	α-helix	trans	-66.5	-39.7	178	166.9	0	0	0	0	111.4	R11 F12 A15 M81 I82 K89 F111 V115	R11-V85 HydrophobicContact CB-CG1 4.49Å; R11-V85 HydrophobicContact CB-CG2 3.97Å; F12-V85 HydrophobicContact CB-CG2 4.48Å; A15-V85 HydrophobicContact CB-CG2 4.34Å; M81-V85 VanDerWaalsContact O-CG2 3.3Å; M81-V85 WeakPolarHBondContact O-CG2 3.4Å; M81-V85 PolarHBondContact O-N 3.1Å; I82-V85 WeakPolarHBondContact O-CB 3.33Å; I82-V85 PolarHBondContact O-N 2.91Å; I82-V85 VanDerWaalsContact O-N 3.11Å; V85-K89 WeakPolarHBondContact O-CB 3.24Å; V85-K89 PolarHBondContact O-N 3.03Å; V85-F111 HydrophobicContact CG1-CE2 4.1Å; V85-F111 HydrophobicContact CG1-CZ 3.92Å; V85-F111 HydrophobicContact CG2-CE2 4.3Å; V85-V115 HydrophobicContact CG1-CG2 4.35Å
86	E	90.6	Very high	85.9	Confident	125 Å²	125	52.8 Å²	52.8	58%	0.584	27%	0.27	S	S	*	.	H	α-helix	trans	-72.1	-42.9	178.5	-72.8	-178.4	173.9	0	0	113	I82 A83 M88 K89 K90	I82-E86 HydrophobicContact CG2-CG 4.21Å; I82-E86 WeakPolarHBondContact CG2-OE1 3.15Å; I82-E86 WeakPolarHBondContact O-CG 3.43Å; I82-E86 PolarHBondContact O-N 3.49Å; A83-E86 PolarHBondContact O-N 2.91Å; E86-M88 VanDerWaalsContact C-N 3.34Å; E86-M88 PolarHBondContact O-N 3.16Å; E86-K89 PolarHBondContact O-N 2.68Å; E86-K90 VanDerWaalsContact O-CB 3.29Å; E86-K90 WeakPolarHBondContact O-CB 3.42Å; E86-K90 PolarHBondContact O-N 3.41Å
87	E	90.1	Very high	83.9	Confident	25 Å²	25	55.3 Å²	55.3	12%	0.117	28%	0.278	C	S	.	.	H	α-helix	trans	-65.6	-37.6	175.3	-172.5	76	-154.3	0	0	110.6	R37 F38 F41 A83 K90 I91	R37-E87 WeakPolarHBondContact CD-OE1 3.3Å; R37-E87 IonicContact CZ-OE1 3.59Å; R37-E87 IonicContact CZ-OE2 3.61Å; R37-E87 IonicContact NE-OE1 2.66Å; R37-E87 IonicContact NH1-OE1 2.7Å; R37-E87 PolarHBondContact NH1-OE1 3.46Å; R37-E87 IonicContact NH1-OE2 3.3Å; R37-E87 PolarHBondContact NH1-OE2 3.11Å; F38-E87 HydrophobicContact CE1-CB 4.42Å; F38-E87 HydrophobicContact CE1-CG 4.5Å; F41-E87 HydrophobicContact CE2-CB 4.29Å; A83-E87 WeakPolarHBondContact O-CB 3.36Å; A83-E87 PolarHBondContact O-N 2.98Å; E87-K90 PolarHBondContact O-N 2.97Å; E87-K90 IonicContact OE1-NZ 3.8Å; E87-K90 IonicContact OE2-NZ 2.78Å; E87-I91 HydrophobicContact CG-CD1 4.14Å; E87-I91 WeakPolarHBondContact O-CD1 3.16Å; E87-I91 VanDerWaalsContact O-CG1 3.24Å; E87-I91 WeakPolarHBondContact O-CG1 3.33Å; E87-I91 PolarHBondContact O-N 2.81Å
88	M	85.3	Confident	82.2	Confident	7 Å²	7	54.6 Å²	54.6	3%	0.034	28%	0.281	C	S	.	.	H	α-helix	trans	-64	-45.4	172.7	-163.8	180	74.6	0	0	112.2	A15 V18 I19 F38 Y84 E86 K90 I91 I92 F111	A15-M88 HydrophobicContact CB-CE 3.58Å; A15-M88 HydrophobicContact CB-SD 3.8Å; V18-M88 HydrophobicContact CB-CE 4.49Å; V18-M88 HydrophobicContact CB-SD 4.14Å; V18-M88 HydrophobicContact CG1-CE 4.42Å; V18-M88 HydrophobicContact CG1-SD 3.85Å; I19-M88 HydrophobicContact CD1-CB 4.4Å; I19-M88 HydrophobicContact CD1-CG 4.01Å; I19-M88 HydrophobicContact CD1-SD 3.64Å; I19-M88 HydrophobicContact CG1-CG 4.46Å; I19-M88 HydrophobicContact CG1-SD 3.81Å; F38-M88 HydrophobicContact CE1-CB 3.87Å; F38-M88 HydrophobicContact CE1-CG 4.5Å; F38-M88 HydrophobicContact CZ-CB 3.96Å; F38-M88 HydrophobicContact CZ-CG 4.24Å; Y84-M88 WeakPolarHBondContact O-CB 3.47Å; Y84-M88 PolarHBondContact O-N 3.13Å; Y84-M88 VanDerWaalsContact O-N 3.1Å; E86-M88 VanDerWaalsContact C-N 3.34Å; E86-M88 PolarHBondContact O-N 3.16Å; M88-K90 PolarHBondContact O-N 2.62Å; M88-I91 PolarHBondContact O-N 3.36Å; M88-I92 HydrophobicContact CE-CD1 4.49Å; M88-I92 HydrophobicContact CG-CD1 4.3Å; M88-I92 WeakPolarHBondContact O-CD1 3.45Å; M88-I92 WeakPolarHBondContact O-CG1 3.4Å; M88-I92 PolarHBondContact O-N 2.69Å; M88-I92 VanDerWaalsContact O-N 3.15Å; M88-F111 HydrophobicContact CE-CD1 3.55Å; M88-F111 HydrophobicContact CE-CD2 3.82Å; M88-F111 HydrophobicContact CE-CE1 3.27Å; M88-F111 HydrophobicContact CE-CE2 3.57Å; M88-F111 HydrophobicContact CE-CG 3.81Å; M88-F111 HydrophobicContact CE-CZ 3.26Å
89	K	84	Confident	80.6	Confident	53 Å²	53	59.8 Å²	59.8	23%	0.23	31%	0.305	C	S	.	.	H	α-helix	trans	-58.2	-48.9	175.4	174.5	161.7	177.3	153.2	0	111.8	V85 E86 I91 I92 E93 Y112 E116	V85-K89 WeakPolarHBondContact O-CB 3.24Å; V85-K89 PolarHBondContact O-N 3.03Å; E86-K89 PolarHBondContact O-N 2.68Å; K89-I91 VanDerWaalsContact C-N 3.28Å; K89-I91 PolarHBondContact O-N 2.99Å; K89-I92 WeakPolarHBondContact O-CB 3.36Å; K89-I92 PolarHBondContact O-N 3.37Å; K89-I92 VanDerWaalsContact O-N 3.15Å; K89-E93 WeakPolarHBondContact CE-OE1 3.22Å; K89-E93 HydrophobicContact CG-CG 4.33Å; K89-E93 IonicContact NZ-OE1 3.64Å; K89-E93 WeakPolarHBondContact O-CG 3.35Å; K89-E93 PolarHBondContact O-N 2.92Å; K89-Y112 VanDerWaalsContact CE-OH 3.3Å; K89-Y112 WeakPolarHBondContact CE-OH 3.18Å; K89-Y112 PolarHBondContact NZ-OH 3.5Å; K89-E116 IonicContact NZ-OE1 3.9Å
90	K	85.1	Confident	78.8	Confident	99 Å²	99	60.7 Å²	60.7	43%	0.43	31%	0.307	S	S	.	.	H	α-helix	trans	-56.6	-41.6	177.3	175.4	-175.2	170.7	-165.5	0	112	E86 E87 M88 E93 T94	E86-K90 VanDerWaalsContact O-CB 3.29Å; E86-K90 WeakPolarHBondContact O-CB 3.42Å; E86-K90 PolarHBondContact O-N 3.41Å; E87-K90 PolarHBondContact O-N 2.97Å; E87-K90 IonicContact OE1-NZ 3.8Å; E87-K90 IonicContact OE2-NZ 2.78Å; M88-K90 PolarHBondContact O-N 2.62Å; K90-E93 PolarHBondContact O-N 3.02Å; K90-T94 WeakPolarHBondContact O-CG2 3.44Å; K90-T94 PolarHBondContact O-N 3.19Å; K90-T94 PolarHBondContact O-OG1 2.91Å
91	I	81.1	Confident	77	Confident	17 Å²	17	60.7 Å²	60.7	9%	0.087	31%	0.307	C	S	.	.	H	α-helix	trans	-61	-46.8	177.2	-74.5	162.2	0	0	0	110.7	F28 M34 F38 E87 M88 K89 E93 T94 M95	F28-I91 HydrophobicContact CE1-CG2 4.39Å; F28-I91 HydrophobicContact CZ-CG2 3.73Å; M34-I91 HydrophobicContact CB-CD1 4.27Å; M34-I91 HydrophobicContact CE-CD1 3.68Å; M34-I91 HydrophobicContact CE-CG1 3.87Å; M34-I91 HydrophobicContact CE-CG2 3.86Å; M34-I91 HydrophobicContact CG-CD1 4.01Å; F38-I91 HydrophobicContact CE2-CD1 3.57Å; F38-I91 HydrophobicContact CZ-CD1 3.47Å; F38-I91 VanDerWaalsContact CZ-CD1 3.47Å; E87-I91 HydrophobicContact CG-CD1 4.14Å; E87-I91 WeakPolarHBondContact O-CD1 3.16Å; E87-I91 VanDerWaalsContact O-CG1 3.24Å; E87-I91 WeakPolarHBondContact O-CG1 3.33Å; E87-I91 PolarHBondContact O-N 2.81Å; M88-I91 PolarHBondContact O-N 3.36Å; K89-I91 VanDerWaalsContact C-N 3.28Å; K89-I91 PolarHBondContact O-N 2.99Å; I91-E93 PolarHBondContact O-N 3.29Å; I91-T94 PolarHBondContact O-N 2.82Å; I91-T94 PolarHBondContact O-OG1 2.75Å; I91-M95 WeakPolarHBondContact O-CB 3.09Å; I91-M95 PolarHBondContact O-N 2.94Å; I91-M95 VanDerWaalsContact O-N 3.1Å
92	I	74.2	Confident	75.5	Confident	8 Å²	8	66.2 Å²	66.2	4%	0.041	33%	0.333	C	S	.	.	H	α-helix	trans	-59.5	-45.5	175.6	-59.9	153.2	0	0	0	111	M88 K89 T94 M95 L105 I108 Y112	M88-I92 HydrophobicContact CE-CD1 4.49Å; M88-I92 HydrophobicContact CG-CD1 4.3Å; M88-I92 WeakPolarHBondContact O-CD1 3.45Å; M88-I92 WeakPolarHBondContact O-CG1 3.4Å; M88-I92 PolarHBondContact O-N 2.69Å; M88-I92 VanDerWaalsContact O-N 3.15Å; K89-I92 WeakPolarHBondContact O-CB 3.36Å; K89-I92 PolarHBondContact O-N 3.37Å; K89-I92 VanDerWaalsContact O-N 3.15Å; I92-T94 VanDerWaalsContact C-N 3.32Å; I92-T94 PolarHBondContact O-N 3.29Å; I92-M95 PolarHBondContact O-N 2.99Å; I92-L105 HydrophobicContact CG2-CD2 3.88Å; I92-I108 HydrophobicContact CD1-CD1 3.87Å; I92-I108 HydrophobicContact CD1-CG2 3.81Å; I92-I108 HydrophobicContact CG1-CD1 3.97Å; I92-Y112 HydrophobicContact CD1-CE2 4.34Å
93	E	78.2	Confident	74.1	Confident	122 Å²	122	71.1 Å²	71.1	57%	0.57	36%	0.355	S	S	*	.	H	α-helix	trans	-66.1	-29.9	178.9	-70.9	178.8	154.7	0	0	113.5	K89 K90 I91	K89-E93 WeakPolarHBondContact CE-OE1 3.22Å; K89-E93 HydrophobicContact CG-CG 4.33Å; K89-E93 IonicContact NZ-OE1 3.64Å; K89-E93 WeakPolarHBondContact O-CG 3.35Å; K89-E93 PolarHBondContact O-N 2.92Å; K90-E93 PolarHBondContact O-N 3.02Å; I91-E93 PolarHBondContact O-N 3.29Å
94	T	70.9	Confident	72.6	Confident	102 Å²	102	71.4 Å²	71.4	63%	0.626	35%	0.354	S	S	*	.	H	α-helix	trans	-86.6	-8.9	176.2	57.4	0	0	0	0	114.4	K90 I91 I92	K90-T94 WeakPolarHBondContact O-CG2 3.44Å; K90-T94 PolarHBondContact O-N 3.19Å; K90-T94 PolarHBondContact O-OG1 2.91Å; I91-T94 PolarHBondContact O-N 2.82Å; I91-T94 PolarHBondContact O-OG1 2.75Å; I92-T94 VanDerWaalsContact C-N 3.32Å; I92-T94 PolarHBondContact O-N 3.29Å
95	M	65.6	Low	71.2	Confident	31 Å²	31	73.8 Å²	73.8	15%	0.153	37%	0.367	C	S	.	.	S	Bend	trans	-82.7	128.4	-175.9	-164	172.3	178	0	0	110.7	F28 I91 I92 M97 V101 L104	F28-M95 HydrophobicContact CB-CE 3.66Å; F28-M95 HydrophobicContact CD2-CE 3.48Å; F28-M95 VanDerWaalsContact CD2-CE 3.48Å; F28-M95 HydrophobicContact CD2-SD 3.91Å; F28-M95 HydrophobicContact CE2-CE 4.23Å; F28-M95 HydrophobicContact CE2-SD 4.09Å; F28-M95 HydrophobicContact CG-CE 3.64Å; F28-M95 HydrophobicContact CG-SD 4.16Å; I91-M95 WeakPolarHBondContact O-CB 3.09Å; I91-M95 PolarHBondContact O-N 2.94Å; I91-M95 VanDerWaalsContact O-N 3.1Å; I92-M95 PolarHBondContact O-N 2.99Å; M95-M97 PolarHBondContact O-N 3.29Å; M95-V101 HydrophobicContact CE-CG2 3.52Å; M95-V101 HydrophobicContact CG-CG2 3.86Å; M95-V101 HydrophobicContact SD-CG1 4.47Å; M95-V101 HydrophobicContact SD-CG2 3.72Å; M95-L104 HydrophobicContact SD-CD2 4.21Å
96	P	61.1	Low	69.8	Low	97 Å²	97	80.6 Å²	80.6	63%	0.63	40%	0.397	S	S	*	.			trans	-66.9	122.5	179.2	26.8	-33.7	0	0	0	110.3	T98 V101	P96-T98 PolarHBondContact O-N 3.42Å; P96-V101 WeakPolarHBondContact O-CG2 3.31Å
97	M	53.8	Low	68.5	Low	125 Å²	125	78.1 Å²	78.1	62%	0.616	39%	0.39	S	S	*	.			trans	-58.9	113.4	178.7	-67	-64	160.1	0	0	110.2	M95 V101 L105	M95-M97 PolarHBondContact O-N 3.29Å; M97-V101 HydrophobicContact CE-CG1 4.17Å; M97-V101 HydrophobicContact SD-CB 4.27Å; M97-V101 HydrophobicContact SD-CG1 3.59Å; M97-V101 VanDerWaalsContact SD-CG1 3.59Å; M97-L105 HydrophobicContact CE-CD1 4.05Å; M97-L105 HydrophobicContact SD-CD1 3.76Å
98	T	60.6	Low	67.2	Low	68 Å²	68	77.1 Å²	77.1	42%	0.417	39%	0.386	S	S	.	.			trans	-137.7	163.4	175.3	53.2	0	0	0	0	107	P96 K100 V101 E102	P96-T98 PolarHBondContact O-N 3.42Å; T98-K100 PolarHBondContact O-N 3.45Å; T98-V101 WeakPolarHBondContact O-CA 3.38Å; T98-V101 WeakPolarHBondContact O-CB 3.43Å; T98-V101 PolarHBondContact O-N 3.31Å; T98-E102 PolarHBondContact O-N 3.01Å
99	E	59.3	Low	66.2	Low	168 Å²	168	78.3 Å²	78.3	79%	0.785	40%	0.4	S	S	*	.	H	α-helix	trans	-52.4	-32.3	-176.1	-59.8	166.8	146.7	0	0	113	V101 E102 E103	E99-V101 VanDerWaalsContact C-N 3.32Å; E99-V101 PolarHBondContact O-N 2.96Å; E99-E102 WeakPolarHBondContact O-CB 3.2Å; E99-E102 PolarHBondContact O-N 3.49Å; E99-E102 VanDerWaalsContact O-N 3.17Å; E99-E103 PolarHBondContact O-N 2.98Å
100	K	55.1	Low	65.4	Low	123 Å²	123	79.4 Å²	79.4	54%	0.535	41%	0.412	S	S	.	.	H	α-helix	trans	-69.5	-24.1	175.5	-69.3	141.4	162.1	179.5	0	114.2	S27 T98 L104	S27-K100 WeakPolarHBondContact OG-CB 3.5Å; S27-K100 WeakPolarHBondContact OG-CD 3.49Å; S27-K100 WeakPolarHBondContact OG-CG 3.5Å; T98-K100 PolarHBondContact O-N 3.45Å; K100-L104 PolarHBondContact O-N 3.18Å
101	V	59.3	Low	64.4	Low	0 Å²	0	74.9 Å²	74.9	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-80.3	-25.9	172.2	-174.3	0	0	0	0	110.6	M95 P96 M97 T98 E99 L104 L105	M95-V101 HydrophobicContact CE-CG2 3.52Å; M95-V101 HydrophobicContact CG-CG2 3.86Å; M95-V101 HydrophobicContact SD-CG1 4.47Å; M95-V101 HydrophobicContact SD-CG2 3.72Å; P96-V101 WeakPolarHBondContact O-CG2 3.31Å; M97-V101 HydrophobicContact CE-CG1 4.17Å; M97-V101 HydrophobicContact SD-CB 4.27Å; M97-V101 HydrophobicContact SD-CG1 3.59Å; M97-V101 VanDerWaalsContact SD-CG1 3.59Å; T98-V101 WeakPolarHBondContact O-CA 3.38Å; T98-V101 WeakPolarHBondContact O-CB 3.43Å; T98-V101 PolarHBondContact O-N 3.31Å; E99-V101 VanDerWaalsContact C-N 3.32Å; E99-V101 PolarHBondContact O-N 2.96Å; V101-L104 WeakPolarHBondContact O-CB 3.31Å; V101-L104 PolarHBondContact O-N 2.95Å; V101-L105 HydrophobicContact CG1-CD1 4.06Å; V101-L105 HydrophobicContact CG1-CG 4.11Å; V101-L105 VanDerWaalsContact O-CB 3.23Å; V101-L105 WeakPolarHBondContact O-CB 3.42Å; V101-L105 WeakPolarHBondContact O-CG 3.49Å; V101-L105 PolarHBondContact O-N 2.95Å
102	E	60	Low	63.5	Low	133 Å²	133	76.4 Å²	76.4	62%	0.621	40%	0.398	S	S	*	.	H	α-helix	trans	-68.5	-39.5	174.3	-57.8	-172	163.5	0	0	111.4	T98 E99 L105 H106	T98-E102 PolarHBondContact O-N 3.01Å; E99-E102 WeakPolarHBondContact O-CB 3.2Å; E99-E102 PolarHBondContact O-N 3.49Å; E99-E102 VanDerWaalsContact O-N 3.17Å; E102-L105 PolarHBondContact O-N 3.37Å; E102-H106 WeakPolarHBondContact O-CB 3.26Å; E102-H106 PolarHBondContact O-N 2.9Å
103	E	62.8	Low	63.1	Low	146 Å²	146	82.8 Å²	82.8	68%	0.682	43%	0.427	S	S	*	.	H	α-helix	trans	-61	-46.7	170.5	-173.7	175.1	-157.1	0	0	111.4	E99 L105 H106 V107	E99-E103 PolarHBondContact O-N 2.98Å; E103-L105 PolarHBondContact O-N 3.14Å; E103-H106 PolarHBondContact O-N 2.67Å; E103-V107 PolarHBondContact O-N 2.82Å
