A0A087WPJ3_MOUSE Loading...

Protein tyrosine phosphatase, receptor type, f polypeptide (PTPRF),-interacting protein (liprin), alpha 4

AlphaFold DB , UniProt , Accession A0A087WPJ3, Species MOUSE (Mus musculus, Mouse), Gene Ppfia4, Length 892 aa.

						>A0A087WPJ3_MOUSE|A0A087WPJ3|Ppfia4
LREALAQKEDMEERITTLEKRYLAAQREATSIHDLNDKLENELANKESLHRQCEEKARHLQELLEVAEQKLQQTMRKAETLPEVEAELSQRIAALTKAEERHGNIEEHLRQLEGQLEEKNQELARVRQREKMNEDHNKRLSDTVDRLLSESNERLQLHLKERMAALEEKGRLSEEIEKLRQEVDQLKGRGGPFVDGIHSRSHVGSAADVRFSLSTATHAPPGLHRRYSALRDESAKDWKPSPLPGVLGATTPAFDSDPEISDVDEDEPGGLVGTQVDVISPGGHSDAQTLAMMLQEQLDAINQEIRMIQEEKESTELRAEEIETRVTSGSMEALNLTQLRKRGSIPTSLTALSLASASPPLSGRSTPKLTSRSAAQDLDRMGVMTLPSDLRKHRRKLLSPVSREENREDKATIKCETSPPSSPRTLRLEKLGHPGLSQEEGKSALEGQDSNPSSSNSSQDSLHKGAKRKGIKSSIGRLFGKKEKGRLIQLSRDATGHVLLTDSELSLQEPMVPAKLGTQAEKDRRLKKKHQLLEDARRKGMPFAQWDGPTVVSWLELWVGMPAWYVAACRANVKSGAIMSALSDTEIQREIGISNALHRLKLRLAIQEMVSLTSPSAPPTSRTSSGNVWVTHEEMETLATSTKTTLAYGDMNHEWIGNEWLPSLGLPQYRSYFMECLVDARMLDHLTKKDLRVHLKMVDSFHRTSLQYGIMCLKRLNYDRKELEKRREESQHEIKDVLVWTNDQVVHWVQSIGLRDYAGNLHESGVHGALLALDENFDHNTLALVLQIPTQSTQARQVMEREFNNLLALGTDRKLDDGEEKVFRRAPSWRKRFRPRDHHSGGMLGTSAETLPAGFRVSTLGPLQPPPAPPKKIMPEAHSHYLYGHMLSAFRD
					

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	L	74.1	Confident	85.2	Confident	174 Å²	174	116.9 Å²	116.9	91%	0.911	58%	0.582	S	S	*	*				0	-72.2	0	-131.3	163.8	0	0	0	111.6	E3 A4 L5	L1-E3 VanDerWaalsContact C-N 3.35Å; L1-E3 PolarHBondContact O-N 3.47Å; L1-A4 PolarHBondContact O-N 2.75Å; L1-A4 VanDerWaalsContact O-N 3.14Å; L1-L5 HydrophobicContact CD2-CD1 4.21Å; L1-L5 PolarHBondContact O-N 3.49Å; L1-L5 VanDerWaalsContact O-N 3.11Å
2	R	81.5	Confident	85.7	Confident	231 Å²	231	114.8 Å²	114.8	87%	0.872	57%	0.569	S	S	*	*	H	α-helix	trans	-53	-47.5	175.1	-72.6	-174.7	-178.2	167.4	0.8	113.5	A4 L5 A6	R2-A4 VanDerWaalsContact C-N 3.34Å; R2-A4 PolarHBondContact O-N 2.81Å; R2-L5 WeakPolarHBondContact O-CB 3.39Å; R2-L5 PolarHBondContact O-N 3.31Å; R2-L5 VanDerWaalsContact O-N 3.1Å; R2-A6 PolarHBondContact O-N 3.39Å
3	E	83.1	Confident	86.2	Confident	142 Å²	142	116.1 Å²	116.1	66%	0.664	57%	0.573	S	S	*	*	H	α-helix	trans	-57.5	-42.1	176.7	-176.6	179.4	-169.9	0	0	113.4	L1 L5 A6 Q7	L1-E3 VanDerWaalsContact C-N 3.35Å; L1-E3 PolarHBondContact O-N 3.47Å; E3-L5 VanDerWaalsContact C-N 3.3Å; E3-L5 PolarHBondContact O-N 2.97Å; E3-A6 PolarHBondContact O-N 3.27Å; E3-Q7 WeakPolarHBondContact O-CG 3.4Å; E3-Q7 PolarHBondContact O-N 3.42Å