104	L	62.7	Low	62.3	Low	26 Å²	26	79.9 Å²	79.9	14%	0.136	42%	0.415	C	S	.	.	H	α-helix	trans	-59.3	-43.8	174.4	-167.5	104.8	0	0	0	111.9	L22 M95 K100 V101 H106 V107 I108	L22-L104 HydrophobicContact CD2-CD1 3.5Å; M95-L104 HydrophobicContact SD-CD2 4.21Å; K100-L104 PolarHBondContact O-N 3.18Å; V101-L104 WeakPolarHBondContact O-CB 3.31Å; V101-L104 PolarHBondContact O-N 2.95Å; L104-H106 VanDerWaalsContact C-N 3.33Å; L104-H106 PolarHBondContact O-N 3.31Å; L104-V107 PolarHBondContact O-N 3.22Å; L104-I108 HydrophobicContact CD2-CD1 3.58Å; L104-I108 HydrophobicContact CG-CD1 3.66Å; L104-I108 WeakPolarHBondContact O-CB 3.18Å; L104-I108 WeakPolarHBondContact O-CD1 3.36Å; L104-I108 VanDerWaalsContact O-CG1 3.24Å; L104-I108 WeakPolarHBondContact O-CG1 3.49Å; L104-I108 PolarHBondContact O-N 3.35Å
105	L	64.1	Low	61.8	Low	58 Å²	58	76 Å²	76	30%	0.304	39%	0.391	S	S	.	.	H	α-helix	trans	-67.1	-31	176.9	-77.6	171.1	0	0	0	112.3	I92 M97 V101 E102 E103 V107 I108 G109	I92-L105 HydrophobicContact CG2-CD2 3.88Å; M97-L105 HydrophobicContact CE-CD1 4.05Å; M97-L105 HydrophobicContact SD-CD1 3.76Å; V101-L105 HydrophobicContact CG1-CD1 4.06Å; V101-L105 HydrophobicContact CG1-CG 4.11Å; V101-L105 VanDerWaalsContact O-CB 3.23Å; V101-L105 WeakPolarHBondContact O-CB 3.42Å; V101-L105 WeakPolarHBondContact O-CG 3.49Å; V101-L105 PolarHBondContact O-N 2.95Å; E102-L105 PolarHBondContact O-N 3.37Å; E103-L105 PolarHBondContact O-N 3.14Å; L105-V107 VanDerWaalsContact C-N 3.33Å; L105-I108 CarbonylContact O-C 3.53Å; L105-I108 PolarHBondContact O-N 3.37Å; L105-G109 WeakPolarHBondContact O-CA 3.24Å; L105-G109 PolarHBondContact O-N 3.44Å
106	H	63.2	Low	61.6	Low	159 Å²	159	79.3 Å²	79.3	74%	0.736	41%	0.406	S	S	*	.	H	α-helix	trans	-71.1	-30.2	174.4	-159.3	-43.9	0	0	0	112	E102 E103 L104	E102-H106 WeakPolarHBondContact O-CB 3.26Å; E102-H106 PolarHBondContact O-N 2.9Å; E103-H106 PolarHBondContact O-N 2.67Å; L104-H106 VanDerWaalsContact C-N 3.33Å; L104-H106 PolarHBondContact O-N 3.31Å
107	V	61.7	Low	61.3	Low	74 Å²	74	79.9 Å²	79.9	45%	0.448	40%	0.404	S	S	.	.	H	α-helix	trans	-74.4	-32.8	169.6	176.6	0	0	0	0	111.6	E103 L104 L105	E103-V107 PolarHBondContact O-N 2.82Å; L104-V107 PolarHBondContact O-N 3.22Å; L105-V107 VanDerWaalsContact C-N 3.33Å
108	I	64.4	Low	61.1	Low	4 Å²	4	80.5 Å²	80.5	2%	0.021	40%	0.403	C	S	.	.	H	α-helix	trans	-87.2	-19.7	-177.1	-73.8	167.1	0	0	0	113.4	V18 I92 L104 L105 F111 Y112	V18-I108 HydrophobicContact CB-CG1 4.49Å; V18-I108 HydrophobicContact CG1-CD1 3.97Å; V18-I108 HydrophobicContact CG1-CG1 3.56Å; V18-I108 HydrophobicContact CG2-CG1 4.04Å; I92-I108 HydrophobicContact CD1-CD1 3.87Å; I92-I108 HydrophobicContact CD1-CG2 3.81Å; I92-I108 HydrophobicContact CG1-CD1 3.97Å; L104-I108 HydrophobicContact CD2-CD1 3.58Å; L104-I108 HydrophobicContact CG-CD1 3.66Å; L104-I108 WeakPolarHBondContact O-CB 3.18Å; L104-I108 WeakPolarHBondContact O-CD1 3.36Å; L104-I108 VanDerWaalsContact O-CG1 3.24Å; L104-I108 WeakPolarHBondContact O-CG1 3.49Å; L104-I108 PolarHBondContact O-N 3.35Å; L105-I108 CarbonylContact O-C 3.53Å; L105-I108 PolarHBondContact O-N 3.37Å; I108-F111 HydrophobicContact CG2-CD1 4.04Å; I108-F111 CarbonylContact O-C 3.58Å; I108-F111 WeakPolarHBondContact O-CA 3.25Å; I108-F111 WeakPolarHBondContact O-CB 3.42Å; I108-F111 PolarHBondContact O-N 3.43Å; I108-Y112 HydrophobicContact CG2-CD2 3.9Å; I108-Y112 PolarHBondContact O-N 3.2Å
109	G	63.9	Low	60.5	Low	32 Å²	32	86.1 Å²	86.1	33%	0.33	42%	0.422	S	S	.	.	H	α-helix	trans	-48.8	-49.8	-178.5	0	0	0	0	0	113.8	L105 F111 Y112 E113	L105-G109 WeakPolarHBondContact O-CA 3.24Å; L105-G109 PolarHBondContact O-N 3.44Å; G109-F111 VanDerWaalsContact C-N 3.28Å; G109-F111 PolarHBondContact O-N 3.28Å; G109-Y112 PolarHBondContact O-N 3.32Å; G109-E113 PolarHBondContact O-N 2.78Å
110	P	66.9	Low	59.6	Low	76 Å²	76	84.3 Å²	84.3	49%	0.494	42%	0.418	S	S	.	.	H	α-helix	trans	-60.5	-31.6	174.8	-25.4	35.5	0	0	0	114.2	I114	P110-I114 VanDerWaalsContact O-CD1 3.23Å; P110-I114 WeakPolarHBondContact O-CD1 3.3Å; P110-I114 WeakPolarHBondContact O-CG1 3.37Å; P110-I114 PolarHBondContact O-N 2.96Å
111	F	63.7	Low	58.8	Low	3 Å²	3	82.4 Å²	82.4	1%	0.013	42%	0.419	C	S	.	.	H	α-helix	trans	-72	-40.3	171.9	159.1	-89.1	0	0	0	111.3	A14 A15 V18 V85 M88 I108 G109 I114 V115	A14-F111 HydrophobicContact CB-CB 4.23Å; A14-F111 HydrophobicContact CB-CD2 3.99Å; A15-F111 HydrophobicContact CB-CD2 4.16Å; A15-F111 HydrophobicContact CB-CE2 3.77Å; A15-F111 HydrophobicContact CB-CZ 4.49Å; V18-F111 HydrophobicContact CG2-CB 4.46Å; V85-F111 HydrophobicContact CG1-CE2 4.1Å; V85-F111 HydrophobicContact CG1-CZ 3.92Å; V85-F111 HydrophobicContact CG2-CE2 4.3Å; M88-F111 HydrophobicContact CE-CD1 3.55Å; M88-F111 HydrophobicContact CE-CD2 3.82Å; M88-F111 HydrophobicContact CE-CE1 3.27Å; M88-F111 HydrophobicContact CE-CE2 3.57Å; M88-F111 HydrophobicContact CE-CG 3.81Å; M88-F111 HydrophobicContact CE-CZ 3.26Å; I108-F111 HydrophobicContact CG2-CD1 4.04Å; I108-F111 CarbonylContact O-C 3.58Å; I108-F111 WeakPolarHBondContact O-CA 3.25Å; I108-F111 WeakPolarHBondContact O-CB 3.42Å; I108-F111 PolarHBondContact O-N 3.43Å; G109-F111 VanDerWaalsContact C-N 3.28Å; G109-F111 PolarHBondContact O-N 3.28Å; F111-I114 PolarHBondContact O-N 2.94Å; F111-V115 HydrophobicContact CD1-CG2 4.34Å; F111-V115 HydrophobicContact CD2-CG2 4.05Å; F111-V115 HydrophobicContact CE1-CG2 3.96Å; F111-V115 HydrophobicContact CE2-CG2 3.64Å; F111-V115 HydrophobicContact CG-CG2 4.39Å; F111-V115 HydrophobicContact CZ-CG2 3.61Å; F111-V115 WeakPolarHBondContact O-CB 3.41Å; F111-V115 VanDerWaalsContact O-CG2 3.23Å; F111-V115 WeakPolarHBondContact O-CG2 3.42Å; F111-V115 PolarHBondContact O-N 3.22Å
112	Y	63	Low	58	Low	50 Å²	50	91.7 Å²	91.7	20%	0.196	46%	0.46	C	S	.	.	H	α-helix	trans	-65.2	-42.2	-179.9	-122.7	-102	0	0	0	111.8	K89 I92 I108 G109 I114 V115 E116	K89-Y112 VanDerWaalsContact CE-OH 3.3Å; K89-Y112 WeakPolarHBondContact CE-OH 3.18Å; K89-Y112 PolarHBondContact NZ-OH 3.5Å; I92-Y112 HydrophobicContact CD1-CE2 4.34Å; I108-Y112 HydrophobicContact CG2-CD2 3.9Å; I108-Y112 PolarHBondContact O-N 3.2Å; G109-Y112 PolarHBondContact O-N 3.32Å; Y112-I114 PolarHBondContact O-N 2.91Å; Y112-V115 WeakPolarHBondContact O-CA 3.3Å; Y112-V115 PolarHBondContact O-N 2.84Å; Y112-E116 HydrophobicContact CD1-CG 3.87Å; Y112-E116 HydrophobicContact CE1-CG 4.19Å; Y112-E116 WeakPolarHBondContact CE1-OE1 3.43Å; Y112-E116 WeakPolarHBondContact O-CG 3.39Å; Y112-E116 PolarHBondContact O-N 3.19Å
113	E	65.3	Low	57	Low	142 Å²	142	88.8 Å²	88.8	66%	0.664	45%	0.454	S	S	*	.	H	α-helix	trans	-53.4	-54.7	172.8	-169.3	169.8	-155.8	0	0	110.9	G109 V115 E116	G109-E113 PolarHBondContact O-N 2.78Å; E113-V115 PolarHBondContact O-N 3.09Å; E113-V115 VanDerWaalsContact O-N 3.12Å; E113-E116 PolarHBondContact O-N 3.38Å
114	I	61.7	Low	56.1	Low	61 Å²	61	85.1 Å²	85.1	31%	0.313	45%	0.445	S	S	.	.	H	α-helix	trans	-60.8	-23.6	176.5	-62.3	166.9	0	0	0	112.6	T10 R11 P110 F111 Y112	T10-I114 HydrophobicContact CG2-CG2 4.15Å; R11-I114 HydrophobicContact CG-CG2 3.82Å; R11-I114 PolarHBondContact NE-O 2.76Å; R11-I114 PolarHBondContact NH2-O 3.5Å; P110-I114 VanDerWaalsContact O-CD1 3.23Å; P110-I114 WeakPolarHBondContact O-CD1 3.3Å; P110-I114 WeakPolarHBondContact O-CG1 3.37Å; P110-I114 PolarHBondContact O-N 2.96Å; F111-I114 PolarHBondContact O-N 2.94Å; Y112-I114 PolarHBondContact O-N 2.91Å
115	V	60	Low	55.2	Low	19 Å²	19	90.2 Å²	90.2	12%	0.115	47%	0.472	C	S	.	.	H	α-helix	trans	-86.8	-38.7	-179.5	166.7	0	0	0	0	113.4	R11 V85 F111 Y112 E113	R11-V115 HydrophobicContact CB-CG2 4.4Å; R11-V115 HydrophobicContact CG-CG2 3.89Å; R11-V115 VanDerWaalsContact CZ-CA 3.44Å; R11-V115 PolarHBondContact NH1-O 3.3Å; R11-V115 VanDerWaalsContact NH2-C 3.28Å; R11-V115 PolarHBondContact NH2-O 2.94Å; V85-V115 HydrophobicContact CG1-CG2 4.35Å; F111-V115 HydrophobicContact CD1-CG2 4.34Å; F111-V115 HydrophobicContact CD2-CG2 4.05Å; F111-V115 HydrophobicContact CE1-CG2 3.96Å; F111-V115 HydrophobicContact CE2-CG2 3.64Å; F111-V115 HydrophobicContact CG-CG2 4.39Å; F111-V115 HydrophobicContact CZ-CG2 3.61Å; F111-V115 WeakPolarHBondContact O-CB 3.41Å; F111-V115 VanDerWaalsContact O-CG2 3.23Å; F111-V115 WeakPolarHBondContact O-CG2 3.42Å; F111-V115 PolarHBondContact O-N 3.22Å; Y112-V115 WeakPolarHBondContact O-CA 3.3Å; Y112-V115 PolarHBondContact O-N 2.84Å; E113-V115 PolarHBondContact O-N 3.09Å; E113-V115 VanDerWaalsContact O-N 3.12Å
116	E	62.2	Low	54.4	Low	102 Å²	102	95.6 Å²	95.6	48%	0.477	50%	0.5	S	S	.	.	H	α-helix	trans	-87.5	-16	-169.2	-61.9	-146.5	132.1	0	0	115.3	K89 Y112 E113 K118 K119	K89-E116 IonicContact NZ-OE1 3.9Å; Y112-E116 HydrophobicContact CD1-CG 3.87Å; Y112-E116 HydrophobicContact CE1-CG 4.19Å; Y112-E116 WeakPolarHBondContact CE1-OE1 3.43Å; Y112-E116 WeakPolarHBondContact O-CG 3.39Å; Y112-E116 PolarHBondContact O-N 3.19Å; E113-E116 PolarHBondContact O-N 3.38Å; E116-K118 PolarHBondContact O-N 2.87Å; E116-K119 PolarHBondContact O-N 2.98Å
117	D	53.6	Low	53.5	Low	108 Å²	108	93.5 Å²	93.5	58%	0.578	50%	0.499	S	S	*	.	H	α-helix	trans	-43.9	-28.6	179.5	-84.6	-31.8	0	0	0	116.4	K119 S121	D117-K119 VanDerWaalsContact C-N 3.3Å; D117-K119 PolarHBondContact O-N 3.25Å; D117-S121 PolarHBondContact O-OG 3.47Å
118	K	50.5	Low	52.8	Low	138 Å²	138	95.1 Å²	95.1	60%	0.6	51%	0.514	S	S	*	.	H	α-helix	trans	-78.1	-9.1	-178	-154.2	173.2	-177.2	179.2	0	114	E116	E116-K118 PolarHBondContact O-N 2.87Å
119	K	48.1	Very low	51.9	Low	187 Å²	187	102.7 Å²	102.7	81%	0.813	55%	0.554	S	S	*	*	H	α-helix	trans	-93	-29.9	179.2	-160.8	174.8	-178.6	-176.6	0	113.5	E116 D117	E116-K119 PolarHBondContact O-N 2.98Å; D117-K119 VanDerWaalsContact C-N 3.3Å; D117-K119 PolarHBondContact O-N 3.25Å
120	N	39.1	Very low	50.8	Low	130 Å²	130	109.1 Å²	109.1	70%	0.695	58%	0.58	S	S	*	*	H	α-helix	trans	-93.2	-13.3	-174.5	-147	29.4	0	0	0	114.1	K122 S123	N120-K122 PolarHBondContact O-N 3.31Å; N120-S123 PolarHBondContact O-OG 3.11Å
121	S	39.4	Very low	49.6	Very low	82 Å²	82	108.6 Å²	108.6	57%	0.573	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	13.2	178.1	43.9	0	0	0	0	114.4	D117	D117-S121 PolarHBondContact O-OG 3.47Å
122	K	41.7	Very low	48.9	Very low	196 Å²	196	116.2 Å²	116.2	85%	0.852	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.9	25.2	-179.1	-153.8	162.8	-178.6	59.2	0	114.5	N120	N120-K122 PolarHBondContact O-N 3.31Å
123	S	39.6	Very low	48	Very low	71 Å²	71	119.9 Å²	119.9	50%	0.497	66%	0.657	S	S	.	*	S	Bend	trans	-130.8	-12.8	178	46.5	0	0	0	0	113.8	N120	N120-S123 PolarHBondContact O-OG 3.11Å
124	S	43.2	Very low	46.8	Very low	69 Å²	69	120.9 Å²	120.9	48%	0.483	67%	0.665	S	S	.	*	S	Bend	trans	-76.3	-27.7	-170.7	45.1	0	0	0	0	115.7	L126	S124-L126 PolarHBondContact O-N 3.47Å
125	D	43.6	Very low	45.7	Very low	134 Å²	134	124.5 Å²	124.5	72%	0.717	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	15.5	-154.4	-63.9	5.7	0	0	0	115
126	L	47.2	Very low	44.2	Very low	170 Å²	170	129.1 Å²	129.1	89%	0.89	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.8	8.4	-174.8	-71.8	177.7	0	0	0	116	S124	S124-L126 PolarHBondContact O-N 3.47Å
127	T	46	Very low	42.8	Very low	116 Å²	116	129.1 Å²	129.1	71%	0.712	74%	0.735	S	S	*	*	S	Bend	trans	-116.2	0.1	-174.6	92.1	0	0	0	0	115.5
128	S	46.1	Very low	41.9	Very low	108 Å²	108	131.6 Å²	131.6	76%	0.755	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-9.8	-167.5	37	0	0	0	0	115.8
129	D	45.3	Very low	41.1	Very low	162 Å²	162	129 Å²	129	87%	0.866	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	8.9	-167.8	-155.7	37.9	0	0	0	115.4
130	L	41.8	Very low	40.4	Very low	168 Å²	168	130.1 Å²	130.1	88%	0.88	76%	0.757	S	S	*	*	S	Bend	trans	-111	3.5	-178.7	-83.2	168.7	0	0	0	115.2
131	G	41.3	Very low	40.2	Very low	65 Å²	65	128.3 Å²	128.3	67%	0.67	76%	0.761	S	S	*	*	S	Bend	trans	-82.9	-21.8	-169.1	0	0	0	0	0	117.6
132	N	49	Very low	40.1	Very low	162 Å²	162	131.6 Å²	131.6	87%	0.866	78%	0.777	S	S	*	*	S	Bend	trans	-106.1	12.8	-152	-83.2	12.9	0	0	0	117.6
133	V	43.9	Very low	39.8	Very low	128 Å²	128	129.6 Å²	129.6	78%	0.776	78%	0.775	S	S	*	*	S	Bend	trans	-98	-22.6	-166.1	178	0	0	0	0	115.8
134	L	40.9	Very low	39.4	Very low	162 Å²	162	129.8 Å²	129.8	85%	0.848	79%	0.788	S	S	*	*			trans	-121.9	57.7	-163.3	-67.5	179.1	0	0	0	116.5
135	T	36.8	Very low	39.2	Very low	137 Å²	137	134.7 Å²	134.7	84%	0.84	80%	0.801	S	S	*	*			trans	-142.6	61.8	169.3	47.5	0	0	0	0	115.4
136	S	30.2	Very low	39	Very low	116 Å²	116	132.4 Å²	132.4	81%	0.811	80%	0.801	S	S	*	*			trans	-162.8	162.3	154.1	-151.7	0	0	0	0	116.7
137	S	32.6	Very low	38.4	Very low	103 Å²	103	131.3 Å²	131.3	72%	0.72	79%	0.791	S	S	*	*			trans	56.8	74.1	157.4	59.4	0	0	0	0	120.9
138	N	34.3	Very low	37.9	Very low	160 Å²	160	130.5 Å²	130.5	86%	0.856	79%	0.79	S	S	*	*				36.4	138.2	108.6	-162.5	20	0	0	0	122
139	A	32.5	Very low	37.6	Very low	82 Å²	82	130.6 Å²	130.6	68%	0.678	79%	0.791	S	S	*	*			trans	77.5	110.2	151	0	0	0	0	0	121.4
140	K	33.7	Very low	37.3	Very low	212 Å²	212	129.6 Å²	129.6	92%	0.922	79%	0.785	S	S	*	*				152	136.5	98	-167.8	170.1	-174.7	177.9	0	111.8
141	A	34.4	Very low	37.2	Very low	92 Å²	92	126.5 Å²	126.5	76%	0.76	78%	0.778	S	S	*	*			trans	-89.7	154.4	-178.7	0	0	0	0	0	113.8
142	V	39.2	Very low	36.9	Very low	151 Å²	151	127 Å²	127	92%	0.915	78%	0.783	S	S	*	*			trans	-151.3	156.5	146.5	115.8	0	0	0	0	111.3
143	N	33.8	Very low	36.4	Very low	154 Å²	154	124.1 Å²	124.1	82%	0.824	78%	0.781	S	S	*	*			trans	-85.4	152.8	-171.1	-172	14.7	0	0	0	112.7
144	G	32.5	Very low	36.3	Very low	74 Å²	74	127 Å²	127	76%	0.763	79%	0.787	S	S	*	*			trans	-168.5	123.7	174.9	0	0	0	0	0	112.5
145	K	38.3	Very low	36.1	Very low	173 Å²	173	124.9 Å²	124.9	75%	0.752	79%	0.785	S	S	*	*			trans	-125.9	123.4	-173.1	176.7	-162.4	170.4	-146.5	0	111.1	E147	K145-E147 WeakPolarHBondContact CE-OE1 3.45Å; K145-E147 IonicContact NZ-OE1 2.68Å; K145-E147 PolarHBondContact NZ-OE1 2.97Å
146	A	39.2	Very low	36.5	Very low	86 Å²	86	127.4 Å²	127.4	71%	0.711	79%	0.788	S	S	*	*			trans	-150.7	141.1	151.3	0	0	0	0	0	106.9
147	E	35.5	Very low	36.6	Very low	147 Å²	147	131.2 Å²	131.2	69%	0.687	79%	0.792	S	S	*	*				53.4	129	50.9	20.6	-159.1	137.3	0	0	113.2	K145	K145-E147 WeakPolarHBondContact CE-OE1 3.45Å; K145-E147 IonicContact NZ-OE1 2.68Å; K145-E147 PolarHBondContact NZ-OE1 2.97Å
148	S	35.1	Very low	36.6	Very low	99 Å²	99	135.1 Å²	135.1	69%	0.692	80%	0.8	S	S	*	*			cis	-161.9	174.1	4.4	59.7	0	0	0	0	112.3
149	S	38.6	Very low	36.5	Very low	110 Å²	110	136.2 Å²	136.2	77%	0.769	80%	0.8	S	S	*	*			trans	69.7	169.7	151	-63	0	0	0	0	118.9
150	D	39.4	Very low	36.4	Very low	140 Å²	140	136.6 Å²	136.6	75%	0.749	80%	0.803	S	S	*	*			cis	-173.7	165.2	-36.9	-171.1	13.8	0	0	0	107.4
151	S	39.8	Very low	36.1	Very low	104 Å²	104	135.7 Å²	135.7	73%	0.727	80%	0.802	S	S	*	*			trans	66.3	144.4	178.2	-52.9	0	0	0	0	116
152	G	34.9	Very low	36	Very low	76 Å²	76	140 Å²	140	78%	0.784	81%	0.806	S	S	*	*			cis	100.6	84.5	-3.6	0	0	0	0	0	114.1
153	A	39.2	Very low	35.5	Very low	100 Å²	100	140.9 Å²	140.9	83%	0.826	80%	0.8	S	S	*	*			trans	-163.1	116	160.6	0	0	0	0	0	110.2
154	E	42.6	Very low	35.4	Very low	189 Å²	189	139.5 Å²	139.5	88%	0.883	79%	0.792	S	S	*	*			trans	-81.4	149.8	157.2	56.7	-119.2	61.4	0	0	111
155	S	35.2	Very low	35.3	Very low	118 Å²	118	145.8 Å²	145.8	83%	0.825	80%	0.799	S	S	*	*			trans	-164.8	136.4	156.2	-146	0	0	0	0	110.9
156	E	45.8	Very low	34.9	Very low	190 Å²	190	141.2 Å²	141.2	89%	0.888	80%	0.8	S	S	*	*			trans	-104.4	138.9	172.4	-52	166.2	130.6	0	0	108.3
157	E	33.1	Very low	34.5	Very low	195 Å²	195	142 Å²	142	91%	0.911	81%	0.807	S	S	*	*			trans	-147	154.4	160.2	-71.2	-162.2	168.5	0	0	110.4
158	E	32.7	Very low	34.1	Very low	186 Å²	186	143 Å²	143	87%	0.869	81%	0.811	S	S	*	*			trans	-118.2	174.1	-171.2	-91	-157.3	124.6	0	0	114.1
159	E	30.3	Very low	33.8	Very low	183 Å²	183	145.5 Å²	145.5	86%	0.855	81%	0.812	S	S	*	*			trans	83.2	165.7	145	-102.1	-164.7	164.3	0	0	122.8
160	A	30.5	Very low	33.4	Very low	90 Å²	90	146 Å²	146	74%	0.744	82%	0.816	S	S	*	*			trans	59.9	121.6	-179.2	0	0	0	0	0	117.3
161	Q	28.6	Very low	32.9	Very low	192 Å²	192	142.4 Å²	142.4	90%	0.897	81%	0.812	S	S	*	*			cis	78.4	100.1	37.9	-63	-158.8	-41.3	0	0	117.2
162	E	32.4	Very low	32.4	Very low	184 Å²	184	142.4 Å²	142.4	86%	0.86	81%	0.812	S	S	*	*			trans	-140.1	129.1	135.2	-82.7	-166.4	143.6	0	0	105.7
163	E	29	Very low	32.2	Very low	169 Å²	169	145.3 Å²	145.3	79%	0.79	81%	0.81	S	S	*	*				67.9	143.7	70.7	-78.5	-115.2	141.6	0	0	115.2
164	L	31.2	Very low	31.9	Very low	125 Å²	125	145.6 Å²	145.6	65%	0.654	80%	0.797	S	S	*	*			cis	-165	130.7	-32.8	-170.4	133.9	0	0	0	109.4
165	K	31	Very low	31.7	Very low	206 Å²	206	144.6 Å²	144.6	90%	0.896	79%	0.79	S	S	*	*			trans	158.6	136.9	152.1	-92.3	156.8	-171.2	168.4	0	110.9
166	G	28.3	Very low	31.5	Very low	76 Å²	76	147.6 Å²	147.6	78%	0.784	79%	0.788	S	S	*	*			cis	145.7	97.3	-8.5	0	0	0	0	0	113.2
167	A	31.5	Very low	30.7	Very low	104 Å²	104	145.8 Å²	145.8	86%	0.86	78%	0.782	S	S	*	*			trans	-165	89.3	163.9	0	0	0	0	0	110.6
168	E	26.7	Very low	30.7	Very low	166 Å²	166	144.3 Å²	144.3	78%	0.776	78%	0.777	S	S	*	*			trans	-79.2	-177.8	160.9	-57.5	-177.4	70.7	0	0	109.3
169	Q	29.8	Very low	30.5	Very low	152 Å²	152	142 Å²	142	71%	0.71	78%	0.775	S	S	*	*			cis	-168	163.9	22	-152.3	158.6	58.2	0	0	112.9
170	S	29.4	Very low	30.6	Very low	121 Å²	121	141.8 Å²	141.8	85%	0.846	77%	0.771	S	S	*	*			trans	75.9	134.1	150.4	-152	0	0	0	0	119.4
171	G	28.8	Very low	30.6	Very low	65 Å²	65	142.6 Å²	142.6	67%	0.67	77%	0.772	S	S	*	*			cis	167.1	166.8	-7.5	0	0	0	0	0	114.1
172	S	29.3	Very low	30.7	Very low	104 Å²	104	138.4 Å²	138.4	73%	0.727	76%	0.759	S	S	*	*			trans	46.7	133.3	137.9	-166.8	0	0	0	0	120.7
173	D	31.8	Very low	30.7	Very low	137 Å²	137	137.7 Å²	137.7	73%	0.733	76%	0.761	S	S	*	*			cis	-168.6	176.9	-8.8	-105.6	-48.4	0	0	0	111
174	D	32	Very low	31.1	Very low	105 Å²	105	139 Å²	139	56%	0.561	77%	0.765	S	S	*	*			trans	79	107	143.6	-85.8	5.9	0	0	0	125.1
175	K	37.4	Very low	31	Very low	169 Å²	169	141.2 Å²	141.2	74%	0.735	78%	0.777	S	S	*	*				61.8	123.5	119.8	-59.9	172.4	-177.5	106.5	0	120.8
176	K	31.1	Very low	31.1	Very low	181 Å²	181	138.6 Å²	138.6	79%	0.787	77%	0.772	S	S	*	*				132.3	129.2	108.4	-148.5	178	-169.5	-176	0	118.6
177	M	29.3	Very low	30.9	Very low	152 Å²	152	143.5 Å²	143.5	75%	0.749	78%	0.775	S	S	*	*			trans	66.7	116.1	149.3	-89.1	-163.9	-51.8	0	0	124.3
178	M	33.3	Very low	30.9	Very low	164 Å²	164	145.3 Å²	145.3	81%	0.808	77%	0.768	S	S	*	*				62.5	100.7	103.8	-163.1	84.2	132.7	0	0	122
179	T	29.6	Very low	31.1	Very low	136 Å²	136	143.5 Å²	143.5	83%	0.834	76%	0.763	S	S	*	*			trans	-151.8	156.7	140.6	54.1	0	0	0	0	107.4
180	K	30.9	Very low	31.1	Very low	179 Å²	179	143.1 Å²	143.1	78%	0.778	77%	0.77	S	S	*	*			cis	75.6	101.8	-9.7	-157	176.1	-176.6	178.1	0	121.9
181	S	31.3	Very low	31.1	Very low	107 Å²	107	143.5 Å²	143.5	75%	0.748	77%	0.767	S	S	*	*			trans	-141.3	144.4	141.9	44.6	0	0	0	0	106.5
182	T	31	Very low	31.1	Very low	104 Å²	104	148.2 Å²	148.2	64%	0.638	78%	0.777	S	S	*	*			cis	95.2	78.8	21.9	70.3	0	0	0	0	115.8
183	D	32	Very low	31	Very low	169 Å²	169	146.6 Å²	146.6	90%	0.904	78%	0.778	S	S	*	*			trans	-68.6	165.1	157.4	-68.8	-58.6	0	0	0	112.3
184	K	36.7	Very low	30.6	Very low	198 Å²	198	150.7 Å²	150.7	86%	0.861	78%	0.784	S	S	*	*			trans	-116.7	123.4	-170	-62.2	172.6	-175.1	170.4	0	111.3
185	N	30.4	Very low	30.5	Very low	171 Å²	171	153.8 Å²	153.8	91%	0.914	79%	0.793	S	S	*	*			trans	-67.4	150.5	160.5	-74.4	-38.4	0	0	0	110.1
186	L	31.6	Very low	30	Very low	150 Å²	150	151.1 Å²	151.1	79%	0.785	79%	0.786	S	S	*	*			trans	-136	107	174	-145.8	161.1	0	0	0	108.9	I188	L186-I188 HydrophobicContact CD2-CD1 3.88Å; L186-I188 HydrophobicContact CD2-CG1 3.75Å
187	E	25.9	Very low	29.9	Very low	180 Å²	180	146.2 Å²	146.2	84%	0.841	78%	0.775	S	S	*	*			trans	-102.5	130.2	-177.3	-179.2	-176.9	171.2	0	0	109.2
188	I	31.6	Very low	29.7	Very low	141 Å²	141	148.6 Å²	148.6	72%	0.723	78%	0.781	S	S	*	*			trans	-127.3	87.3	176.9	-56.2	-176.1	0	0	0	110.1	L186	L186-I188 HydrophobicContact CD2-CD1 3.88Å; L186-I188 HydrophobicContact CD2-CG1 3.75Å
189	I	29.8	Very low	29.6	Very low	129 Å²	129	145.2 Å²	145.2	66%	0.662	78%	0.78	S	S	*	*			trans	33.8	111.7	130.9	-55.5	173.9	0	0	0	116.3	T191	I189-T191 HydrophobicContact CG2-CG2 4.01Å
190	V	30	Very low	29.7	Very low	144 Å²	144	148 Å²	148	87%	0.873	78%	0.783	S	S	*	*			trans	-74	128.9	159.1	175.7	0	0	0	0	109.9
191	T	29.2	Very low	29.6	Very low	128 Å²	128	146.6 Å²	146.6	79%	0.785	78%	0.784	S	S	*	*			trans	-127	143.9	161.5	45	0	0	0	0	110.6	I189	I189-T191 HydrophobicContact CG2-CG2 4.01Å
192	N	28.3	Very low	29.7	Very low	164 Å²	164	147.2 Å²	147.2	88%	0.877	79%	0.789	S	S	*	*			trans	-110.1	135.1	179.5	-166.9	4.4	0	0	0	108.7
193	G	27.5	Very low	29.5	Very low	71 Å²	71	149.3 Å²	149.3	73%	0.732	80%	0.796	S	S	*	*			trans	-148.7	148.2	-170.1	0	0	0	0	0	111.9
194	Y	24.3	Very low	29.7	Very low	223 Å²	223	149.3 Å²	149.3	88%	0.875	79%	0.794	S	S	*	*			trans	-126	163.1	-160.9	-153.6	-115.8	0	0	0	111.3
195	K	30.4	Very low	29.3	Very low	169 Å²	169	147.5 Å²	147.5	74%	0.735	79%	0.788	S	S	*	*			trans	71.6	151.3	173.3	-85.7	-168.4	170.2	-115.9	0	117.6
196	D	25.5	Very low	29.2	Very low	113 Å²	113	144.5 Å²	144.5	60%	0.604	78%	0.777	S	S	*	*			cis	-158.5	173.9	-14.8	-140.9	-27.9	0	0	0	110.4
197	S	28.9	Very low	28.9	Very low	78 Å²	78	143.4 Å²	143.4	55%	0.545	77%	0.772	S	S	.	*			trans	52.8	103.2	153.5	-53.7	0	0	0	0	120.1
198	F	26.1	Very low	29.1	Very low	202 Å²	202	139.6 Å²	139.6	89%	0.886	77%	0.765	S	S	*	*				176.3	118.7	90.4	-97.5	-70.2	0	0	0	111
199	A	30.1	Very low	28.9	Very low	93 Å²	93	137.6 Å²	137.6	77%	0.769	76%	0.763	S	S	*	*			trans	-99.9	163	162.8	0	0	0	0	0	109.5
200	Q	33	Very low	28.7	Very low	195 Å²	195	142.6 Å²	142.6	91%	0.911	77%	0.774	S	S	*	*			trans	-131.3	126.3	171.7	-150.5	173.2	14.2	0	0	108.8
201	D	28.2	Very low	28.6	Very low	149 Å²	149	141.4 Å²	141.4	80%	0.797	77%	0.772	S	S	*	*			trans	-76.2	152.6	-170.9	-56.9	-58	0	0	0	113.6
202	S	32.9	Very low	28.5	Very low	121 Å²	121	139.2 Å²	139.2	85%	0.846	77%	0.767	S	S	*	*			trans	-161.8	80.3	136.3	60.4	0	0	0	0	111.4
203	D	27.9	Very low	28.5	Very low	148 Å²	148	143.3 Å²	143.3	79%	0.791	77%	0.77	S	S	*	*			trans	-75.6	138.2	166.1	-87.7	-39.3	0	0	0	111.4
204	I	34.3	Very low	28.4	Very low	169 Å²	169	150 Å²	150	87%	0.867	77%	0.773	S	S	*	*			trans	-136.6	116	155.2	-68.8	-171.6	0	0	0	109.6
205	H	28.3	Very low	28.6	Very low	159 Å²	159	142.5 Å²	142.5	74%	0.736	75%	0.753	S	S	*	*			trans	-57	163.6	165.5	-76	-107.8	0	0	0	111.8
206	T	29.3	Very low	28.5	Very low	109 Å²	109	142.2 Å²	142.2	67%	0.669	75%	0.754	S	S	*	*			cis	-161.7	-178.2	12.3	2.1	0	0	0	0	106.6
207	D	26.3	Very low	28.7	Very low	127 Å²	127	142.5 Å²	142.5	68%	0.679	76%	0.756	S	S	*	*			cis	-158.4	173.2	14	-138	-53.5	0	0	0	112.3
208	S	28.9	Very low	28.5	Very low	100 Å²	100	146.5 Å²	146.5	70%	0.699	76%	0.764	S	S	*	*			trans	16.1	145.2	144.6	-69	0	0	0	0	122.5
209	S	26.8	Very low	28.6	Very low	99 Å²	99	145.7 Å²	145.7	69%	0.692	76%	0.76	S	S	*	*			cis	-175.4	150.1	-3.1	54.5	0	0	0	0	115
210	R	27.3	Very low	29.4	Very low	234 Å²	234	145.8 Å²	145.8	88%	0.883	75%	0.753	S	S	*	*			trans	56.5	134.2	141.4	-82.3	-179.7	158.4	173.6	-5.6	123.7
211	S	26.2	Very low	29	Very low	119 Å²	119	141.9 Å²	141.9	83%	0.832	74%	0.742	S	S	*	*			trans	75.2	159.7	145.1	71.9	0	0	0	0	119.6
212	A	27.9	Very low	29	Very low	82 Å²	82	140.3 Å²	140.3	68%	0.678	73%	0.733	S	S	*	*			cis	164.1	145.6	-46	0	0	0	0	0	109.5
213	R	27.3	Very low	28.8	Very low	249 Å²	249	143.5 Å²	143.5	94%	0.94	74%	0.735	S	S	*	*			trans	73.6	161.8	-178.8	-51.9	175.4	-177.9	-125	-0.8	114.8
214	R	26.3	Very low	28.7	Very low	212 Å²	212	141.5 Å²	141.5	80%	0.8	73%	0.733	S	S	*	*			cis	-176.1	146.2	-35.7	-173	-168.2	-171.9	-103.4	12	107.8
215	S	29.5	Very low	28.4	Very low	65 Å²	65	137.9 Å²	137.9	46%	0.455	72%	0.723	S	S	.	*			trans	71	133.8	160.8	-76.8	0	0	0	0	119.4
216	E	28.5	Very low	28.4	Very low	163 Å²	163	138.6 Å²	138.6	76%	0.762	73%	0.726	S	S	*	*				31	138.1	129.1	-58.6	138.1	119.7	0	0	118.9
217	D	27.6	Very low	28.4	Very low	119 Å²	119	141.4 Å²	141.4	64%	0.636	73%	0.732	S	S	*	*				-170.9	170.5	52.4	-150.7	0	0	0	0	116.1
218	K	26.6	Very low	28.3	Very low	163 Å²	163	141.4 Å²	141.4	71%	0.709	74%	0.737	S	S	*	*			trans	15.8	132.3	160.8	-70.8	155	-166.5	78.3	0	124.9
219	K	26.9	Very low	28.2	Very low	185 Å²	185	139.1 Å²	139.1	80%	0.804	73%	0.728	S	S	*	*				12.1	164.5	124.2	-112.5	-157.4	148.5	-165.5	0	120.7
220	P	46.3	Very low	28.4	Very low	95 Å²	95	142.2 Å²	142.2	62%	0.617	74%	0.737	S	S	*	*			cis	-146.7	-165.7	10.9	39.8	-15.8	0	0	0	119
221	T	25.8	Very low	28.4	Very low	112 Å²	112	137.4 Å²	137.4	69%	0.687	73%	0.734	S	S	*	*			trans	93.1	137.4	143.9	-69.5	0	0	0	0	120.4
222	D	27.9	Very low	28.4	Very low	116 Å²	116	138.9 Å²	138.9	62%	0.62	74%	0.738	S	S	*	*			cis	-167.3	152	-28.7	-93.3	-45.7	0	0	0	111.6
223	Q	28.6	Very low	28.2	Very low	188 Å²	188	141.7 Å²	141.7	88%	0.879	74%	0.74	S	S	*	*			trans	163	123.4	144.9	-92.2	160	94.2	0	0	109.3
224	S	26.2	Very low	28.2	Very low	106 Å²	106	135.1 Å²	135.1	74%	0.741	73%	0.731	S	S	*	*				93.7	128.2	54.1	-176.2	0	0	0	0	111.6
225	S	28.4	Very low	28.2	Very low	94 Å²	94	131.4 Å²	131.4	66%	0.657	73%	0.732	S	S	*	*			cis	-167.6	179.4	-2.6	-90.1	0	0	0	0	112
226	Q	27.6	Very low	28.2	Very low	174 Å²	174	136.1 Å²	136.1	81%	0.813	75%	0.747	S	S	*	*			trans	82.9	139.7	169.1	-53.4	171.6	97.1	0	0	115.2