4	A	82.5	Confident	86.7	Confident	57 Å²	57	118.8 Å²	118.8	47%	0.471	57%	0.574	S	S	.	*	H	α-helix	trans	-69.6	-25.9	177.2	0	0	0	0	0	113	L1 R2 K8	L1-A4 PolarHBondContact O-N 2.75Å; L1-A4 VanDerWaalsContact O-N 3.14Å; R2-A4 VanDerWaalsContact C-N 3.34Å; R2-A4 PolarHBondContact O-N 2.81Å; A4-K8 WeakPolarHBondContact O-CB 3.33Å; A4-K8 PolarHBondContact O-N 3.49Å; A4-K8 VanDerWaalsContact O-N 3.16Å
5	L	83.5	Confident	87.1	Confident	102 Å²	102	116.1 Å²	116.1	53%	0.534	56%	0.562	S	S	.	*	H	α-helix	trans	-72.6	-44.8	170.6	-67.6	169.8	0	0	0	110.6	L1 R2 E3 Q7 K8 E9	L1-L5 HydrophobicContact CD2-CD1 4.21Å; L1-L5 PolarHBondContact O-N 3.49Å; L1-L5 VanDerWaalsContact O-N 3.11Å; R2-L5 WeakPolarHBondContact O-CB 3.39Å; R2-L5 PolarHBondContact O-N 3.31Å; R2-L5 VanDerWaalsContact O-N 3.1Å; E3-L5 VanDerWaalsContact C-N 3.3Å; E3-L5 PolarHBondContact O-N 2.97Å; L5-Q7 VanDerWaalsContact C-N 3.35Å; L5-Q7 PolarHBondContact O-N 3.05Å; L5-K8 WeakPolarHBondContact O-CB 3.42Å; L5-K8 PolarHBondContact O-N 3.02Å; L5-K8 VanDerWaalsContact O-N 3.14Å; L5-E9 WeakPolarHBondContact O-CB 3.44Å; L5-E9 PolarHBondContact O-N 3.08Å
6	A	84.4	Confident	87.5	Confident	55 Å²	55	112.3 Å²	112.3	46%	0.455	55%	0.548	S	S	.	.	H	α-helix	trans	-63.5	-37.6	176	0	0	0	0	0	112.8	R2 E3 K8 E9 D10	R2-A6 PolarHBondContact O-N 3.39Å; E3-A6 PolarHBondContact O-N 3.27Å; A6-K8 VanDerWaalsContact C-N 3.35Å; A6-E9 PolarHBondContact O-N 3.13Å; A6-D10 PolarHBondContact O-N 3.3Å
7	Q	87.4	Confident	87.9	Confident	120 Å²	120	109.2 Å²	109.2	56%	0.561	54%	0.538	S	S	*	.	H	α-helix	trans	-66.3	-34.7	172.7	-73.4	172.6	-2.1	0	0	112.6	E3 L5 M11	E3-Q7 WeakPolarHBondContact O-CG 3.4Å; E3-Q7 PolarHBondContact O-N 3.42Å; L5-Q7 VanDerWaalsContact C-N 3.35Å; L5-Q7 PolarHBondContact O-N 3.05Å; Q7-M11 WeakPolarHBondContact O-CB 3.46Å; Q7-M11 PolarHBondContact O-N 3.45Å
8	K	89.1	Confident	88.3	Confident	97 Å²	97	109.6 Å²	109.6	42%	0.422	54%	0.542	S	S	.	.	H	α-helix	trans	-67.3	-40.8	172.1	-179.8	-179	177.2	-79.5	0	111.1	A4 L5 A6 M11 E12	A4-K8 WeakPolarHBondContact O-CB 3.33Å; A4-K8 PolarHBondContact O-N 3.49Å; A4-K8 VanDerWaalsContact O-N 3.16Å; L5-K8 WeakPolarHBondContact O-CB 3.42Å; L5-K8 PolarHBondContact O-N 3.02Å; L5-K8 VanDerWaalsContact O-N 3.14Å; A6-K8 VanDerWaalsContact C-N 3.35Å; K8-M11 PolarHBondContact O-N 3.01Å; K8-E12 VanDerWaalsContact CE-OE1 3.32Å; K8-E12 WeakPolarHBondContact CE-OE1 3.48Å; K8-E12 IonicContact NZ-OE1 2.64Å; K8-E12 PolarHBondContact NZ-OE1 2.83Å; K8-E12 IonicContact NZ-OE2 2.7Å; K8-E12 PolarHBondContact NZ-OE2 3.48Å; K8-E12 WeakPolarHBondContact O-CG 3.36Å; K8-E12 PolarHBondContact O-N 3.38Å