227	Q	29.2	Very low	28.2	Very low	168 Å²	168	137.3 Å²	137.3	79%	0.785	75%	0.752	S	S	*	*			cis	-169.7	160.1	-8	-117	-177.3	-33.1	0	0	107.4
228	T	23.9	Very low	28.1	Very low	127 Å²	127	138 Å²	138	78%	0.779	76%	0.756	S	S	*	*			cis	-114.2	-154.1	-10.6	52.7	0	0	0	0	108.8
229	G	27.7	Very low	28.3	Very low	51 Å²	51	136.1 Å²	136.1	53%	0.526	76%	0.758	S	S	.	*			cis	108.7	123	2.9	0	0	0	0	0	112.4
230	N	30.5	Very low	28.3	Very low	164 Å²	164	133.9 Å²	133.9	88%	0.877	76%	0.755	S	S	*	*			cis	-146.7	163.5	9.7	-68.5	-24.3	0	0	0	112.8
231	T	27.8	Very low	27.6	Very low	134 Å²	134	137.7 Å²	137.7	82%	0.822	77%	0.765	S	S	*	*			trans	-139.8	145.4	173.8	-53.5	0	0	0	0	111.6
232	V	26.2	Very low	28.1	Very low	149 Å²	149	139.2 Å²	139.2	90%	0.903	77%	0.769	S	S	*	*			trans	-138.8	152.8	167.8	179.6	0	0	0	0	109.3
233	L	23.6	Very low	29.4	Very low	141 Å²	141	139.1 Å²	139.1	74%	0.738	77%	0.774	S	S	*	*			trans	-152.2	141.9	-156.9	177.2	136.2	0	0	0	114.4
234	C	27.5	Very low	29.5	Very low	111 Å²	111	133.8 Å²	133.8	75%	0.75	77%	0.77	S	S	*	*			trans	65.3	156.4	172.8	-67.8	0	0	0	0	116.8
235	V	26.1	Very low	30.1	Very low	135 Å²	135	137.9 Å²	137.9	82%	0.818	78%	0.777	S	S	*	*			cis	-151.4	166.8	48.8	161.5	0	0	0	0	113.3
236	H	28.3	Very low	30.4	Very low	164 Å²	164	141.2 Å²	141.2	76%	0.759	79%	0.788	S	S	*	*			trans	-49	156.6	179.5	-66.9	-104.8	0	0	0	119.4
237	Q	28.8	Very low	30.6	Very low	188 Å²	188	136.5 Å²	136.5	88%	0.879	78%	0.779	S	S	*	*				-154.4	160.4	127.5	-135.2	148.9	99.2	0	0	112.5
238	D	26.6	Very low	31.1	Very low	133 Å²	133	134.7 Å²	134.7	71%	0.711	78%	0.784	S	S	*	*			trans	-95.2	170.3	-168.4	-45.4	-95.7	0	0	0	114.5
239	T	30	Very low	31.5	Very low	124 Å²	124	131.3 Å²	131.3	76%	0.761	78%	0.775	S	S	*	*				155.1	111.8	126.1	-64.2	0	0	0	0	114.6
240	N	28.4	Very low	31.9	Very low	138 Å²	138	135 Å²	135	74%	0.738	79%	0.788	S	S	*	*			trans	56.6	164.5	145.5	-64.4	6	0	0	0	125.5
241	E	30	Very low	32.7	Very low	175 Å²	175	135.2 Å²	135.2	82%	0.818	78%	0.783	S	S	*	*			trans	83.4	126.7	163.1	-46.1	-61.7	96.2	0	0	120.1
242	D	38	Very low	33.3	Very low	143 Å²	143	137.1 Å²	137.1	77%	0.765	78%	0.782	S	S	*	*			trans	-129.1	157.8	167.8	172.9	70.9	0	0	0	104.7
243	P	54.2	Low	33.8	Very low	114 Å²	114	138.1 Å²	138.1	74%	0.74	78%	0.781	S	S	*	*			cis	-125.4	-179	7.9	20.1	5.5	0	0	0	114.7
244	G	31	Very low	34.2	Very low	77 Å²	77	137.9 Å²	137.9	79%	0.794	79%	0.786	S	S	*	*			trans	-167.6	134	168.6	0	0	0	0	0	113.7
245	E	38.6	Very low	35	Very low	191 Å²	191	138.2 Å²	138.2	89%	0.893	79%	0.789	S	S	*	*			trans	-88.4	159.7	-170.1	-60.3	172.1	132.9	0	0	114.3
246	D	33.7	Very low	36.2	Very low	165 Å²	165	139.1 Å²	139.1	88%	0.882	79%	0.79	S	S	*	*			trans	86.6	152.5	141.3	-116.3	-11.6	0	0	0	125
247	A	32.9	Very low	37.4	Very low	74 Å²	74	136 Å²	136	61%	0.612	79%	0.786	S	S	*	*			trans	64.5	88.6	150.6	0	0	0	0	0	123.8
248	S	39.3	Very low	38.4	Very low	130 Å²	130	132.3 Å²	132.3	91%	0.909	77%	0.773	S	S	*	*				72.1	167	125	79.6	0	0	0	0	121.9
249	G	32.8	Very low	39.3	Very low	57 Å²	57	131.1 Å²	131.1	59%	0.588	78%	0.775	S	S	*	*			trans	116.2	32.2	150.5	0	0	0	0	0	120.9	H251	G249-H251 PolarHBondContact O-N 2.85Å
250	V	35.2	Very low	40.3	Very low	129 Å²	129	131.8 Å²	131.8	78%	0.782	77%	0.769	S	S	*	*			trans	-85.6	101.2	170.9	-176.6	0	0	0	0	111.3
251	H	47.5	Very low	41.6	Very low	168 Å²	168	131.6 Å²	131.6	78%	0.778	77%	0.773	S	S	*	*			trans	-79.6	123.6	169.3	-64.9	-103.9	0	0	0	110.7	G249	G249-H251 PolarHBondContact O-N 2.85Å
252	H	40.5	Very low	42.4	Very low	173 Å²	173	133.5 Å²	133.5	80%	0.801	77%	0.774	S	S	*	*			trans	-125.8	120.2	159.5	-80.9	-61.2	0	0	0	110.3
253	L	36.1	Very low	42.9	Very low	170 Å²	170	131.7 Å²	131.7	89%	0.89	77%	0.772	S	S	*	*			trans	-73	136.2	-179.1	-63.4	164.1	0	0	0	109.9	S255	L253-S255 PolarHBondContact O-N 3.16Å
254	T	32.7	Very low	42.3	Very low	137 Å²	137	133.8 Å²	133.8	84%	0.84	78%	0.776	S	S	*	*			trans	-70.3	114	167.7	45.1	0	0	0	0	109.3	D256	T254-D256 VanDerWaalsContact C-N 3.3Å; T254-D256 PolarHBondContact O-N 3.36Å
255	S	43.8	Very low	42.9	Very low	117 Å²	117	134.4 Å²	134.4	82%	0.818	77%	0.768	S	S	*	*			trans	-74.7	84	172.5	-176.7	0	0	0	0	109.9	L253 S257	L253-S255 PolarHBondContact O-N 3.16Å; S255-S257 PolarHBondContact O-N 3.29Å
256	D	51.4	Low	43.2	Very low	154 Å²	154	129.8 Å²	129.8	82%	0.824	75%	0.748	S	S	*	*			trans	-66.2	121.3	165	-174.8	6.8	0	0	0	109.4	T254	T254-D256 VanDerWaalsContact C-N 3.3Å; T254-D256 PolarHBondContact O-N 3.36Å
257	S	54.1	Low	43.9	Very low	98 Å²	98	128.8 Å²	128.8	69%	0.685	74%	0.738	S	S	*	*			trans	-166.2	112.2	173.7	-171.2	0	0	0	0	112.1	S255	S255-S257 PolarHBondContact O-N 3.29Å
258	D	49.7	Very low	44.5	Very low	112 Å²	112	130.4 Å²	130.4	60%	0.599	73%	0.733	S	S	*	*			trans	64.7	99.9	154.4	-159.3	-13.3	0	0	0	118.1	E260	D258-E260 PolarHBondContact OD1-N 2.84Å
259	S	45.6	Very low	44.6	Very low	108 Å²	108	126.6 Å²	126.6	76%	0.755	70%	0.7	S	S	*	*			trans	-142.2	43.4	147.2	52.1	0	0	0	0	111.5	V261	S259-V261 PolarHBondContact O-N 2.79Å; S259-V261 VanDerWaalsContact O-N 3.11Å
260	E	50.7	Low	45.2	Very low	138 Å²	138	126.3 Å²	126.3	65%	0.645	70%	0.697	S	S	*	*			trans	-64.8	-19	-170.3	-47.9	-52.3	125.4	0	0	114.3	D258 Y262 C263	D258-E260 PolarHBondContact OD1-N 2.84Å; E260-Y262 PolarHBondContact O-N 2.89Å; E260-C263 PolarHBondContact O-N 2.92Å
261	V	55.4	Low	45.4	Very low	134 Å²	134	126.6 Å²	126.6	81%	0.812	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	17	-162.5	-83.6	0	0	0	0	117	S259	S259-V261 PolarHBondContact O-N 2.79Å; S259-V261 VanDerWaalsContact O-N 3.11Å
262	Y	48	Very low	44.9	Very low	214 Å²	214	125.4 Å²	125.4	84%	0.839	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.3	24.8	173.6	-148.2	-102.4	0	0	0	116.3	E260	E260-Y262 PolarHBondContact O-N 2.89Å
263	C	47.6	Very low	44.9	Very low	106 Å²	106	123 Å²	123	72%	0.716	67%	0.674	S	S	*	*	S	Bend	trans	-100.6	-30.4	170.3	-69.9	0	0	0	0	113.7	E260 S265 M266	E260-C263 PolarHBondContact O-N 2.92Å; C263-S265 PolarHBondContact O-N 3.31Å; C263-M266 PolarHBondContact O-N 3.21Å
264	D	41.3	Very low	45.1	Very low	157 Å²	157	123.7 Å²	123.7	84%	0.84	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	18.9	-166.8	-153.6	37.2	0	0	0	115.6
265	S	44.5	Very low	45	Very low	90 Å²	90	127.7 Å²	127.7	63%	0.629	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.3	4.6	-179.9	-63.6	0	0	0	0	114	C263	C263-S265 PolarHBondContact O-N 3.31Å
266	M	44.1	Very low	44.8	Very low	94 Å²	94	130.8 Å²	130.8	46%	0.463	67%	0.673	S	S	.	*	S	Bend	trans	-92.8	-9	174	-69.1	-150.8	66.8	0	0	114.2	N32 C263 Q268 F269	N32-M266 HydrophobicContact CB-CE 4.49Å; N32-M266 WeakPolarHBondContact ND2-CE 3.48Å; N32-M266 WeakPolarHBondContact OD1-CE 3.43Å; C263-M266 PolarHBondContact O-N 3.21Å; M266-Q268 PolarHBondContact O-N 3.34Å; M266-F269 HydrophobicContact CE-CE2 4.14Å; M266-F269 WeakPolarHBondContact O-CD2 3.35Å
267	E	48.6	Very low	44	Very low	144 Å²	144	127.4 Å²	127.4	67%	0.673	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-68	-15.8	-177	-152.1	62.5	-158.2	0	0	114.1	F269	E267-F269 VanDerWaalsContact C-N 3.28Å; E267-F269 PolarHBondContact O-N 3.38Å
268	Q	46.2	Very low	42.8	Very low	108 Å²	108	126.5 Å²	126.5	51%	0.505	68%	0.681	S	S	.	*	G	3₁₀ helix	trans	-78.7	3.9	-168.8	-163.8	167.2	-10.9	0	0	115.1	I61 M266 G270 E272	I61-Q268 HydrophobicContact CD1-CB 4.12Å; M266-Q268 PolarHBondContact O-N 3.34Å; Q268-G270 PolarHBondContact O-N 3.47Å; Q268-E272 PolarHBondContact NE2-OE1 3.46Å
269	F	40.5	Very low	41.8	Very low	51 Å²	51	128.9 Å²	128.9	22%	0.224	69%	0.694	C	S	.	*	G	3₁₀ helix	trans	-66.6	-17.3	179.7	-86.8	-95.8	0	0	0	114.7	L36 I61 K65 M266 E267	L36-F269 HydrophobicContact CD2-CE1 4Å; I61-F269 HydrophobicContact CB-CE2 4.28Å; I61-F269 HydrophobicContact CB-CZ 4.18Å; I61-F269 HydrophobicContact CD1-CD2 4.34Å; I61-F269 HydrophobicContact CD1-CE2 4.09Å; I61-F269 HydrophobicContact CG1-CD2 4.43Å; I61-F269 HydrophobicContact CG1-CE2 3.75Å; I61-F269 HydrophobicContact CG1-CZ 4.08Å; I61-F269 HydrophobicContact CG2-CD1 4.1Å; I61-F269 HydrophobicContact CG2-CD2 4.12Å; I61-F269 HydrophobicContact CG2-CE1 3.85Å; I61-F269 HydrophobicContact CG2-CE2 3.87Å; I61-F269 HydrophobicContact CG2-CG 4.24Å; I61-F269 HydrophobicContact CG2-CZ 3.73Å; K65-F269 HydrophobicContact CD-CD1 4.04Å; K65-F269 HydrophobicContact CD-CE1 4.07Å; K65-F269 HydrophobicContact CG-CD1 4.19Å; K65-F269 HydrophobicContact CG-CE1 3.82Å; M266-F269 HydrophobicContact CE-CE2 4.14Å; M266-F269 WeakPolarHBondContact O-CD2 3.35Å; E267-F269 VanDerWaalsContact C-N 3.28Å; E267-F269 PolarHBondContact O-N 3.38Å
270	G	45.3	Very low	41.3	Very low	50 Å²	50	129.9 Å²	129.9	52%	0.515	70%	0.698	S	S	.	*	G	3₁₀ helix	trans	-106.8	7.6	-166.6	0	0	0	0	0	118.9	Q268	Q268-G270 PolarHBondContact O-N 3.47Å
271	Q	40.6	Very low	40.4	Very low	136 Å²	136	127.3 Å²	127.3	64%	0.636	70%	0.7	S	S	*	*	S	Bend	trans	-122.9	-23.1	-167.7	-58.5	-167.6	25.1	0	0	117.1	E273	Q271-E273 PolarHBondContact O-N 2.79Å
272	E	37.2	Very low	39.5	Very low	142 Å²	142	130.3 Å²	130.3	66%	0.664	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	11.8	-161.2	-61.4	-163.1	167.5	0	0	117.9	Q268	Q268-E272 PolarHBondContact NE2-OE1 3.46Å
273	E	40.1	Very low	38.4	Very low	124 Å²	124	128.2 Å²	128.2	58%	0.579	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	9	168.8	-65.7	-164.4	135.8	0	0	113.6	K43 Q271	K43-E273 IonicContact NZ-OE1 2.67Å; K43-E273 PolarHBondContact NZ-OE1 3.29Å; K43-E273 IonicContact NZ-OE2 3.93Å; K43-E273 PolarHBondContact NZ-OE2 3.17Å; Q271-E273 PolarHBondContact O-N 2.79Å
274	Y	39.8	Very low	37.6	Very low	183 Å²	183	129.8 Å²	129.8	72%	0.718	70%	0.703	S	S	*	*	S	Bend	trans	-93.4	-3.3	-172	-106.4	-85	0	0	0	116.9
275	Y	31.2	Very low	37	Very low	222 Å²	222	131.8 Å²	131.8	87%	0.871	71%	0.708	S	S	*	*	S	Bend	trans	-136.9	56.6	-173.5	-75.5	-76.2	0	0	0	114.7
276	L	38.3	Very low	36.2	Very low	181 Å²	181	130.8 Å²	130.8	95%	0.948	71%	0.712	S	S	*	*	S	Bend	trans	-148	46.9	168.2	-112.3	175.5	0	0	0	113.6
277	G	34.7	Very low	35.5	Very low	84 Å²	84	132.4 Å²	132.4	87%	0.866	73%	0.732	S	S	*	*			trans	-166.3	74.1	-179.5	0	0	0	0	0	115.1
278	G	28.7	Very low	34.4	Very low	78 Å²	78	129 Å²	129	80%	0.804	74%	0.735	S	S	*	*			trans	180	122.1	171.8	0	0	0	0	0	113.2
279	D	29	Very low	33.4	Very low	163 Å²	163	134 Å²	134	87%	0.872	76%	0.755	S	S	*	*			trans	-76.9	143	171.6	-95.2	-54.2	0	0	0	111.1	A281	D279-A281 PolarHBondContact O-N 3.39Å
280	P	34.8	Very low	32.7	Very low	128 Å²	128	137.7 Å²	137.7	83%	0.831	79%	0.786	S	S	*	*			trans	-86.2	97.5	-171.7	33.1	-34.8	0	0	0	113
281	A	31.8	Very low	31.9	Very low	84 Å²	84	143.7 Å²	143.7	69%	0.694	80%	0.801	S	S	*	*			trans	-147.9	128.7	166.5	0	0	0	0	0	113.5	D279	D279-A281 PolarHBondContact O-N 3.39Å
282	Q	37	Very low	31.3	Very low	198 Å²	198	145 Å²	145	93%	0.925	81%	0.812	S	S	*	*			trans	71.6	95	163.4	-54	178.6	39.1	0	0	118
283	H	24.6	Very low	30.9	Very low	170 Å²	170	142.3 Å²	142.3	79%	0.787	81%	0.814	S	S	*	*			trans	-134	108.9	146.7	-172.8	-80.1	0	0	0	106.8
284	L	32.2	Very low	30.4	Very low	139 Å²	139	144.8 Å²	144.8	73%	0.728	83%	0.826	S	S	*	*				82.8	105.6	74.5	-142.2	99.7	0	0	0	113.6
285	E	27.9	Very low	29.8	Very low	199 Å²	199	143.3 Å²	143.3	93%	0.93	83%	0.83	S	S	*	*			trans	-131.3	145.3	146.4	-71.3	-170	156	0	0	106
286	G	27.3	Very low	29.6	Very low	69 Å²	69	138 Å²	138	71%	0.711	83%	0.825	S	S	*	*			cis	-169.6	174	-3	0	0	0	0	0	112.2
287	S	29.2	Very low	30	Very low	128 Å²	128	135.1 Å²	135.1	90%	0.895	82%	0.817	S	S	*	*			trans	-36.7	136.3	178.3	-176.3	0	0	0	0	116.5
288	G	26.1	Very low	29.7	Very low	71 Å²	71	134.7 Å²	134.7	73%	0.732	81%	0.813	S	S	*	*			trans	-163.1	127.9	167.3	0	0	0	0	0	112.4
289	F	24.6	Very low	29.7	Very low	213 Å²	213	139 Å²	139	93%	0.934	82%	0.817	S	S	*	*			trans	-68.5	159.3	170.8	-96.7	-120.4	0	0	0	111.2
290	C	25.7	Very low	29.7	Very low	129 Å²	129	133.8 Å²	133.8	87%	0.872	80%	0.803	S	S	*	*			trans	-126.8	114.6	174.9	-171.2	0	0	0	0	109.9
291	E	29.2	Very low	29.4	Very low	177 Å²	177	132.9 Å²	132.9	83%	0.827	80%	0.799	S	S	*	*			trans	-149.3	118.6	169.8	-159.1	167	-148.3	0	0	110
292	D	26.8	Very low	29.3	Very low	162 Å²	162	136.4 Å²	136.4	87%	0.866	81%	0.805	S	S	*	*			trans	58.9	163.3	162.1	-87.8	-22.7	0	0	0	124
293	A	30.7	Very low	29	Very low	86 Å²	86	130.3 Å²	130.3	71%	0.711	80%	0.795	S	S	*	*			trans	77.8	94.4	164.4	0	0	0	0	0	120.8
294	Q	28.4	Very low	29.3	Very low	176 Å²	176	131.4 Å²	131.4	82%	0.822	80%	0.798	S	S	*	*				72.1	122.5	127.5	-75.7	-166.5	-23	0	0	123.4
295	L	27	Very low	29.1	Very low	153 Å²	153	132.1 Å²	132.1	80%	0.801	80%	0.799	S	S	*	*			trans	79.1	129.7	133.3	-62.9	169.6	0	0	0	121.2
296	S	27.2	Very low	29.2	Very low	111 Å²	111	130.3 Å²	130.3	78%	0.776	79%	0.791	S	S	*	*			trans	-89.5	-176.8	164.8	-138.3	0	0	0	0	109.9
297	P	47.3	Very low	29.1	Very low	119 Å²	119	134.5 Å²	134.5	77%	0.773	79%	0.794	S	S	*	*			cis	-141.1	177.5	-0.1	41.5	-23.1	0	0	0	117.2
298	G	27.3	Very low	29	Very low	76 Å²	76	139.3 Å²	139.3	78%	0.784	79%	0.792	S	S	*	*			trans	94.3	172.3	153.8	0	0	0	0	0	116.8
299	N	29.8	Very low	29.2	Very low	167 Å²	167	140.2 Å²	140.2	89%	0.893	79%	0.793	S	S	*	*			cis	-164.7	155.3	-10.7	-177.7	23.7	0	0	0	109.3
300	G	27.9	Very low	29.7	Very low	55 Å²	55	136.4 Å²	136.4	57%	0.567	79%	0.787	S	S	*	*			trans	63	109.4	162.8	0	0	0	0	0	117.8
301	S	29.9	Very low	30.1	Very low	108 Å²	108	139.3 Å²	139.3	76%	0.755	79%	0.785	S	S	*	*			cis	87.7	130.1	50	84.7	0	0	0	0	116.6
302	I	30	Very low	30.3	Very low	159 Å²	159	134.4 Å²	134.4	82%	0.815	78%	0.781	S	S	*	*			trans	75.8	120.3	151.9	-62.9	161.3	0	0	0	120.2
303	G	30.6	Very low	31	Very low	70 Å²	70	134.7 Å²	134.7	72%	0.722	78%	0.775	S	S	*	*			trans	174.7	81.2	160.2	0	0	0	0	0	111
304	K	30.1	Very low	31	Very low	192 Å²	192	134.4 Å²	134.4	84%	0.835	78%	0.78	S	S	*	*				67.7	154.3	83.7	-90.3	-169.8	174.8	179.4	0	116.1
305	M	29	Very low	31.1	Very low	155 Å²	155	132.2 Å²	132.2	76%	0.764	77%	0.77	S	S	*	*			trans	71.6	117.1	-176.1	-97.2	37.9	178.4	0	0	114.6
306	Q	28.8	Very low	31.5	Very low	160 Å²	160	131.8 Å²	131.8	75%	0.748	77%	0.773	S	S	*	*				74.8	138.8	61	-79	-163.3	12.7	0	0	113.8
307	M	25.6	Very low	32.7	Very low	158 Å²	158	133.7 Å²	133.7	78%	0.778	77%	0.768	S	S	*	*			cis	-167.4	167.1	-6.4	-177.4	173.9	-174.9	0	0	110.5
308	R	26.3	Very low	32.4	Very low	228 Å²	228	136.9 Å²	136.9	86%	0.86	77%	0.772	S	S	*	*			trans	104.4	140.1	144.1	-146.9	172.3	-154.9	-104.7	2.9	116.6
309	A	32.1	Very low	32.8	Very low	90 Å²	90	136.8 Å²	136.8	74%	0.744	77%	0.771	S	S	*	*			trans	-143.3	158.1	-173.6	0	0	0	0	0	112.3
310	V	33.7	Very low	33	Very low	134 Å²	134	132.5 Å²	132.5	81%	0.812	77%	0.766	S	S	*	*			trans	-147.2	123.5	163.4	-179.6	0	0	0	0	104.8
311	K	34.1	Very low	33.5	Very low	190 Å²	190	138.6 Å²	138.6	83%	0.826	78%	0.78	S	S	*	*			cis	93.3	107.3	20.1	-165.1	-175.3	174.1	-176.2	0	116
312	G	33.2	Very low	34.1	Very low	73 Å²	73	141.2 Å²	141.2	75%	0.753	79%	0.785	S	S	*	*			trans	160.7	97	168.6	0	0	0	0	0	107.5
313	K	43	Very low	34.4	Very low	168 Å²	168	137.3 Å²	137.3	73%	0.73	79%	0.785	S	S	*	*			cis	71	99.5	36.1	-114.6	-88.9	177.5	-174.2	0	111.9	E315	K313-E315 IonicContact NZ-OE2 2.66Å; K313-E315 PolarHBondContact NZ-OE2 3.16Å
314	G	30.2	Very low	34.9	Very low	80 Å²	80	146 Å²	146	83%	0.825	80%	0.796	S	S	*	*			trans	-146.1	132.8	167.5	0	0	0	0	0	109.1
315	E	30.4	Very low	35.2	Very low	130 Å²	130	142.4 Å²	142.4	61%	0.607	79%	0.794	S	S	*	*			trans	-161.9	140.1	-167.8	177	-168.3	155	0	0	107.9	K313	K313-E315 IonicContact NZ-OE2 2.66Å; K313-E315 PolarHBondContact NZ-OE2 3.16Å
316	V	36.2	Very low	35.4	Very low	144 Å²	144	139.7 Å²	139.7	87%	0.873	79%	0.791	S	S	*	*			trans	-177.1	163.3	150.4	151	0	0	0	0	109.6
317	K	51.5	Low	35.5	Very low	152 Å²	152	138.1 Å²	138.1	66%	0.661	80%	0.798	S	S	*	*			trans	-115.2	-177.2	-151.3	-57.4	172	177.6	177.6	0	115.3
318	H	41.5	Very low	35.8	Very low	185 Å²	185	134.2 Å²	134.2	86%	0.856	80%	0.798	S	S	*	*			trans	87.6	147.5	162.1	-51.9	-73.7	0	0	0	116.8
319	G	35.5	Very low	36.2	Very low	74 Å²	74	130.1 Å²	130.1	76%	0.763	80%	0.798	S	S	*	*			cis	165.8	161.7	-7.3	0	0	0	0	0	113.4
320	G	34.1	Very low	37	Very low	77 Å²	77	131.6 Å²	131.6	79%	0.794	80%	0.801	S	S	*	*			trans	85.7	142	-179.8	0	0	0	0	0	114
321	E	37.8	Very low	36.8	Very low	183 Å²	183	132.7 Å²	132.7	86%	0.855	80%	0.796	S	S	*	*			cis	109.1	134.9	10	-163.9	163.4	-162.9	0	0	115.7
322	D	43	Very low	36.7	Very low	163 Å²	163	132.9 Å²	132.9	87%	0.872	79%	0.792	S	S	*	*			trans	68.1	145.4	172.2	-85.7	-22.6	0	0	0	123.6
323	G	36	Very low	36.5	Very low	78 Å²	78	136 Å²	136	80%	0.804	79%	0.787	S	S	*	*			trans	149.6	89.6	170.9	0	0	0	0	0	115.8
324	R	39.9	Very low	36.2	Very low	253 Å²	253	136.9 Å²	136.9	96%	0.955	79%	0.791	S	S	*	*			trans	-106.8	134.1	176.3	-88.5	-174	168.7	-146.1	1.5	113.6
325	S	37.8	Very low	36.2	Very low	115 Å²	115	144.9 Å²	144.9	80%	0.804	80%	0.796	S	S	*	*			trans	-170.6	148.6	149	49	0	0	0	0	109.7
326	S	32.8	Very low	36	Very low	98 Å²	98	142.5 Å²	142.5	69%	0.685	81%	0.806	S	S	*	*			cis	157.1	121.3	-29.4	49.4	0	0	0	0	106.9
327	S	31.6	Very low	35.7	Very low	128 Å²	128	138.8 Å²	138.8	90%	0.895	80%	0.797	S	S	*	*			trans	59.8	143.3	161.7	59.7	0	0	0	0	120.7
328	G	31.5	Very low	34.7	Very low	76 Å²	76	140.7 Å²	140.7	78%	0.784	81%	0.808	S	S	*	*			trans	172.1	40.6	171.2	0	0	0	0	0	120.3
329	T	35.3	Very low	34.1	Very low	141 Å²	141	137 Å²	137	87%	0.865	80%	0.803	S	S	*	*			trans	-133.5	125.2	170.9	45.2	0	0	0	0	113.3
330	P	48.7	Very low	33.9	Very low	122 Å²	122	142.2 Å²	142.2	79%	0.792	81%	0.808	S	S	*	*				-138.8	159.3	129.1	34.8	-20.7	0	0	0	111.2
331	H	28.1	Very low	33.8	Very low	157 Å²	157	145.1 Å²	145.1	73%	0.727	81%	0.805	S	S	*	*			cis	99.7	120.9	22.3	-166.5	79	0	0	0	115.9
332	R	33.8	Very low	33.5	Very low	194 Å²	194	143.3 Å²	143.3	73%	0.732	80%	0.799	S	S	*	*			trans	66.2	166.1	172.8	-95.1	176.3	-177.3	-151.5	15.2	116.9
333	E	28.2	Very low	33.2	Very low	137 Å²	137	140.9 Å²	140.9	64%	0.64	80%	0.795	S	S	*	*			cis	-147.4	136.9	8.4	-152.7	142	-136.8	0	0	109.1
334	K	36.3	Very low	32.9	Very low	188 Å²	188	140 Å²	140	82%	0.817	79%	0.787	S	S	*	*				63.3	140.5	79.4	-144.9	-171.2	-179.6	-175.4	0	117.7
335	R	29.9	Very low	32.4	Very low	248 Å²	248	134.7 Å²	134.7	94%	0.936	78%	0.782	S	S	*	*			trans	93.5	149.4	179.4	-60.9	-179.8	177.7	-118.7	4	115.3
336	G	26.9	Very low	32.1	Very low	79 Å²	79	139.8 Å²	139.8	81%	0.814	78%	0.784	S	S	*	*			cis	143.9	138.3	-14.5	0	0	0	0	0	115.7
337	G	30.7	Very low	32.2	Very low	66 Å²	66	146.3 Å²	146.3	68%	0.68	79%	0.793	S	S	*	*			trans	87.2	163.6	172.7	0	0	0	0	0	115.7
338	E	30.2	Very low	32.1	Very low	193 Å²	193	143.3 Å²	143.3	90%	0.902	78%	0.783	S	S	*	*			cis	-174	169	-11.9	-120.6	151.3	-151.4	0	0	110.3
339	S	29	Very low	32.3	Very low	107 Å²	107	151.6 Å²	151.6	75%	0.748	79%	0.79	S	S	*	*			trans	72.1	140.1	172.4	-136.3	0	0	0	0	116.4
340	E	31.2	Very low	32	Very low	184 Å²	184	147.7 Å²	147.7	86%	0.86	78%	0.778	S	S	*	*			cis	68.7	137.2	26.6	-50.6	-172.6	142.2	0	0	112.6
341	D	31.7	Very low	31.1	Very low	137 Å²	137	149.9 Å²	149.9	73%	0.733	78%	0.777	S	S	*	*			cis	-165.7	-178.6	15.5	-161.9	-2.3	0	0	0	110.9
342	I	31	Very low	31.2	Very low	145 Å²	145	153 Å²	153	74%	0.744	78%	0.782	S	S	*	*			trans	69.5	147.1	157.2	-72	162.5	0	0	0	117.3
343	S	36.3	Very low	31	Very low	112 Å²	112	152.3 Å²	152.3	78%	0.783	79%	0.79	S	S	*	*			cis	-170.5	179.1	-21.2	65.9	0	0	0	0	108.2
344	G	30	Very low	32.1	Very low	61 Å²	61	150.6 Å²	150.6	63%	0.629	79%	0.791	S	S	*	*			cis	157.5	148.7	-9.6	0	0	0	0	0	115.2
345	V	29.1	Very low	31.8	Very low	141 Å²	141	149.3 Å²	149.3	86%	0.855	79%	0.787	S	S	*	*			trans	80.1	148.5	154.3	-161.4	0	0	0	0	121.2
346	R	32.3	Very low	31.8	Very low	221 Å²	221	144.4 Å²	144.4	83%	0.834	78%	0.779	S	S	*	*			trans	97.4	133.6	168.4	-57.7	176.9	-175.4	-161.1	-1.1	114.4
347	R	35.1	Very low	32.1	Very low	236 Å²	236	145.2 Å²	145.2	89%	0.891	77%	0.772	S	S	*	*			cis	-157.2	174.8	3.4	-98.4	163.8	175.5	171.1	-3	107.8
348	G	28.1	Very low	32.2	Very low	65 Å²	65	150.9 Å²	150.9	67%	0.67	78%	0.781	S	S	*	*			cis	144.5	129.2	-7.2	0	0	0	0	0	114.6
349	R	35.6	Very low	32.4	Very low	250 Å²	250	144.6 Å²	144.6	94%	0.943	77%	0.767	S	S	*	*			trans	84.1	151.4	-173.4	-59.7	178.5	168.5	-176.3	-3.8	115.7
350	G	29.1	Very low	32.6	Very low	59 Å²	59	145.3 Å²	145.3	61%	0.608	77%	0.768	S	S	*	*			cis	164.1	171.3	-9.1	0	0	0	0	0	114.9
351	H	30.6	Very low	32.9	Very low	168 Å²	168	146.3 Å²	146.3	78%	0.778	77%	0.769	S	S	*	*			trans	77.6	155.5	170.8	-43.6	-73.3	0	0	0	118.3
352	R	29.9	Very low	32.9	Very low	221 Å²	221	143.8 Å²	143.8	83%	0.834	78%	0.775	S	S	*	*			cis	-171.2	114.8	-30.9	171.9	-169.9	-87.3	-161.1	-1.6	112.1
353	M	30.2	Very low	33.1	Very low	181 Å²	181	148.5 Å²	148.5	89%	0.892	78%	0.784	S	S	*	*			trans	45.2	163.4	145.1	-67	-53	-165.8	0	0	124.5
354	P	50.2	Low	33	Very low	101 Å²	101	152 Å²	152	66%	0.656	79%	0.787	S	S	*	*			trans	-133.9	-165.5	-154	45.7	-28.5	0	0	0	117.5
355	H	30.7	Very low	33.4	Very low	160 Å²	160	155.7 Å²	155.7	74%	0.741	80%	0.797	S	S	*	*			trans	76.7	145	147.1	97.4	-44.4	0	0	0	124.6
356	L	30.5	Very low	33.9	Very low	145 Å²	145	152.5 Å²	152.5	76%	0.759	79%	0.793	S	S	*	*			trans	169.9	126.9	148.2	-110.6	67.4	0	0	0	104.4
357	S	32.6	Very low	34.1	Very low	96 Å²	96	148 Å²	148	67%	0.671	80%	0.796	S	S	*	*			cis	90.6	119.2	34	78.6	0	0	0	0	115.5
358	E	33.4	Very low	34.4	Very low	186 Å²	186	140.7 Å²	140.7	87%	0.869	79%	0.794	S	S	*	*			trans	-177.6	133.1	139.1	-161.9	56.6	-104.4	0	0	113.7
359	G	33.3	Very low	34.9	Very low	60 Å²	60	141.1 Å²	141.1	62%	0.619	80%	0.798	S	S	*	*			trans	70.1	159.7	154.8	0	0	0	0	0	122.4
360	T	33.7	Very low	35.3	Very low	123 Å²	123	137 Å²	137	76%	0.755	80%	0.795	S	S	*	*			cis	-160.8	135.5	-12.4	-70.3	0	0	0	0	112.1
361	K	37.3	Very low	36.1	Very low	205 Å²	205	137.4 Å²	137.4	89%	0.891	80%	0.799	S	S	*	*			trans	28.4	135.4	157.6	-60.2	167.5	-178.8	172.1	0	122.4
362	G	31.3	Very low	37.1	Very low	83 Å²	83	137.6 Å²	137.6	86%	0.856	80%	0.8	S	S	*	*			trans	179.9	112.7	153	0	0	0	0	0	116.1
363	R	34.9	Very low	37.5	Very low	245 Å²	245	138.1 Å²	138.1	93%	0.925	80%	0.802	S	S	*	*			trans	-97.4	154.3	161.2	-109.4	-173.8	172	-159.6	-1.3	107.9
364	Q	34.5	Very low	38.4	Very low	184 Å²	184	140.8 Å²	140.8	86%	0.86	80%	0.803	S	S	*	*				175.3	172.9	107.8	-160.6	138.1	-12.4	0	0	111.4
365	V	39.2	Very low	38	Very low	139 Å²	139	139.4 Å²	139.4	84%	0.842	81%	0.807	S	S	*	*			trans	-96.9	162.1	-176.6	-69	0	0	0	0	112.4
366	G	39.3	Very low	38.5	Very low	74 Å²	74	137.6 Å²	137.6	76%	0.763	81%	0.812	S	S	*	*			trans	161.3	115	153.4	0	0	0	0	0	118.3
367	S	37.8	Very low	39.6	Very low	128 Å²	128	138.1 Å²	138.1	90%	0.895	82%	0.816	S	S	*	*			trans	3.6	133	151	-54.1	0	0	0	0	122.5
368	G	40.9	Very low	40	Very low	82 Å²	82	145.1 Å²	145.1	85%	0.845	83%	0.827	S	S	*	*				96.1	155.8	97.7	0	0	0	0	0	119.5
369	G	38.9	Very low	40.3	Very low	74 Å²	74	140.3 Å²	140.3	76%	0.763	83%	0.827	S	S	*	*			trans	103.2	104.3	-174.4	0	0	0	0	0	110.1
370	D	43.8	Very low	40.9	Very low	164 Å²	164	142.3 Å²	142.3	88%	0.877	83%	0.832	S	S	*	*				72.8	128.5	62.6	-168.3	20.5	0	0	0	112.7
371	G	44.5	Very low	41.8	Very low	67 Å²	67	147.5 Å²	147.5	69%	0.691	84%	0.838	S	S	*	*			trans	168	19.2	-165	0	0	0	0	0	115.4	R373	G371-R373 PolarHBondContact O-N 3.22Å
372	E	52.3	Low	42.6	Very low	172 Å²	172	139.5 Å²	139.5	80%	0.804	81%	0.813	S	S	*	*			trans	-63.1	99.6	176.3	-55.7	-65.5	161.8	0	0	110.4
373	R	38.7	Very low	44.3	Very low	231 Å²	231	137.8 Å²	137.8	87%	0.872	79%	0.788	S	S	*	*			trans	-137.2	75.3	173.7	-154.7	169.4	-162.4	-99	-1.2	114.8	G371	G371-R373 PolarHBondContact O-N 3.22Å
374	W	48	Very low	46	Very low	238 Å²	238	131.8 Å²	131.8	90%	0.902	77%	0.774	S	S	*	*			trans	33.9	102.4	140.8	-61.3	96.1	0	0	0	116.6
375	G	42.4	Very low	48	Very low	72 Å²	72	128.5 Å²	128.5	74%	0.742	76%	0.762	S	S	*	*			trans	-69.8	177.1	170.4	0	0	0	0	0	113.2
376	S	40.6	Very low	49.9	Very low	122 Å²	122	127.3 Å²	127.3	85%	0.853	75%	0.747	S	S	*	*			trans	-156.2	123.1	163.4	-78.5	0	0	0	0	110.2	R378	S376-R378 PolarHBondContact O-N 3.14Å
377	D	55.1	Low	51.6	Low	156 Å²	156	130.1 Å²	130.1	83%	0.834	74%	0.741	S	S	*	*			trans	-60.4	121	154.1	-83.5	-63.7	0	0	0	109.6
378	R	41.2	Very low	53.6	Low	243 Å²	243	127.9 Å²	127.9	92%	0.917	72%	0.718	S	S	*	*			trans	-174.3	117.9	139.3	-95	139	-146	-92.9	-0.1	108.8	S376	S376-R378 PolarHBondContact O-N 3.14Å
379	G	38.8	Very low	55.8	Low	84 Å²	84	126 Å²	126	87%	0.866	70%	0.695	S	S	*	*			trans	-84.2	168.3	-175.8	0	0	0	0	0	114.5
380	S	45.2	Very low	57.9	Low	103 Å²	103	126.9 Å²	126.9	72%	0.72	68%	0.682	S	S	*	*			trans	-135.5	130.3	151	-168.9	0	0	0	0	105.4	G382	S380-G382 PolarHBondContact O-N 3.42Å; S380-G382 PolarHBondContact OG-N 2.78Å
381	R	53.2	Low	60.1	Low	231 Å²	231	123.3 Å²	123.3	87%	0.872	67%	0.665	S	S	*	*				52.4	15.4	54.7	-69.6	-174.1	67.9	163.6	-0.8	114.6	S383	R381-S383 PolarHBondContact O-N 2.7Å
382	G	54.9	Low	62.1	Low	37 Å²	37	124.8 Å²	124.8	38%	0.381	66%	0.657	S	S	.	*			trans	-59.9	90.4	137.2	0	0	0	0	0	106.8	S380 E386	S380-G382 PolarHBondContact O-N 3.42Å; S380-G382 PolarHBondContact OG-N 2.78Å; G382-E386 WeakPolarHBondContact CA-OE1 3.47Å; G382-E386 WeakPolarHBondContact CA-OE2 3.17Å
383	S	65.6	Low	63.8	Low	47 Å²	47	121.7 Å²	121.7	33%	0.329	65%	0.645	S	S	.	*			trans	-82.6	171.7	-149.8	70	0	0	0	0	112.6	R381 N385 E386	R381-S383 PolarHBondContact O-N 2.7Å; S383-N385 PolarHBondContact O-N 2.93Å; S383-E386 WeakPolarHBondContact O-CB 3.23Å; S383-E386 PolarHBondContact O-N 3.35Å