9	E	89.5	Confident	88.6	Confident	127 Å²	127	109.3 Å²	109.3	59%	0.593	54%	0.538	S	S	*	.	H	α-helix	trans	-65.1	-47.5	179.5	-163	163.4	-153.7	0	0	111.6	L5 A6 M11 E12 E13	L5-E9 WeakPolarHBondContact O-CB 3.44Å; L5-E9 PolarHBondContact O-N 3.08Å; A6-E9 PolarHBondContact O-N 3.13Å; E9-M11 VanDerWaalsContact C-N 3.29Å; E9-M11 PolarHBondContact O-N 3.32Å; E9-E12 PolarHBondContact O-N 3.38Å; E9-E12 VanDerWaalsContact O-N 3.16Å; E9-E13 PolarHBondContact O-N 3.1Å
10	D	91.9	Very high	88.8	Confident	77 Å²	77	110.9 Å²	110.9	41%	0.412	54%	0.542	S	S	.	.	H	α-helix	trans	-54.9	-44	170.1	172.1	79.2	0	0	0	111.9	A6 E13 R14	A6-D10 PolarHBondContact O-N 3.3Å; D10-E13 PolarHBondContact O-N 3.45Å; D10-R14 VanDerWaalsContact CG-CD 3.48Å; D10-R14 VanDerWaalsContact O-CB 3.31Å; D10-R14 WeakPolarHBondContact O-CB 3.29Å; D10-R14 WeakPolarHBondContact O-CD 3.5Å; D10-R14 WeakPolarHBondContact O-CG 3.38Å; D10-R14 PolarHBondContact O-N 2.93Å; D10-R14 WeakPolarHBondContact OD1-CD 3.43Å; D10-R14 WeakPolarHBondContact OD2-CD 3.36Å; D10-R14 IonicContact OD2-CZ 3.77Å; D10-R14 IonicContact OD2-NE 3.88Å; D10-R14 IonicContact OD2-NH1 2.84Å; D10-R14 PolarHBondContact OD2-NH1 3.42Å
11	M	90.6	Very high	89.1	Confident	104 Å²	104	113.9 Å²	113.9	51%	0.512	55%	0.548	S	S	.	.	H	α-helix	trans	-65.4	-39.5	178.8	-175.4	173.7	68.9	0	0	112	Q7 K8 E9 R14 I15	Q7-M11 WeakPolarHBondContact O-CB 3.46Å; Q7-M11 PolarHBondContact O-N 3.45Å; K8-M11 PolarHBondContact O-N 3.01Å; E9-M11 VanDerWaalsContact C-N 3.29Å; E9-M11 PolarHBondContact O-N 3.32Å; M11-R14 PolarHBondContact O-N 3.36Å; M11-I15 HydrophobicContact CG-CD1 3.97Å; M11-I15 WeakPolarHBondContact O-CB 3.32Å; M11-I15 WeakPolarHBondContact O-CD1 3.24Å; M11-I15 WeakPolarHBondContact O-CG1 3.39Å; M11-I15 PolarHBondContact O-N 3.05Å
12	E	91.3	Very high	90.1	Very high	91 Å²	91	113.1 Å²	113.1	43%	0.425	53%	0.534	S	S	.	.	H	α-helix	trans	-70.9	-37.6	176.3	-73.6	175.4	148.1	0	0	112.2	K8 E9 I15 T16	K8-E12 VanDerWaalsContact CE-OE1 3.32Å; K8-E12 WeakPolarHBondContact CE-OE1 3.48Å; K8-E12 IonicContact NZ-OE1 2.64Å; K8-E12 PolarHBondContact NZ-OE1 2.83Å; K8-E12 IonicContact NZ-OE2 2.7Å; K8-E12 PolarHBondContact NZ-OE2 3.48Å; K8-E12 WeakPolarHBondContact O-CG 3.36Å; K8-E12 PolarHBondContact O-N 3.38Å; E9-E12 PolarHBondContact O-N 3.38Å; E9-E12 VanDerWaalsContact O-N 3.16Å; E12-I15 PolarHBondContact O-N 3.25Å; E12-T16 WeakPolarHBondContact O-CG2 3.2Å; E12-T16 PolarHBondContact O-N 3.01Å; E12-T16 PolarHBondContact O-OG1 3.36Å; E12-T16 VanDerWaalsContact O-OG1 3.05Å