384	L	71.7	Confident	65.8	Low	120 Å²	120	118.3 Å²	118.3	63%	0.628	63%	0.632	S	S	*	*	H	α-helix	trans	-44.3	-30.9	176.4	-158	157.6	0	0	0	113	E386 Q387 I388	L384-E386 VanDerWaalsContact C-N 3.33Å; L384-E386 PolarHBondContact O-N 3.18Å; L384-Q387 PolarHBondContact O-N 3.05Å; L384-Q387 VanDerWaalsContact O-N 3.16Å; L384-I388 HydrophobicContact CD2-CD1 3.39Å; L384-I388 HydrophobicContact CD2-CG1 3.82Å; L384-I388 PolarHBondContact O-N 3.46Å
385	N	75	Confident	67.9	Low	115 Å²	115	112.2 Å²	112.2	62%	0.615	62%	0.616	S	S	*	*	H	α-helix	trans	-57.4	-35.5	173	-61.4	0.3	0	0	0	114.5	S383 A389	S383-N385 PolarHBondContact O-N 2.93Å; N385-A389 WeakPolarHBondContact O-CB 3.39Å; N385-A389 PolarHBondContact O-N 2.69Å
386	E	79.5	Confident	70	Confident	113 Å²	113	114.3 Å²	114.3	53%	0.528	61%	0.607	S	S	.	*	H	α-helix	trans	-72.8	-35.6	176.4	-67.9	168.6	-164.4	0	0	111.3	G382 S383 L384 A389 L390	G382-E386 WeakPolarHBondContact CA-OE1 3.47Å; G382-E386 WeakPolarHBondContact CA-OE2 3.17Å; S383-E386 WeakPolarHBondContact O-CB 3.23Å; S383-E386 PolarHBondContact O-N 3.35Å; L384-E386 VanDerWaalsContact C-N 3.33Å; L384-E386 PolarHBondContact O-N 3.18Å; E386-A389 PolarHBondContact O-N 2.85Å; E386-L390 WeakPolarHBondContact O-CG 3.35Å; E386-L390 PolarHBondContact O-N 3.46Å
387	Q	76.4	Confident	72.3	Confident	133 Å²	133	114.9 Å²	114.9	62%	0.621	60%	0.596	S	S	*	*	H	α-helix	trans	-69.9	-39.7	172.7	-64.3	-176.7	-10.1	0	0	111.1	L384 L390 V391	L384-Q387 PolarHBondContact O-N 3.05Å; L384-Q387 VanDerWaalsContact O-N 3.16Å; Q387-L390 PolarHBondContact O-N 2.78Å; Q387-V391 WeakPolarHBondContact O-CG2 2.97Å; Q387-V391 PolarHBondContact O-N 3.13Å
388	I	79.5	Confident	74.1	Confident	81 Å²	81	111.7 Å²	111.7	42%	0.415	58%	0.579	S	S	.	*	H	α-helix	trans	-58.9	-47.3	168.7	-75	168.8	0	0	0	110.3	L384 L390 V391 L392	L384-I388 HydrophobicContact CD2-CD1 3.39Å; L384-I388 HydrophobicContact CD2-CG1 3.82Å; L384-I388 PolarHBondContact O-N 3.46Å; I388-L390 VanDerWaalsContact C-N 3.35Å; I388-L390 PolarHBondContact O-N 3.37Å; I388-V391 CarbonylContact O-C 3.6Å; I388-V391 PolarHBondContact O-N 2.93Å; I388-V391 VanDerWaalsContact O-N 3.13Å; I388-L392 HydrophobicContact CG2-CD1 3.61Å; I388-L392 HydrophobicContact CG2-CG 4.05Å; I388-L392 WeakPolarHBondContact O-CB 3.39Å; I388-L392 VanDerWaalsContact O-CG 3.3Å; I388-L392 WeakPolarHBondContact O-CG 3.32Å; I388-L392 PolarHBondContact O-N 2.9Å
389	A	86	Confident	76.3	Confident	44 Å²	44	105.5 Å²	105.5	36%	0.364	56%	0.562	S	S	.	*	H	α-helix	trans	-59.7	-43.9	178.3	0	0	0	0	0	111.9	N385 E386 V391 L392 I393	N385-A389 WeakPolarHBondContact O-CB 3.39Å; N385-A389 PolarHBondContact O-N 2.69Å; E386-A389 PolarHBondContact O-N 2.85Å; A389-V391 VanDerWaalsContact C-N 3.35Å; A389-V391 PolarHBondContact O-N 3.38Å; A389-L392 PolarHBondContact O-N 3.41Å; A389-I393 WeakPolarHBondContact O-CB 3.42Å; A389-I393 WeakPolarHBondContact O-CD1 3.43Å; A389-I393 WeakPolarHBondContact O-CG1 3.28Å; A389-I393 PolarHBondContact O-N 3.32Å
390	L	84.4	Confident	78.7	Confident	92 Å²	92	106.2 Å²	106.2	48%	0.482	54%	0.543	S	S	.	.	H	α-helix	trans	-63.2	-36.4	174.1	-78.3	167.3	0	0	0	113.2	E386 Q387 I388 R394	E386-L390 WeakPolarHBondContact O-CG 3.35Å; E386-L390 PolarHBondContact O-N 3.46Å; Q387-L390 PolarHBondContact O-N 2.78Å; I388-L390 VanDerWaalsContact C-N 3.35Å; I388-L390 PolarHBondContact O-N 3.37Å; L390-R394 WeakPolarHBondContact O-CB 3.33Å; L390-R394 WeakPolarHBondContact O-CD 3.22Å; L390-R394 VanDerWaalsContact O-CG 3.23Å; L390-R394 WeakPolarHBondContact O-CG 3.26Å; L390-R394 PolarHBondContact O-N 3.12Å
391	V	88.8	Confident	80.8	Confident	89 Å²	89	105.7 Å²	105.7	54%	0.539	53%	0.532	S	S	.	.	H	α-helix	trans	-70.7	-42.6	174.7	168.4	0	0	0	0	111.3	Q387 I388 A389 R394 L395	Q387-V391 WeakPolarHBondContact O-CG2 2.97Å; Q387-V391 PolarHBondContact O-N 3.13Å; I388-V391 CarbonylContact O-C 3.6Å; I388-V391 PolarHBondContact O-N 2.93Å; I388-V391 VanDerWaalsContact O-N 3.13Å; A389-V391 VanDerWaalsContact C-N 3.35Å; A389-V391 PolarHBondContact O-N 3.38Å; V391-R394 PolarHBondContact O-N 2.86Å; V391-L395 VanDerWaalsContact O-CB 3.28Å; V391-L395 WeakPolarHBondContact O-CB 3.41Å; V391-L395 PolarHBondContact O-N 3.49Å
392	L	86.5	Confident	82.7	Confident	98 Å²	98	98.6 Å²	98.6	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-64.5	-43	177.8	-72.6	174.1	0	0	0	111.9	I388 A389 R394 L395 Q396	I388-L392 HydrophobicContact CG2-CD1 3.61Å; I388-L392 HydrophobicContact CG2-CG 4.05Å; I388-L392 WeakPolarHBondContact O-CB 3.39Å; I388-L392 VanDerWaalsContact O-CG 3.3Å; I388-L392 WeakPolarHBondContact O-CG 3.32Å; I388-L392 PolarHBondContact O-N 2.9Å; A389-L392 PolarHBondContact O-N 3.41Å; L392-R394 PolarHBondContact O-N 2.93Å; L392-L395 PolarHBondContact O-N 3.17Å; L392-Q396 VanDerWaalsContact O-CB 3.26Å; L392-Q396 WeakPolarHBondContact O-CB 3.42Å; L392-Q396 PolarHBondContact O-N 3.37Å
393	I	88	Confident	84.4	Confident	106 Å²	106	101.3 Å²	101.3	54%	0.544	52%	0.519	S	S	.	.	H	α-helix	trans	-60.2	-46.4	175.5	-71.1	163.3	0	0	0	110.4	A389 Q396 E397	A389-I393 WeakPolarHBondContact O-CB 3.42Å; A389-I393 WeakPolarHBondContact O-CD1 3.43Å; A389-I393 WeakPolarHBondContact O-CG1 3.28Å; A389-I393 PolarHBondContact O-N 3.32Å; I393-Q396 PolarHBondContact O-N 3Å; I393-E397 WeakPolarHBondContact O-CB 3.42Å; I393-E397 PolarHBondContact O-N 3.38Å
394	R	81.1	Confident	85.5	Confident	160 Å²	160	105.8 Å²	105.8	60%	0.604	54%	0.535	S	S	*	.	H	α-helix	trans	-64.8	-40	176.9	-72.5	169.1	-179.4	161.2	0.9	112.8	L390 V391 L392 E397 D398	L390-R394 WeakPolarHBondContact O-CB 3.33Å; L390-R394 WeakPolarHBondContact O-CD 3.22Å; L390-R394 VanDerWaalsContact O-CG 3.23Å; L390-R394 WeakPolarHBondContact O-CG 3.26Å; L390-R394 PolarHBondContact O-N 3.12Å; V391-R394 PolarHBondContact O-N 2.86Å; L392-R394 PolarHBondContact O-N 2.93Å; R394-E397 PolarHBondContact O-N 3.01Å; R394-D398 WeakPolarHBondContact O-CB 3.47Å; R394-D398 PolarHBondContact O-N 2.89Å
395	L	92.4	Very high	86.4	Confident	110 Å²	110	108.6 Å²	108.6	58%	0.576	54%	0.537	S	S	*	.	H	α-helix	trans	-66.8	-37.9	177.1	-177.9	64.4	0	0	0	111.7	V391 L392 M399	V391-L395 VanDerWaalsContact O-CB 3.28Å; V391-L395 WeakPolarHBondContact O-CB 3.41Å; V391-L395 PolarHBondContact O-N 3.49Å; L392-L395 PolarHBondContact O-N 3.17Å; L395-M399 WeakPolarHBondContact O-CB 3.46Å; L395-M399 PolarHBondContact O-N 3Å
396	Q	85.6	Confident	87.1	Confident	116 Å²	116	107.6 Å²	107.6	54%	0.542	53%	0.532	S	S	.	.	H	α-helix	trans	-69.1	-38.2	176.5	-175.5	172.7	-10.1	0	0	111.7	L392 I393 Q400	L392-Q396 VanDerWaalsContact O-CB 3.26Å; L392-Q396 WeakPolarHBondContact O-CB 3.42Å; L392-Q396 PolarHBondContact O-N 3.37Å; I393-Q396 PolarHBondContact O-N 3Å; Q396-Q400 VanDerWaalsContact O-CG 3.26Å; Q396-Q400 WeakPolarHBondContact O-CG 3.47Å; Q396-Q400 PolarHBondContact O-N 3.31Å; Q396-Q400 VanDerWaalsContact O-N 3.12Å
397	E	88.6	Confident	87.3	Confident	134 Å²	134	108 Å²	108	63%	0.626	53%	0.533	S	S	*	.	H	α-helix	trans	-65.4	-44.8	172.1	-175.8	171.3	-141	0	0	111.9	I393 R394 Q400 N401	I393-E397 WeakPolarHBondContact O-CB 3.42Å; I393-E397 PolarHBondContact O-N 3.38Å; R394-E397 PolarHBondContact O-N 3.01Å; E397-Q400 PolarHBondContact O-N 2.83Å; E397-N401 PolarHBondContact O-N 2.89Å
398	D	93.2	Very high	87.7	Confident	90 Å²	90	108.5 Å²	108.5	48%	0.481	53%	0.533	S	S	.	.	H	α-helix	trans	-66.4	-40.2	177.4	-166.3	42.7	0	0	0	112.1	R394 Q400 N401 V402	R394-D398 WeakPolarHBondContact O-CB 3.47Å; R394-D398 PolarHBondContact O-N 2.89Å; D398-Q400 VanDerWaalsContact C-N 3.31Å; D398-Q400 PolarHBondContact O-N 3.35Å; D398-N401 WeakPolarHBondContact O-CB 3.47Å; D398-N401 PolarHBondContact O-N 3.37Å; D398-N401 VanDerWaalsContact O-N 3.16Å; D398-V402 WeakPolarHBondContact O-CG2 3.3Å; D398-V402 PolarHBondContact O-N 3.37Å
399	M	87.5	Confident	87.8	Confident	112 Å²	112	109.3 Å²	109.3	55%	0.552	54%	0.538	S	S	*	.	H	α-helix	trans	-60.9	-39.3	173.2	-171.1	-178.4	72.6	0	0	111.9	L395 V402 L403	L395-M399 WeakPolarHBondContact O-CB 3.46Å; L395-M399 PolarHBondContact O-N 3Å; M399-V402 PolarHBondContact O-N 2.93Å; M399-L403 HydrophobicContact CG-CD1 4.17Å; M399-L403 WeakPolarHBondContact O-CB 3.36Å; M399-L403 VanDerWaalsContact O-CG 3.26Å; M399-L403 WeakPolarHBondContact O-CG 3.27Å; M399-L403 PolarHBondContact O-N 3.46Å
400	Q	89.2	Confident	87.7	Confident	99 Å²	99	112.3 Å²	112.3	46%	0.463	54%	0.544	S	S	.	.	H	α-helix	trans	-65.6	-39.9	174.5	-72.7	170.4	19.7	0	0	111.9	Q396 E397 D398 L403 Q404	Q396-Q400 VanDerWaalsContact O-CG 3.26Å; Q396-Q400 WeakPolarHBondContact O-CG 3.47Å; Q396-Q400 PolarHBondContact O-N 3.31Å; Q396-Q400 VanDerWaalsContact O-N 3.12Å; E397-Q400 PolarHBondContact O-N 2.83Å; D398-Q400 VanDerWaalsContact C-N 3.31Å; D398-Q400 PolarHBondContact O-N 3.35Å; Q400-L403 PolarHBondContact O-N 3.34Å; Q400-Q404 WeakPolarHBondContact O-CB 3.42Å; Q400-Q404 WeakPolarHBondContact O-CG 3.33Å; Q400-Q404 PolarHBondContact O-N 3.28Å
401	N	90.6	Very high	87.3	Confident	93 Å²	93	111.8 Å²	111.8	50%	0.497	55%	0.545	S	S	.	.	H	α-helix	trans	-63.9	-43.3	175	-171	10.9	0	0	0	111.8	E397 D398 Q404 R405	E397-N401 PolarHBondContact O-N 2.89Å; D398-N401 WeakPolarHBondContact O-CB 3.47Å; D398-N401 PolarHBondContact O-N 3.37Å; D398-N401 VanDerWaalsContact O-N 3.16Å; N401-Q404 PolarHBondContact O-N 3.3Å; N401-R405 VanDerWaalsContact O-CB 3.28Å; N401-R405 WeakPolarHBondContact O-CB 3.42Å; N401-R405 PolarHBondContact O-N 2.96Å
402	V	93.3	Very high	86.4	Confident	81 Å²	81	112.4 Å²	112.4	49%	0.491	55%	0.545	S	S	.	.	H	α-helix	trans	-62.2	-45.1	173.7	171.1	0	0	0	0	111.2	D398 M399 R405 L406	D398-V402 WeakPolarHBondContact O-CG2 3.3Å; D398-V402 PolarHBondContact O-N 3.37Å; M399-V402 PolarHBondContact O-N 2.93Å; V402-R405 PolarHBondContact O-N 2.87Å; V402-L406 VanDerWaalsContact O-CB 3.32Å; V402-L406 WeakPolarHBondContact O-CB 3.42Å; V402-L406 PolarHBondContact O-N 3.48Å
403	L	89.4	Confident	85.9	Confident	95 Å²	95	111.5 Å²	111.5	50%	0.497	54%	0.543	S	S	.	.	H	α-helix	trans	-64.1	-43.8	177.2	-73.6	168.2	0	0	0	112.2	M399 Q400 R405 L406 H407	M399-L403 HydrophobicContact CG-CD1 4.17Å; M399-L403 WeakPolarHBondContact O-CB 3.36Å; M399-L403 VanDerWaalsContact O-CG 3.26Å; M399-L403 WeakPolarHBondContact O-CG 3.27Å; M399-L403 PolarHBondContact O-N 3.46Å; Q400-L403 PolarHBondContact O-N 3.34Å; L403-R405 VanDerWaalsContact C-N 3.33Å; L403-R405 PolarHBondContact O-N 2.84Å; L403-L406 PolarHBondContact O-N 3.37Å; L403-H407 WeakPolarHBondContact O-CB 3.47Å; L403-H407 PolarHBondContact O-N 3.46Å
404	Q	89.6	Confident	85	Confident	141 Å²	141	109.3 Å²	109.3	66%	0.659	54%	0.541	S	S	*	.	H	α-helix	trans	-61.5	-41.6	173.8	-74.9	-179.7	11	0	0	111.8	Q400 N401 K408	Q400-Q404 WeakPolarHBondContact O-CB 3.42Å; Q400-Q404 WeakPolarHBondContact O-CG 3.33Å; Q400-Q404 PolarHBondContact O-N 3.28Å; N401-Q404 PolarHBondContact O-N 3.3Å; Q404-K408 VanDerWaalsContact O-CB 3.27Å; Q404-K408 WeakPolarHBondContact O-CB 3.47Å; Q404-K408 PolarHBondContact O-N 3.2Å
405	R	89.9	Confident	84.1	Confident	179 Å²	179	104.4 Å²	104.4	68%	0.675	53%	0.531	S	S	*	.	H	α-helix	trans	-67.2	-37.6	176.6	-173.2	174.5	-178.7	171.4	-0.5	112	N401 V402 L403 K408 L409	N401-R405 VanDerWaalsContact O-CB 3.28Å; N401-R405 WeakPolarHBondContact O-CB 3.42Å; N401-R405 PolarHBondContact O-N 2.96Å; V402-R405 PolarHBondContact O-N 2.87Å; L403-R405 VanDerWaalsContact C-N 3.33Å; L403-R405 PolarHBondContact O-N 2.84Å; R405-K408 PolarHBondContact O-N 3.28Å; R405-L409 HydrophobicContact CG-CD1 4.39Å; R405-L409 WeakPolarHBondContact O-CB 3.45Å; R405-L409 VanDerWaalsContact O-CG 3.31Å; R405-L409 WeakPolarHBondContact O-CG 3.26Å; R405-L409 PolarHBondContact O-N 2.97Å
406	L	90.3	Very high	82.6	Confident	94 Å²	94	105.8 Å²	105.8	49%	0.492	54%	0.535	S	S	.	.	H	α-helix	trans	-65.9	-49.1	175.3	-173.9	148.2	0	0	0	110.7	V402 L403 K408 L409 E410	V402-L406 VanDerWaalsContact O-CB 3.32Å; V402-L406 WeakPolarHBondContact O-CB 3.42Å; V402-L406 PolarHBondContact O-N 3.48Å; L403-L406 PolarHBondContact O-N 3.37Å; L406-K408 VanDerWaalsContact C-N 3.25Å; L406-K408 PolarHBondContact O-N 2.86Å; L406-L409 CarbonylContact O-C 3.52Å; L406-L409 WeakPolarHBondContact O-CA 3.26Å; L406-L409 WeakPolarHBondContact O-CB 3.37Å; L406-L409 PolarHBondContact O-N 2.86Å; L406-E410 WeakPolarHBondContact O-CB 3.41Å; L406-E410 PolarHBondContact O-N 3.24Å
407	H	83.9	Confident	81.1	Confident	120 Å²	120	102.1 Å²	102.1	56%	0.556	53%	0.525	S	S	*	.	H	α-helix	trans	-64.4	-30.3	177.7	-150.4	-98	0	0	0	112.3	L403 E410 T411	L403-H407 WeakPolarHBondContact O-CB 3.47Å; L403-H407 PolarHBondContact O-N 3.46Å; H407-E410 IonicContact CD2-OE2 3.74Å; H407-T411 WeakPolarHBondContact O-CB 3.42Å; H407-T411 WeakPolarHBondContact O-CG2 3.3Å; H407-T411 PolarHBondContact O-N 2.9Å; H407-T411 PolarHBondContact O-OG1 3.24Å