13	E	91.9	Very high	90.8	Very high	132 Å²	132	106 Å²	106	62%	0.617	51%	0.513	S	S	*	.	H	α-helix	trans	-64	-39.3	170.9	-72.1	-159	150.1	0	0	112.3	E9 D10 T16 T17	E9-E13 PolarHBondContact O-N 3.1Å; D10-E13 PolarHBondContact O-N 3.45Å; E13-T16 PolarHBondContact O-OG1 2.66Å; E13-T17 VanDerWaalsContact O-CB 3.26Å; E13-T17 WeakPolarHBondContact O-CB 3.38Å; E13-T17 PolarHBondContact O-N 2.78Å; E13-T17 PolarHBondContact O-OG1 2.96Å
14	R	93.4	Very high	91.3	Very high	154 Å²	154	101.2 Å²	101.2	58%	0.581	50%	0.497	S	S	*	.	H	α-helix	trans	-71.2	-39.2	177.4	-72.6	164.8	65.1	-170.3	-0.4	112.3	D10 M11 T17 L18	D10-R14 VanDerWaalsContact CG-CD 3.48Å; D10-R14 VanDerWaalsContact O-CB 3.31Å; D10-R14 WeakPolarHBondContact O-CB 3.29Å; D10-R14 WeakPolarHBondContact O-CD 3.5Å; D10-R14 WeakPolarHBondContact O-CG 3.38Å; D10-R14 PolarHBondContact O-N 2.93Å; D10-R14 WeakPolarHBondContact OD1-CD 3.43Å; D10-R14 WeakPolarHBondContact OD2-CD 3.36Å; D10-R14 IonicContact OD2-CZ 3.77Å; D10-R14 IonicContact OD2-NE 3.88Å; D10-R14 IonicContact OD2-NH1 2.84Å; D10-R14 PolarHBondContact OD2-NH1 3.42Å; M11-R14 PolarHBondContact O-N 3.36Å; R14-T17 PolarHBondContact O-N 2.98Å; R14-L18 WeakPolarHBondContact O-CG 3.43Å; R14-L18 PolarHBondContact O-N 3.46Å
15	I	92.8	Very high	91.8	Very high	79 Å²	79	101 Å²	101	41%	0.405	50%	0.496	S	S	.	.	H	α-helix	trans	-60.7	-54.5	171.9	-73.1	164	0	0	0	109.7	M11 E12 T17 L18 E19	M11-I15 HydrophobicContact CG-CD1 3.97Å; M11-I15 WeakPolarHBondContact O-CB 3.32Å; M11-I15 WeakPolarHBondContact O-CD1 3.24Å; M11-I15 WeakPolarHBondContact O-CG1 3.39Å; M11-I15 PolarHBondContact O-N 3.05Å; E12-I15 PolarHBondContact O-N 3.25Å; I15-T17 PolarHBondContact O-N 2.86Å; I15-L18 CarbonylContact O-C 3.58Å; I15-L18 WeakPolarHBondContact O-CA 3.39Å; I15-L18 WeakPolarHBondContact O-CB 3.39Å; I15-L18 PolarHBondContact O-N 3.06Å; I15-E19 HydrophobicContact CG2-CG 4.25Å; I15-E19 WeakPolarHBondContact O-CG 3.38Å; I15-E19 PolarHBondContact O-N 3.3Å
16	T	93.1	Very high	92.4	Very high	54 Å²	54	100.7 Å²	100.7	33%	0.331	49%	0.491	S	S	.	.	H	α-helix	trans	-64.1	-26.4	-179.3	59.1	0	0	0	0	113.2	E12 E13 E19 K20	E12-T16 WeakPolarHBondContact O-CG2 3.2Å; E12-T16 PolarHBondContact O-N 3.01Å; E12-T16 PolarHBondContact O-OG1 3.36Å; E12-T16 VanDerWaalsContact O-OG1 3.05Å; E13-T16 PolarHBondContact O-OG1 2.66Å; T16-E19 WeakPolarHBondContact CA-OE2 3.48Å; T16-K20 WeakPolarHBondContact O-CB 3.41Å; T16-K20 VanDerWaalsContact O-CD 3.27Å; T16-K20 WeakPolarHBondContact O-CD 3.34Å; T16-K20 WeakPolarHBondContact O-CG 3.43Å; T16-K20 PolarHBondContact O-N 3.01Å
17	T	94.1	Very high	92.9	Very high	61 Å²	61	106.8 Å²	106.8	37%	0.374	50%	0.503	S	S	.	.	H	α-helix	trans	-71.4	-40.1	171.1	-62.7	0	0	0	0	112.2	E13 R14 I15 R21	E13-T17 VanDerWaalsContact O-CB 3.26Å; E13-T17 WeakPolarHBondContact O-CB 3.38Å; E13-T17 PolarHBondContact O-N 2.78Å; E13-T17 PolarHBondContact O-OG1 2.96Å; R14-T17 PolarHBondContact O-N 2.98Å; I15-T17 PolarHBondContact O-N 2.86Å; T17-R21 WeakPolarHBondContact O-CG 3.22Å; T17-R21 PolarHBondContact O-N 2.96Å; T17-R21 VanDerWaalsContact O-N 3.12Å
18	L	94.6	Very high	93.2	Very high	116 Å²	116	107.1 Å²	107.1	61%	0.607	50%	0.504	S	S	*	.	H	α-helix	trans	-67.6	-41.5	173.8	-72.9	168.8	0	0	0	111.7	R14 I15 R21 Y22	R14-L18 WeakPolarHBondContact O-CG 3.43Å; R14-L18 PolarHBondContact O-N 3.46Å; I15-L18 CarbonylContact O-C 3.58Å; I15-L18 WeakPolarHBondContact O-CA 3.39Å; I15-L18 WeakPolarHBondContact O-CB 3.39Å; I15-L18 PolarHBondContact O-N 3.06Å; L18-R21 PolarHBondContact O-N 3.05Å; L18-Y22 WeakPolarHBondContact O-CB 3.28Å; L18-Y22 PolarHBondContact O-N 2.97Å
19	E	93.8	Very high	93.5	Very high	103 Å²	103	105.2 Å²	105.2	48%	0.481	51%	0.507	S	S	.	.	H	α-helix	trans	-59.6	-45.6	174.2	-70.2	172.8	158.3	0	0	111.8	I15 T16 R21 Y22 L23	I15-E19 HydrophobicContact CG2-CG 4.25Å; I15-E19 WeakPolarHBondContact O-CG 3.38Å; I15-E19 PolarHBondContact O-N 3.3Å; T16-E19 WeakPolarHBondContact CA-OE2 3.48Å; E19-R21 VanDerWaalsContact C-N 3.33Å; E19-R21 PolarHBondContact O-N 3.1Å; E19-Y22 PolarHBondContact O-N 3.39Å; E19-L23 WeakPolarHBondContact O-CB 3.42Å; E19-L23 VanDerWaalsContact O-CG 3.32Å; E19-L23 WeakPolarHBondContact O-CG 3.5Å; E19-L23 PolarHBondContact O-N 2.86Å
20	K	94.1	Very high	93.7	Very high	141 Å²	141	102.7 Å²	102.7	61%	0.613	50%	0.5	S	S	*	.	H	α-helix	trans	-59.7	-41.3	174.8	-74.4	162.3	-169.8	160.4	0	112.1	T16 A24	T16-K20 WeakPolarHBondContact O-CB 3.41Å; T16-K20 VanDerWaalsContact O-CD 3.27Å; T16-K20 WeakPolarHBondContact O-CD 3.34Å; T16-K20 WeakPolarHBondContact O-CG 3.43Å; T16-K20 PolarHBondContact O-N 3.01Å; K20-A24 WeakPolarHBondContact O-CB 3.48Å; K20-A24 PolarHBondContact O-N 3.28Å
21	R	94.8	Very high	93.9	Very high	174 Å²	174	102.7 Å²	102.7	66%	0.657	51%	0.506	S	S	*	.	H	α-helix	trans	-68.9	-41	176.3	-72	177.4	-174.7	-164.7	2.6	112.3	T17 L18 E19 A24 A25	T17-R21 WeakPolarHBondContact O-CG 3.22Å; T17-R21 PolarHBondContact O-N 2.96Å; T17-R21 VanDerWaalsContact O-N 3.12Å; L18-R21 PolarHBondContact O-N 3.05Å; E19-R21 VanDerWaalsContact C-N 3.33Å; E19-R21 PolarHBondContact O-N 3.1Å; R21-A24 PolarHBondContact O-N 3.36Å; R21-A25 WeakPolarHBondContact O-CB 3.13Å; R21-A25 PolarHBondContact O-N 3.35Å