408	K	84.6	Confident	79.3	Confident	145 Å²	145	103.8 Å²	103.8	63%	0.63	53%	0.53	S	S	*	.	H	α-helix	trans	-70.8	-36.2	170.3	-174.3	174.2	-178.2	175.9	0	112.9	Q404 R405 L406 T411 L412	Q404-K408 VanDerWaalsContact O-CB 3.27Å; Q404-K408 WeakPolarHBondContact O-CB 3.47Å; Q404-K408 PolarHBondContact O-N 3.2Å; R405-K408 PolarHBondContact O-N 3.28Å; L406-K408 VanDerWaalsContact C-N 3.25Å; L406-K408 PolarHBondContact O-N 2.86Å; K408-T411 WeakPolarHBondContact CA-OG1 3.35Å; K408-T411 PolarHBondContact O-OG1 3.44Å; K408-L412 VanDerWaalsContact O-CG 3.27Å; K408-L412 WeakPolarHBondContact O-CG 3.41Å; K408-L412 PolarHBondContact O-N 2.9Å
409	L	81.2	Confident	77	Confident	97 Å²	97	105.1 Å²	105.1	51%	0.508	54%	0.536	S	S	.	.	H	α-helix	trans	-71.5	-39.3	172.1	-74.5	168.3	0	0	0	111.1	R405 L406 L412 T413	R405-L409 HydrophobicContact CG-CD1 4.39Å; R405-L409 WeakPolarHBondContact O-CB 3.45Å; R405-L409 VanDerWaalsContact O-CG 3.31Å; R405-L409 WeakPolarHBondContact O-CG 3.26Å; R405-L409 PolarHBondContact O-N 2.97Å; L406-L409 CarbonylContact O-C 3.52Å; L406-L409 WeakPolarHBondContact O-CA 3.26Å; L406-L409 WeakPolarHBondContact O-CB 3.37Å; L406-L409 PolarHBondContact O-N 2.86Å; L409-L412 PolarHBondContact O-N 2.9Å; L409-T413 WeakPolarHBondContact O-CB 3.45Å; L409-T413 PolarHBondContact O-N 3.16Å; L409-T413 PolarHBondContact O-OG1 2.92Å
410	E	82.9	Confident	74.5	Confident	108 Å²	108	103.6 Å²	103.6	51%	0.505	54%	0.536	S	S	.	.	H	α-helix	trans	-63	-45.2	177.5	-175.3	176.8	-173.2	0	0	111.6	L406 H407 L412 T413 A414	L406-E410 WeakPolarHBondContact O-CB 3.41Å; L406-E410 PolarHBondContact O-N 3.24Å; H407-E410 IonicContact CD2-OE2 3.74Å; E410-L412 VanDerWaalsContact C-N 3.33Å; E410-L412 PolarHBondContact O-N 3.39Å; E410-T413 PolarHBondContact O-N 3.38Å; E410-A414 WeakPolarHBondContact O-CB 3.37Å; E410-A414 PolarHBondContact O-N 3.32Å
411	T	75.9	Confident	71.9	Confident	80 Å²	80	108.9 Å²	108.9	49%	0.491	55%	0.552	S	S	.	*	H	α-helix	trans	-65.2	-33.8	174.8	44.2	0	0	0	0	113.1	H407 K408 S415	H407-T411 WeakPolarHBondContact O-CB 3.42Å; H407-T411 WeakPolarHBondContact O-CG2 3.3Å; H407-T411 PolarHBondContact O-N 2.9Å; H407-T411 PolarHBondContact O-OG1 3.24Å; K408-T411 WeakPolarHBondContact CA-OG1 3.35Å; K408-T411 PolarHBondContact O-OG1 3.44Å; T411-S415 WeakPolarHBondContact O-CB 3.23Å; T411-S415 PolarHBondContact O-N 3.44Å; T411-S415 PolarHBondContact O-OG 3.12Å
412	L	70.8	Confident	69.7	Low	102 Å²	102	111.9 Å²	111.9	53%	0.534	56%	0.563	S	S	.	*	H	α-helix	trans	-72.3	-39.8	171.8	-70.6	172.6	0	0	0	112.4	K408 L409 E410 S415 Q416	K408-L412 VanDerWaalsContact O-CG 3.27Å; K408-L412 WeakPolarHBondContact O-CG 3.41Å; K408-L412 PolarHBondContact O-N 2.9Å; L409-L412 PolarHBondContact O-N 2.9Å; E410-L412 VanDerWaalsContact C-N 3.33Å; E410-L412 PolarHBondContact O-N 3.39Å; L412-S415 WeakPolarHBondContact CA-OG 3.26Å; L412-S415 PolarHBondContact O-OG 2.83Å; L412-Q416 VanDerWaalsContact O-CB 3.23Å; L412-Q416 WeakPolarHBondContact O-CB 3.47Å; L412-Q416 PolarHBondContact O-N 3.25Å
413	T	75.9	Confident	67.2	Low	80 Å²	80	114.2 Å²	114.2	49%	0.491	58%	0.578	S	S	.	*	H	α-helix	trans	-71.1	-39.2	177.9	-63.1	0	0	0	0	111.7	L409 E410 Q416 A417	L409-T413 WeakPolarHBondContact O-CB 3.45Å; L409-T413 PolarHBondContact O-N 3.16Å; L409-T413 PolarHBondContact O-OG1 2.92Å; E410-T413 PolarHBondContact O-N 3.38Å; T413-Q416 PolarHBondContact O-N 2.98Å; T413-A417 VanDerWaalsContact O-CB 3.25Å; T413-A417 WeakPolarHBondContact O-CB 3.3Å; T413-A417 PolarHBondContact O-N 3.37Å
414	A	69.4	Low	64.6	Low	60 Å²	60	114.6 Å²	114.6	50%	0.496	59%	0.589	S	S	.	*	H	α-helix	trans	-65.6	-38.3	175.5	0	0	0	0	0	111.9	E410 K418	E410-A414 WeakPolarHBondContact O-CB 3.37Å; E410-A414 PolarHBondContact O-N 3.32Å; A414-K418 VanDerWaalsContact O-CB 3.3Å; A414-K418 WeakPolarHBondContact O-CB 3.48Å; A414-K418 PolarHBondContact O-N 3.24Å
415	S	62.6	Low	61.9	Low	57 Å²	57	115 Å²	115	40%	0.399	60%	0.595	S	S	.	*	H	α-helix	trans	-73.2	-37.9	173.2	50.7	0	0	0	0	112.5	T411 L412 K418 L419	T411-S415 WeakPolarHBondContact O-CB 3.23Å; T411-S415 PolarHBondContact O-N 3.44Å; T411-S415 PolarHBondContact O-OG 3.12Å; L412-S415 WeakPolarHBondContact CA-OG 3.26Å; L412-S415 PolarHBondContact O-OG 2.83Å; S415-K418 PolarHBondContact O-N 3.08Å; S415-L419 WeakPolarHBondContact O-CG 3.49Å; S415-L419 PolarHBondContact O-N 3.22Å
416	Q	61	Low	59.3	Low	138 Å²	138	115.5 Å²	115.5	65%	0.645	61%	0.605	S	S	*	*	H	α-helix	trans	-63.1	-43.7	173	-173.5	176.4	28.3	0	0	112.2	L412 T413 L419 S420	L412-Q416 VanDerWaalsContact O-CB 3.23Å; L412-Q416 WeakPolarHBondContact O-CB 3.47Å; L412-Q416 PolarHBondContact O-N 3.25Å; T413-Q416 PolarHBondContact O-N 2.98Å; Q416-L419 PolarHBondContact O-N 2.92Å; Q416-S420 PolarHBondContact O-N 3.04Å
417	A	53.7	Low	56.9	Low	40 Å²	40	116.9 Å²	116.9	33%	0.331	62%	0.62	S	S	.	*	H	α-helix	trans	-62.4	-44.9	173.8	0	0	0	0	0	111	T413 L419 S420 W421	T413-A417 VanDerWaalsContact O-CB 3.25Å; T413-A417 WeakPolarHBondContact O-CB 3.3Å; T413-A417 PolarHBondContact O-N 3.37Å; A417-L419 PolarHBondContact O-N 3.11Å; A417-S420 PolarHBondContact O-N 2.79Å; A417-S420 VanDerWaalsContact O-N 3.1Å; A417-S420 PolarHBondContact O-OG 3.04Å; A417-W421 PolarHBondContact O-N 3.38Å
418	K	51.4	Low	54.7	Low	169 Å²	169	116.5 Å²	116.5	74%	0.735	63%	0.631	S	S	*	*	H	α-helix	trans	-63.9	-25.7	178.4	-158	161.7	-168.9	167	0	113.3	A414 S415	A414-K418 VanDerWaalsContact O-CB 3.3Å; A414-K418 WeakPolarHBondContact O-CB 3.48Å; A414-K418 PolarHBondContact O-N 3.24Å; S415-K418 PolarHBondContact O-N 3.08Å
419	L	43.7	Very low	52.7	Low	118 Å²	118	115 Å²	115	62%	0.618	64%	0.639	S	S	*	*	H	α-helix	trans	-83.1	-30.7	171.9	-74.9	164.6	0	0	0	113.4	S415 Q416 A417 W421 Q422	S415-L419 WeakPolarHBondContact O-CG 3.49Å; S415-L419 PolarHBondContact O-N 3.22Å; Q416-L419 PolarHBondContact O-N 2.92Å; A417-L419 PolarHBondContact O-N 3.11Å; L419-W421 PolarHBondContact O-N 3.33Å; L419-Q422 PolarHBondContact O-N 3.1Å
420	S	35.4	Very low	51.3	Low	79 Å²	79	119.6 Å²	119.6	55%	0.552	66%	0.657	S	S	*	*	H	α-helix	trans	-70	-31.5	-179.4	67.8	0	0	0	0	113.2	Q416 A417 Q422	Q416-S420 PolarHBondContact O-N 3.04Å; A417-S420 PolarHBondContact O-N 2.79Å; A417-S420 VanDerWaalsContact O-N 3.1Å; A417-S420 PolarHBondContact O-OG 3.04Å; S420-Q422 PolarHBondContact O-N 3.21Å; S420-Q422 VanDerWaalsContact O-N 3.16Å
421	W	34.1	Very low	49.5	Very low	211 Å²	211	123.2 Å²	123.2	80%	0.799	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-4.9	176.4	-66.6	111.1	0	0	0	114.9	A417 L419	A417-W421 PolarHBondContact O-N 3.38Å; L419-W421 PolarHBondContact O-N 3.33Å
422	Q	44.1	Very low	48.5	Very low	155 Å²	155	123.6 Å²	123.6	72%	0.724	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	1.5	-177.7	-68.9	-168.4	-35.9	0	0	115.2	L419 S420	L419-Q422 PolarHBondContact O-N 3.1Å; S420-Q422 PolarHBondContact O-N 3.21Å; S420-Q422 VanDerWaalsContact O-N 3.16Å
423	T	40.6	Very low	47.7	Very low	131 Å²	131	125.3 Å²	125.3	80%	0.804	69%	0.691	S	S	*	*	S	Bend	trans	-114	32.8	-178.6	-36.4	0	0	0	0	113.5
424	S	36.4	Very low	47.6	Very low	103 Å²	103	132.7 Å²	132.7	72%	0.72	71%	0.71	S	S	*	*			trans	-148.4	61.6	170.4	-175.8	0	0	0	0	113
425	N	31.2	Very low	47.2	Very low	148 Å²	148	135.5 Å²	135.5	79%	0.791	71%	0.708	S	S	*	*			trans	-139.3	87.8	167.5	-90.1	-55.4	0	0	0	110.1
426	Q	36.4	Very low	47.6	Very low	190 Å²	190	137.7 Å²	137.7	89%	0.888	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-73.3	143.9	158.2	-99.3	-160.9	-11.7	0	0	109.2	S428	Q426-S428 PolarHBondContact O-N 3.47Å
427	P	38.9	Very low	47.9	Very low	123 Å²	123	137.4 Å²	137.4	80%	0.799	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-66.3	132.6	178.8	27.9	-34.1	0	0	0	110.6
428	S	37.5	Very low	48.4	Very low	113 Å²	113	144.4 Å²	144.4	79%	0.79	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-64.1	140.8	172.9	47	0	0	0	0	110.9	Q426 Q430	Q426-S428 PolarHBondContact O-N 3.47Å; S428-Q430 PolarHBondContact O-N 2.88Å
429	S	43.7	Very low	49.3	Very low	114 Å²	114	142.5 Å²	142.5	80%	0.797	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-64.2	128.3	175.6	43.5	0	0	0	0	110.4	R431	S429-R431 PolarHBondContact O-N 3.34Å
430	Q	51.4	Low	50.8	Low	192 Å²	192	139.8 Å²	139.8	90%	0.897	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-61.9	127.2	-179.8	-67.4	-175.6	-5	0	0	110.2	S428	S428-Q430 PolarHBondContact O-N 2.88Å
431	R	46.1	Very low	52.8	Low	185 Å²	185	139.1 Å²	139.1	70%	0.698	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-69.5	126.1	171.4	-64.4	-174.4	-177.7	-159.4	2.6	108.6	S429 S433	S429-R431 PolarHBondContact O-N 3.34Å; R431-S433 PolarHBondContact O-N 3.38Å
432	P	53.3	Low	54.9	Low	88 Å²	88	130.7 Å²	130.7	57%	0.571	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-65.9	132.5	172.9	27.4	-33.3	0	0	0	109.8	W434 W435	P432-W434 PolarHBondContact O-N 2.9Å; P432-W435 PolarHBondContact O-N 3.07Å
433	S	55.3	Low	56.8	Low	138 Å²	138	125.3 Å²	125.3	97%	0.965	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	11.3	-170.5	50.6	0	0	0	0	115.9	R431	R431-S433 PolarHBondContact O-N 3.38Å
434	W	72.5	Confident	59	Low	234 Å²	234	122 Å²	122	89%	0.886	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	7.5	-178.2	-163.6	58.9	0	0	0	113.5	P432 P436	P432-W434 PolarHBondContact O-N 2.9Å; W434-P436 WeakPolarHBondContact O-CD 3.42Å
435	W	62.6	Low	61.4	Low	119 Å²	119	119.2 Å²	119.2	45%	0.451	65%	0.645	S	S	.	*			trans	-88.9	117.6	-178.1	-156	-106.9	0	0	0	111.8	P432 F437 L444	P432-W435 PolarHBondContact O-N 3.07Å; W435-F437 PolarHBondContact O-N 3.29Å; W435-L444 HydrophobicContact CZ2-CD1 4.27Å
436	P	69.7	Low	64.2	Low	104 Å²	104	119.3 Å²	119.3	68%	0.675	64%	0.638	S	S	*	*			trans	-91.9	9.1	-170.5	37.4	-37.3	0	0	0	114.4	W434	W434-P436 WeakPolarHBondContact O-CD 3.42Å
437	F	66.7	Low	66.6	Low	131 Å²	131	113.4 Å²	113.4	58%	0.575	62%	0.622	S	S	*	*	S	Bend	trans	-120.2	137.5	-177.6	-57.7	-69.1	0	0	0	110.8	W435 M439	W435-F437 PolarHBondContact O-N 3.29Å; F437-M439 PolarHBondContact O-N 3.45Å
438	E	66.3	Low	69.1	Low	187 Å²	187	112.6 Å²	112.6	87%	0.874	61%	0.61	S	S	*	*	S	Bend	trans	-68.8	-18.8	-177.5	-59.1	-172.6	135.2	0	0	113.5
439	M	68.3	Low	71.8	Confident	129 Å²	129	111.3 Å²	111.3	64%	0.635	59%	0.593	S	S	*	*	S	Bend	trans	-71.7	134	178.4	-65.6	-65.1	164.4	0	0	112.2	F437	F437-M439 PolarHBondContact O-N 3.45Å
440	S	75.9	Confident	74.1	Confident	61 Å²	61	114.2 Å²	114.2	43%	0.427	59%	0.587	S	S	.	*			trans	-53.7	139.1	172.5	177.4	0	0	0	0	111.2	G442 A443 L444	S440-G442 PolarHBondContact O-N 3.24Å; S440-G442 VanDerWaalsContact O-N 3.07Å; S440-A443 WeakPolarHBondContact O-CA 3.42Å; S440-A443 WeakPolarHBondContact O-CB 3.44Å; S440-A443 PolarHBondContact O-N 3.49Å; S440-L444 PolarHBondContact O-N 3.07Å
441	P	77.9	Confident	76.1	Confident	65 Å²	65	107.9 Å²	107.9	42%	0.422	56%	0.562	S	S	.	*	H	α-helix	trans	-53.4	-31.8	177.5	-29	36.1	0	0	0	113.9	L444 A445	P441-L444 PolarHBondContact O-N 2.85Å; P441-A445 PolarHBondContact O-N 2.96Å
442	G	78.3	Confident	78.3	Confident	34 Å²	34	105.8 Å²	105.8	35%	0.351	56%	0.558	S	S	.	*	H	α-helix	trans	-64.7	-40	172.9	0	0	0	0	0	113.3	S440 L444 A445 F446	S440-G442 PolarHBondContact O-N 3.24Å; S440-G442 VanDerWaalsContact O-N 3.07Å; G442-L444 VanDerWaalsContact C-N 3.35Å; G442-L444 PolarHBondContact O-N 3.48Å; G442-A445 PolarHBondContact O-N 2.99Å; G442-F446 WeakPolarHBondContact O-CD2 3.47Å; G442-F446 PolarHBondContact O-N 2.74Å
443	A	83.6	Confident	80.1	Confident	43 Å²	43	104.8 Å²	104.8	36%	0.355	55%	0.548	S	S	.	.	H	α-helix	trans	-66.1	-36.7	177.5	0	0	0	0	0	112	S440 F446 A447	S440-A443 WeakPolarHBondContact O-CA 3.42Å; S440-A443 WeakPolarHBondContact O-CB 3.44Å; S440-A443 PolarHBondContact O-N 3.49Å; A443-F446 PolarHBondContact O-N 2.79Å; A443-A447 WeakPolarHBondContact O-CB 3.37Å; A443-A447 PolarHBondContact O-N 3.3Å
444	L	86.1	Confident	81.9	Confident	62 Å²	62	100.1 Å²	100.1	33%	0.325	52%	0.517	S	S	.	.	H	α-helix	trans	-68.6	-38.4	174.1	-174.7	140.9	0	0	0	112	W435 S440 P441 G442 A447 I448	W435-L444 HydrophobicContact CZ2-CD1 4.27Å; S440-L444 PolarHBondContact O-N 3.07Å; P441-L444 PolarHBondContact O-N 2.85Å; G442-L444 VanDerWaalsContact C-N 3.35Å; G442-L444 PolarHBondContact O-N 3.48Å; L444-A447 PolarHBondContact O-N 3.47Å; L444-I448 HydrophobicContact CD2-CD1 3.68Å; L444-I448 HydrophobicContact CG-CD1 4.43Å; L444-I448 WeakPolarHBondContact O-CG1 3.45Å; L444-I448 PolarHBondContact O-N 2.95Å; L444-I448 VanDerWaalsContact O-N 3.1Å
445	A	88.4	Confident	82.7	Confident	44 Å²	44	95.3 Å²	95.3	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-61.7	-45.1	171	0	0	0	0	0	111.7	P441 G442 A447 I448 I449	P441-A445 PolarHBondContact O-N 2.96Å; G442-A445 PolarHBondContact O-N 2.99Å; A445-A447 PolarHBondContact O-N 3.43Å; A445-I448 PolarHBondContact O-N 2.88Å; A445-I449 WeakPolarHBondContact O-CB 3.25Å; A445-I449 WeakPolarHBondContact O-CD1 3.05Å; A445-I449 VanDerWaalsContact O-CG1 3.23Å; A445-I449 WeakPolarHBondContact O-CG1 3.23Å; A445-I449 PolarHBondContact O-N 3.29Å