22	Y	94.9	Very high	94.1	Very high	158 Å²	158	103.2 Å²	103.2	62%	0.62	51%	0.51	S	S	*	.	H	α-helix	trans	-62.6	-46.5	175.9	179.1	-92.4	0	0	0	111.2	L18 E19 A24 A25 Q26	L18-Y22 WeakPolarHBondContact O-CB 3.28Å; L18-Y22 PolarHBondContact O-N 2.97Å; E19-Y22 PolarHBondContact O-N 3.39Å; Y22-A24 VanDerWaalsContact C-N 3.32Å; Y22-A24 PolarHBondContact O-N 2.94Å; Y22-A25 PolarHBondContact O-N 3.05Å; Y22-Q26 VanDerWaalsContact O-CB 3.27Å; Y22-Q26 WeakPolarHBondContact O-CB 3.47Å; Y22-Q26 PolarHBondContact O-N 3.28Å
23	L	94.9	Very high	94.3	Very high	83 Å²	83	104.2 Å²	104.2	44%	0.435	51%	0.514	S	S	.	.	H	α-helix	trans	-65.4	-32.5	176.1	-71.9	168.7	0	0	0	112.9	E19 R27	E19-L23 WeakPolarHBondContact O-CB 3.42Å; E19-L23 VanDerWaalsContact O-CG 3.32Å; E19-L23 WeakPolarHBondContact O-CG 3.5Å; E19-L23 PolarHBondContact O-N 2.86Å; L23-R27 WeakPolarHBondContact O-CD 3.29Å; L23-R27 VanDerWaalsContact O-CG 3.22Å; L23-R27 WeakPolarHBondContact O-CG 3.18Å; L23-R27 PolarHBondContact O-N 2.85Å
24	A	93.6	Very high	94.4	Very high	41 Å²	41	101.8 Å²	101.8	34%	0.339	51%	0.506	S	S	.	.	H	α-helix	trans	-66.9	-53.5	171.8	0	0	0	0	0	111.1	K20 R21 Y22 Q26 R27 E28	K20-A24 WeakPolarHBondContact O-CB 3.48Å; K20-A24 PolarHBondContact O-N 3.28Å; R21-A24 PolarHBondContact O-N 3.36Å; Y22-A24 VanDerWaalsContact C-N 3.32Å; Y22-A24 PolarHBondContact O-N 2.94Å; A24-Q26 VanDerWaalsContact C-N 3.27Å; A24-Q26 PolarHBondContact O-N 2.89Å; A24-R27 WeakPolarHBondContact O-CB 3.36Å; A24-R27 PolarHBondContact O-N 3.27Å; A24-R27 VanDerWaalsContact O-N 3.08Å; A24-E28 WeakPolarHBondContact O-CG 3.37Å; A24-E28 PolarHBondContact O-N 3.34Å
25	A	94.3	Very high	94.5	Very high	53 Å²	53	99.2 Å²	99.2	44%	0.438	50%	0.503	S	S	.	.	H	α-helix	trans	-60.3	-35	178.1	0	0	0	0	0	112.7	R21 Y22 E28 A29	R21-A25 WeakPolarHBondContact O-CB 3.13Å; R21-A25 PolarHBondContact O-N 3.35Å; Y22-A25 PolarHBondContact O-N 3.05Å; A25-E28 PolarHBondContact O-N 3.16Å; A25-A29 VanDerWaalsContact O-CB 3.32Å; A25-A29 WeakPolarHBondContact O-CB 3.41Å; A25-A29 PolarHBondContact O-N 3.12Å
26	Q	95.1	Very high	94.6	Very high	94 Å²	94	98.9 Å²	98.9	44%	0.439	50%	0.502	S	S	.	.	H	α-helix	trans	-66	-41.8	174.6	-173	177.8	2.8	0	0	111.7	Y22 A24 A29 T30	Y22-Q26 VanDerWaalsContact O-CB 3.27Å; Y22-Q26 WeakPolarHBondContact O-CB 3.47Å; Y22-Q26 PolarHBondContact O-N 3.28Å; A24-Q26 VanDerWaalsContact C-N 3.27Å; A24-Q26 PolarHBondContact O-N 2.89Å; Q26-A29 PolarHBondContact O-N 2.83Å; Q26-T30 PolarHBondContact O-N 3.16Å; Q26-T30 PolarHBondContact O-OG1 3.2Å; Q26-T30 VanDerWaalsContact O-OG1 3.14Å
27	R	94.8	Very high	94.7	Very high	184 Å²	184	99.2 Å²	99.2	69%	0.694	50%	0.501	S	S	*	.	H	α-helix	trans	-66.4	-40	174.8	-71.8	166.6	-176.9	-178.7	1.3	112	L23 A24 T30 S31	L23-R27 WeakPolarHBondContact O-CD 3.29Å; L23-R27 VanDerWaalsContact O-CG 3.22Å; L23-R27 WeakPolarHBondContact O-CG 3.18Å; L23-R27 PolarHBondContact O-N 2.85Å; A24-R27 WeakPolarHBondContact O-CB 3.36Å; A24-R27 PolarHBondContact O-N 3.27Å; A24-R27 VanDerWaalsContact O-N 3.08Å; R27-T30 PolarHBondContact O-N 3.28Å; R27-S31 VanDerWaalsContact O-CB 3.31Å; R27-S31 WeakPolarHBondContact O-CB 3.27Å; R27-S31 PolarHBondContact O-N 2.83Å
28	E	95.1	Very high	94.8	Very high	126 Å²	126	102 Å²	102	59%	0.589	51%	0.509	S	S	*	.	H	α-helix	trans	-63	-44.9	174.4	-72.1	170.3	-174.6	0	0	110.9	A24 A25 T30 S31 I32	A24-E28 WeakPolarHBondContact O-CG 3.37Å; A24-E28 PolarHBondContact O-N 3.34Å; A25-E28 PolarHBondContact O-N 3.16Å; E28-T30 PolarHBondContact O-N 3.08Å; E28-S31 PolarHBondContact O-N 3.47Å; E28-I32 WeakPolarHBondContact O-CB 3.32Å; E28-I32 VanDerWaalsContact O-CG1 3.27Å; E28-I32 WeakPolarHBondContact O-CG1 3.49Å; E28-I32 PolarHBondContact O-N 3.39Å
29	A	94.4	Very high	94.8	Very high	58 Å²	58	101.3 Å²	101.3	48%	0.479	51%	0.505	S	S	.	.	H	α-helix	trans	-60.9	-44.7	175.5	0	0	0	0	0	112.7	A25 Q26 I32 H33	A25-A29 VanDerWaalsContact O-CB 3.32Å; A25-A29 WeakPolarHBondContact O-CB 3.41Å; A25-A29 PolarHBondContact O-N 3.12Å; Q26-A29 PolarHBondContact O-N 2.83Å; A29-I32 PolarHBondContact O-N 2.97Å; A29-H33 PolarHBondContact O-N 3.2Å
30	T	94.3	Very high	94.8	Very high	74 Å²	74	101.9 Å²	101.9	45%	0.454	51%	0.507	S	S	.	.	H	α-helix	trans	-62.4	-43.9	173	-57.3	0	0	0	0	111.5	Q26 R27 E28 I32 H33 D34	Q26-T30 PolarHBondContact O-N 3.16Å; Q26-T30 PolarHBondContact O-OG1 3.2Å; Q26-T30 VanDerWaalsContact O-OG1 3.14Å; R27-T30 PolarHBondContact O-N 3.28Å; E28-T30 PolarHBondContact O-N 3.08Å; T30-I32 VanDerWaalsContact C-N 3.26Å; T30-I32 PolarHBondContact O-N 2.7Å; T30-H33 PolarHBondContact O-N 3.07Å; T30-D34 WeakPolarHBondContact O-CB 3.19Å; T30-D34 PolarHBondContact O-N 3.12Å
31	S	95.9	Very high	94.8	Very high	77 Å²	77	100.1 Å²	100.1	54%	0.538	51%	0.505	S	S	.	.	H	α-helix	trans	-64.4	-28.8	178.2	-172.5	0	0	0	0	113.4	R27 E28 L35	R27-S31 VanDerWaalsContact O-CB 3.31Å; R27-S31 WeakPolarHBondContact O-CB 3.27Å; R27-S31 PolarHBondContact O-N 2.83Å; E28-S31 PolarHBondContact O-N 3.47Å; S31-L35 WeakPolarHBondContact O-CB 3.4Å; S31-L35 PolarHBondContact O-N 3.37Å