446	F	88.7	Confident	84.1	Confident	149 Å²	149	97.4 Å²	97.4	65%	0.654	51%	0.513	S	S	*	.	H	α-helix	trans	-60	-43.5	173.9	-75	-59.8	0	0	0	112.2	G442 A443 I448 I449 W450	G442-F446 WeakPolarHBondContact O-CD2 3.47Å; G442-F446 PolarHBondContact O-N 2.74Å; A443-F446 PolarHBondContact O-N 2.79Å; F446-I448 VanDerWaalsContact C-N 3.33Å; F446-I448 PolarHBondContact O-N 3.01Å; F446-I449 PolarHBondContact O-N 2.8Å; F446-W450 VanDerWaalsContact O-CB 3.26Å; F446-W450 WeakPolarHBondContact O-CB 3.32Å; F446-W450 PolarHBondContact O-N 2.91Å
447	A	87.9	Confident	85.2	Confident	67 Å²	67	96.9 Å²	96.9	55%	0.554	50%	0.504	S	S	*	.	H	α-helix	trans	-61.1	-37.8	178.4	0	0	0	0	0	113.1	A443 L444 A445 P451	A443-A447 WeakPolarHBondContact O-CB 3.37Å; A443-A447 PolarHBondContact O-N 3.3Å; L444-A447 PolarHBondContact O-N 3.47Å; A445-A447 PolarHBondContact O-N 3.43Å; A447-P451 VanDerWaalsContact O-CD 3.3Å; A447-P451 WeakPolarHBondContact O-CD 3.49Å
448	I	90.9	Very high	86.4	Confident	106 Å²	106	94.5 Å²	94.5	54%	0.544	50%	0.5	S	S	.	.	H	α-helix	trans	-72	-35.9	176.3	-67.9	170.5	0	0	0	111.7	L444 A445 F446 P451	L444-I448 HydrophobicContact CD2-CD1 3.68Å; L444-I448 HydrophobicContact CG-CD1 4.43Å; L444-I448 WeakPolarHBondContact O-CG1 3.45Å; L444-I448 PolarHBondContact O-N 2.95Å; L444-I448 VanDerWaalsContact O-N 3.1Å; A445-I448 PolarHBondContact O-N 2.88Å; F446-I448 VanDerWaalsContact C-N 3.33Å; F446-I448 PolarHBondContact O-N 3.01Å; I448-P451 WeakPolarHBondContact O-CD 3.2Å; I448-P451 WeakPolarHBondContact O-CG 3.47Å
449	I	94.3	Very high	87.5	Confident	86 Å²	86	90.9 Å²	90.9	44%	0.441	48%	0.483	S	S	.	.	H	α-helix	trans	-83	-28.5	-177.2	-64.9	166.6	0	0	0	111.9	A445 F446 F452 I453	A445-I449 WeakPolarHBondContact O-CB 3.25Å; A445-I449 WeakPolarHBondContact O-CD1 3.05Å; A445-I449 VanDerWaalsContact O-CG1 3.23Å; A445-I449 WeakPolarHBondContact O-CG1 3.23Å; A445-I449 PolarHBondContact O-N 3.29Å; F446-I449 PolarHBondContact O-N 2.8Å; I449-F452 WeakPolarHBondContact O-CB 3.37Å; I449-F452 PolarHBondContact O-N 3.46Å; I449-I453 HydrophobicContact CG2-CD1 3.71Å; I449-I453 HydrophobicContact CG2-CG1 3.95Å; I449-I453 PolarHBondContact O-N 2.97Å; I449-I453 VanDerWaalsContact O-N 3.11Å
450	W	92.4	Very high	88.5	Confident	175 Å²	175	87.8 Å²	87.8	66%	0.663	47%	0.469	S	S	*	.	H	α-helix	trans	-48.1	-49.2	180	-173.5	-110.4	0	0	0	115.4	F446 F452 I453 A454	F446-W450 VanDerWaalsContact O-CB 3.26Å; F446-W450 WeakPolarHBondContact O-CB 3.32Å; F446-W450 PolarHBondContact O-N 2.91Å; W450-F452 VanDerWaalsContact C-N 3.26Å; W450-F452 PolarHBondContact O-N 3.46Å; W450-I453 PolarHBondContact O-N 3.29Å; W450-A454 WeakPolarHBondContact O-CB 3.32Å; W450-A454 PolarHBondContact O-N 2.9Å
451	P	92.6	Very high	89.2	Confident	59 Å²	59	91.6 Å²	91.6	38%	0.383	48%	0.475	S	S	.	.	H	α-helix	trans	-60.1	-34	178	22.3	-34.4	0	0	0	113.2	A447 I448 Q455	A447-P451 VanDerWaalsContact O-CD 3.3Å; A447-P451 WeakPolarHBondContact O-CD 3.49Å; I448-P451 WeakPolarHBondContact O-CD 3.2Å; I448-P451 WeakPolarHBondContact O-CG 3.47Å; P451-Q455 WeakPolarHBondContact O-CB 3.27Å; P451-Q455 VanDerWaalsContact O-CG 3.27Å; P451-Q455 WeakPolarHBondContact O-CG 3.28Å; P451-Q455 PolarHBondContact O-N 2.91Å
452	F	92.9	Very high	89.7	Confident	140 Å²	140	95 Å²	95	61%	0.614	48%	0.48	S	S	*	.	H	α-helix	trans	-72.6	-40.2	176.9	-62.3	-81.8	0	0	0	111.7	I449 W450 Q455 W456	I449-F452 WeakPolarHBondContact O-CB 3.37Å; I449-F452 PolarHBondContact O-N 3.46Å; W450-F452 VanDerWaalsContact C-N 3.26Å; W450-F452 PolarHBondContact O-N 3.46Å; F452-Q455 PolarHBondContact O-N 3.5Å; F452-W456 VanDerWaalsContact O-CB 3.3Å; F452-W456 WeakPolarHBondContact O-CB 3.5Å; F452-W456 PolarHBondContact O-N 2.89Å
453	I	91.3	Very high	89.7	Confident	67 Å²	67	97 Å²	97	34%	0.344	48%	0.48	S	S	.	.	H	α-helix	trans	-62.3	-45.8	173	-66.5	174.7	0	0	0	110.3	I449 W450 W456 L457	I449-I453 HydrophobicContact CG2-CD1 3.71Å; I449-I453 HydrophobicContact CG2-CG1 3.95Å; I449-I453 PolarHBondContact O-N 2.97Å; I449-I453 VanDerWaalsContact O-N 3.11Å; W450-I453 PolarHBondContact O-N 3.29Å; I453-W456 PolarHBondContact O-N 2.99Å; I453-L457 HydrophobicContact CG2-CD1 3.88Å; I453-L457 HydrophobicContact CG2-CG 4.29Å; I453-L457 WeakPolarHBondContact O-CB 3.33Å; I453-L457 WeakPolarHBondContact O-CG 3.43Å; I453-L457 PolarHBondContact O-N 2.94Å
454	A	92.5	Very high	89.4	Confident	40 Å²	40	104.5 Å²	104.5	33%	0.331	50%	0.499	S	S	.	.	H	α-helix	trans	-60.9	-46.2	178.1	0	0	0	0	0	112	W450 W456 L457 V458	W450-A454 WeakPolarHBondContact O-CB 3.32Å; W450-A454 PolarHBondContact O-N 2.9Å; A454-W456 VanDerWaalsContact C-N 3.35Å; A454-W456 PolarHBondContact O-N 3.46Å; A454-L457 PolarHBondContact O-N 3.1Å; A454-V458 WeakPolarHBondContact O-CG2 3.45Å; A454-V458 PolarHBondContact O-N 3.22Å
455	Q	88.9	Confident	89	Confident	134 Å²	134	108.9 Å²	108.9	63%	0.626	51%	0.512	S	S	*	.	H	α-helix	trans	-62	-40.1	174.8	-74.8	177.7	4.3	0	0	112.3	P451 F452 V458 H459	P451-Q455 WeakPolarHBondContact O-CB 3.27Å; P451-Q455 VanDerWaalsContact O-CG 3.27Å; P451-Q455 WeakPolarHBondContact O-CG 3.28Å; P451-Q455 PolarHBondContact O-N 2.91Å; F452-Q455 PolarHBondContact O-N 3.5Å; Q455-V458 PolarHBondContact O-N 3.37Å; Q455-H459 WeakPolarHBondContact O-CB 3.45Å; Q455-H459 PolarHBondContact O-N 3.16Å
456	W	92.8	Very high	88	Confident	162 Å²	162	116.3 Å²	116.3	61%	0.614	53%	0.53	S	S	*	.	H	α-helix	trans	-66.7	-40.7	176.8	-176.8	76.2	0	0	0	112.6	F452 I453 A454 H459 L460	F452-W456 VanDerWaalsContact O-CB 3.3Å; F452-W456 WeakPolarHBondContact O-CB 3.5Å; F452-W456 PolarHBondContact O-N 2.89Å; I453-W456 PolarHBondContact O-N 2.99Å; A454-W456 VanDerWaalsContact C-N 3.35Å; A454-W456 PolarHBondContact O-N 3.46Å; W456-H459 PolarHBondContact O-N 3.03Å; W456-L460 HydrophobicContact CD2-CD1 3.83Å; W456-L460 HydrophobicContact CD2-CG 4.49Å; W456-L460 HydrophobicContact CE3-CD1 3.75Å; W456-L460 HydrophobicContact CH2-CD1 3.59Å; W456-L460 HydrophobicContact CZ2-CD1 3.65Å; W456-L460 HydrophobicContact CZ3-CD1 3.63Å; W456-L460 WeakPolarHBondContact O-CB 3.44Å; W456-L460 PolarHBondContact O-N 3.01Å
457	L	92.9	Very high	86.8	Confident	94 Å²	94	117.8 Å²	117.8	49%	0.492	53%	0.531	S	S	.	.	H	α-helix	trans	-64.7	-42.1	174.2	-72.5	172.8	0	0	0	112	I453 A454 H459 L460 Y461	I453-L457 HydrophobicContact CG2-CD1 3.88Å; I453-L457 HydrophobicContact CG2-CG 4.29Å; I453-L457 WeakPolarHBondContact O-CB 3.33Å; I453-L457 WeakPolarHBondContact O-CG 3.43Å; I453-L457 PolarHBondContact O-N 2.94Å; A454-L457 PolarHBondContact O-N 3.1Å; L457-H459 VanDerWaalsContact C-N 3.34Å; L457-L460 PolarHBondContact O-N 3.34Å; L457-Y461 WeakPolarHBondContact O-CB 3.31Å; L457-Y461 PolarHBondContact O-N 2.95Å
458	V	92.3	Very high	85.6	Confident	80 Å²	80	123 Å²	123	49%	0.485	54%	0.541	S	S	.	.	H	α-helix	trans	-62.4	-42	172.7	170.1	0	0	0	0	110.8	A454 Q455 Y461 Y462	A454-V458 WeakPolarHBondContact O-CG2 3.45Å; A454-V458 PolarHBondContact O-N 3.22Å; Q455-V458 PolarHBondContact O-N 3.37Å; V458-Y461 WeakPolarHBondContact O-CB 3.46Å; V458-Y461 PolarHBondContact O-N 3.29Å; V458-Y462 HydrophobicContact CG1-CD2 3.82Å; V458-Y462 HydrophobicContact CG1-CE2 3.8Å; V458-Y462 VanDerWaalsContact O-CD2 3.3Å; V458-Y462 WeakPolarHBondContact O-CD2 3.3Å; V458-Y462 PolarHBondContact O-N 2.79Å
459	H	89.3	Confident	83.9	Confident	111 Å²	111	124.9 Å²	124.9	51%	0.514	55%	0.552	S	S	.	*	H	α-helix	trans	-63.9	-42.4	176.3	-164.8	108.5	0	0	0	111.8	Q455 W456 L457 Y462 Q463	Q455-H459 WeakPolarHBondContact O-CB 3.45Å; Q455-H459 PolarHBondContact O-N 3.16Å; W456-H459 PolarHBondContact O-N 3.03Å; L457-H459 VanDerWaalsContact C-N 3.34Å; H459-Y462 PolarHBondContact O-N 3.36Å; H459-Q463 PolarHBondContact CD2-NE2 3.27Å; H459-Q463 PolarHBondContact NE2-NE2 3.28Å; H459-Q463 WeakPolarHBondContact O-CG 3.23Å; H459-Q463 PolarHBondContact O-N 2.76Å
460	L	89.7	Confident	81.6	Confident	65 Å²	65	131 Å²	131	34%	0.34	59%	0.585	S	S	.	*	H	α-helix	trans	-62.2	-41.2	173.1	-84.8	172.4	0	0	0	112.5	W456 L457 Q463 R464	W456-L460 HydrophobicContact CD2-CD1 3.83Å; W456-L460 HydrophobicContact CD2-CG 4.49Å; W456-L460 HydrophobicContact CE3-CD1 3.75Å; W456-L460 HydrophobicContact CH2-CD1 3.59Å; W456-L460 HydrophobicContact CZ2-CD1 3.65Å; W456-L460 HydrophobicContact CZ3-CD1 3.63Å; W456-L460 WeakPolarHBondContact O-CB 3.44Å; W456-L460 PolarHBondContact O-N 3.01Å; L457-L460 PolarHBondContact O-N 3.34Å; L460-Q463 PolarHBondContact O-N 3.03Å; L460-R464 VanDerWaalsContact O-CB 3.3Å; L460-R464 WeakPolarHBondContact O-CB 3.48Å; L460-R464 PolarHBondContact O-N 2.75Å
461	Y	90.1	Very high	81	Confident	141 Å²	141	128.8 Å²	128.8	55%	0.553	58%	0.581	S	S	*	*	H	α-helix	trans	-59.4	-48	174.9	174.8	-91.2	0	0	0	111	L457 V458 R464 R465	L457-Y461 WeakPolarHBondContact O-CB 3.31Å; L457-Y461 PolarHBondContact O-N 2.95Å; V458-Y461 WeakPolarHBondContact O-CB 3.46Å; V458-Y461 PolarHBondContact O-N 3.29Å; Y461-R464 PolarHBondContact O-N 3.22Å; Y461-R465 WeakPolarHBondContact O-CB 3.27Å; Y461-R465 PolarHBondContact O-N 3.29Å
462	Y	87.4	Confident	80.4	Confident	135 Å²	135	132.4 Å²	132.4	53%	0.529	59%	0.592	S	S	.	*	H	α-helix	trans	-65.1	-39.8	175.9	-83.2	-68.7	0	0	0	113.1	V458 H459 R465 R466	V458-Y462 HydrophobicContact CG1-CD2 3.82Å; V458-Y462 HydrophobicContact CG1-CE2 3.8Å; V458-Y462 VanDerWaalsContact O-CD2 3.3Å; V458-Y462 WeakPolarHBondContact O-CD2 3.3Å; V458-Y462 PolarHBondContact O-N 2.79Å; H459-Y462 PolarHBondContact O-N 3.36Å; Y462-R465 PolarHBondContact O-N 2.86Å; Y462-R466 WeakPolarHBondContact O-CG 3.45Å; Y462-R466 PolarHBondContact O-N 3.3Å
463	Q	78.1	Confident	79.7	Confident	76 Å²	76	132 Å²	132	36%	0.355	59%	0.591	S	S	.	*	H	α-helix	trans	-61.5	-45.6	172.5	-76.4	-166.7	19.3	0	0	111.9	H459 L460 R465 R466 R467	H459-Q463 PolarHBondContact CD2-NE2 3.27Å; H459-Q463 PolarHBondContact NE2-NE2 3.28Å; H459-Q463 WeakPolarHBondContact O-CG 3.23Å; H459-Q463 PolarHBondContact O-N 2.76Å; L460-Q463 PolarHBondContact O-N 3.03Å; Q463-R465 VanDerWaalsContact C-N 3.27Å; Q463-R465 PolarHBondContact O-N 2.76Å; Q463-R466 PolarHBondContact O-N 3.44Å; Q463-R466 VanDerWaalsContact O-N 3.17Å; Q463-R467 WeakPolarHBondContact O-CG 3.47Å; Q463-R467 PolarHBondContact O-N 3.44Å; Q463-R467 VanDerWaalsContact O-N 3.12Å; Q463-R467 VanDerWaalsContact OE1-NH2 3.16Å
464	R	78.4	Confident	79.1	Confident	201 Å²	201	135.8 Å²	135.8	76%	0.758	61%	0.605	S	S	*	*	H	α-helix	trans	-65.4	-31	179.6	-165.4	174.5	-172.4	179.6	1.6	112	L460 Y461	L460-R464 VanDerWaalsContact O-CB 3.3Å; L460-R464 WeakPolarHBondContact O-CB 3.48Å; L460-R464 PolarHBondContact O-N 2.75Å; Y461-R464 PolarHBondContact O-N 3.22Å
465	R	76.6	Confident	78.2	Confident	155 Å²	155	141.8 Å²	141.8	59%	0.585	62%	0.622	S	S	*	*	H	α-helix	trans	-72.6	-35	172.4	-167.8	170.5	-179.7	169.3	-1.8	112.8	Y461 Y462 Q463 K468	Y461-R465 WeakPolarHBondContact O-CB 3.27Å; Y461-R465 PolarHBondContact O-N 3.29Å; Y462-R465 PolarHBondContact O-N 2.86Å; Q463-R465 VanDerWaalsContact C-N 3.27Å; Q463-R465 PolarHBondContact O-N 2.76Å; R465-K468 PolarHBondContact O-N 3.17Å
466	R	67.8	Low	77.5	Confident	199 Å²	199	142.3 Å²	142.3	75%	0.751	62%	0.622	S	S	*	*	H	α-helix	trans	-69.4	-31.1	174.7	-74	-176.1	-179.6	-160.8	0.4	113.2	Y462 Q463 K468 L469	Y462-R466 WeakPolarHBondContact O-CG 3.45Å; Y462-R466 PolarHBondContact O-N 3.3Å; Q463-R466 PolarHBondContact O-N 3.44Å; Q463-R466 VanDerWaalsContact O-N 3.17Å; R466-K468 PolarHBondContact O-N 3.37Å; R466-L469 PolarHBondContact O-N 3.38Å
467	R	64.9	Low	76.4	Confident	180 Å²	180	140.9 Å²	140.9	68%	0.679	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	22.2	173.6	-59.6	179.6	-153	178.5	6.8	114.5	Q463	Q463-R467 WeakPolarHBondContact O-CG 3.47Å; Q463-R467 PolarHBondContact O-N 3.44Å; Q463-R467 VanDerWaalsContact O-N 3.12Å; Q463-R467 VanDerWaalsContact OE1-NH2 3.16Å
468	K	61.5	Low	75.2	Confident	176 Å²	176	144.5 Å²	144.5	77%	0.765	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.8	14.1	174.5	-69.2	-165.3	172.6	-165.6	0	112.9	R465 R466	R465-K468 PolarHBondContact O-N 3.17Å; R466-K468 PolarHBondContact O-N 3.37Å
469	L	55.6	Low	73.7	Confident	147 Å²	147	149.9 Å²	149.9	77%	0.77	65%	0.645	S	S	*	*			trans	-129.4	1.4	-176.4	-86.5	161.5	0	0	0	113.5	R466	R466-L469 PolarHBondContact O-N 3.38Å
470	N	45.4	Very low	72.3	Confident	213 Å²	213	153.5 Å²	153.5	100%	1.139	66%	0.657	S	S	*	*			trans	-127.1	0	165.8	-66.1	30	0	0	0	107.3

Retrieved 470 of 470 residues in 135.3 ms (Link to these results)

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