32	I	95.7	Very high	94.8	Very high	115 Å²	115	97.7 Å²	97.7	59%	0.59	50%	0.501	S	S	*	.	H	α-helix	trans	-75.8	-41.6	174	-70.8	164.1	0	0	0	110.4	E28 A29 T30 L35 N36	E28-I32 WeakPolarHBondContact O-CB 3.32Å; E28-I32 VanDerWaalsContact O-CG1 3.27Å; E28-I32 WeakPolarHBondContact O-CG1 3.49Å; E28-I32 PolarHBondContact O-N 3.39Å; A29-I32 PolarHBondContact O-N 2.97Å; T30-I32 VanDerWaalsContact C-N 3.26Å; T30-I32 PolarHBondContact O-N 2.7Å; I32-L35 PolarHBondContact O-N 2.88Å; I32-N36 WeakPolarHBondContact O-CB 3.43Å; I32-N36 PolarHBondContact O-N 3.46Å
33	H	95.1	Very high	94.8	Very high	111 Å²	111	94.9 Å²	94.9	51%	0.514	50%	0.496	S	S	.	.	H	α-helix	trans	-61.6	-49.7	173.7	-169.3	-5.2	0	0	0	110.9	A29 T30 L35 N36 D37	A29-H33 PolarHBondContact O-N 3.2Å; T30-H33 PolarHBondContact O-N 3.07Å; H33-L35 PolarHBondContact O-N 3.18Å; H33-L35 VanDerWaalsContact O-N 3.07Å; H33-N36 PolarHBondContact O-N 3.06Å; H33-N36 VanDerWaalsContact O-N 3.08Å; H33-D37 IonicContact CE1-OD1 3.4Å; H33-D37 PolarHBondContact CE1-OD1 3.2Å; H33-D37 IonicContact CE1-OD2 3.43Å; H33-D37 PolarHBondContact CE1-OD2 3.47Å; H33-D37 IonicContact ND1-OD1 2.84Å; H33-D37 PolarHBondContact ND1-OD1 3.26Å; H33-D37 IonicContact ND1-OD2 2.88Å; H33-D37 PolarHBondContact O-N 3Å
34	D	94.1	Very high	94.7	Very high	82 Å²	82	93.6 Å²	93.6	44%	0.439	50%	0.497	S	S	.	.	H	α-helix	trans	-56.4	-25.9	174.4	-76.4	-9.3	0	0	0	113.2	T30 K38	T30-D34 WeakPolarHBondContact O-CB 3.19Å; T30-D34 PolarHBondContact O-N 3.12Å; D34-K38 WeakPolarHBondContact O-CD 3.44Å; D34-K38 WeakPolarHBondContact O-CE 3.41Å; D34-K38 VanDerWaalsContact O-CG 3.24Å; D34-K38 WeakPolarHBondContact O-CG 3.42Å; D34-K38 PolarHBondContact O-NZ 2.89Å
35	L	95.8	Very high	94.7	Very high	100 Å²	100	96.9 Å²	96.9	52%	0.524	51%	0.509	S	S	.	.	H	α-helix	trans	-86.7	-40.6	176.4	-178.7	61.7	0	0	0	111.6	S31 I32 H33 K38 L39	S31-L35 WeakPolarHBondContact O-CB 3.4Å; S31-L35 PolarHBondContact O-N 3.37Å; I32-L35 PolarHBondContact O-N 2.88Å; H33-L35 PolarHBondContact O-N 3.18Å; H33-L35 VanDerWaalsContact O-N 3.07Å; L35-K38 PolarHBondContact O-N 3.03Å; L35-L39 HydrophobicContact CG-CD1 4.27Å; L35-L39 WeakPolarHBondContact O-CG 3.35Å; L35-L39 PolarHBondContact O-N 3.09Å
36	N	95.1	Very high	94.7	Very high	72 Å²	72	101.1 Å²	101.1	39%	0.385	52%	0.518	S	S	.	.	H	α-helix	trans	-58.6	-49.1	174.7	-175.4	81.3	0	0	0	110.9	I32 H33 K38 L39 E40	I32-N36 WeakPolarHBondContact O-CB 3.43Å; I32-N36 PolarHBondContact O-N 3.46Å; H33-N36 PolarHBondContact O-N 3.06Å; H33-N36 VanDerWaalsContact O-N 3.08Å; N36-K38 PolarHBondContact O-N 3.4Å; N36-L39 CarbonylContact O-C 3.13Å; N36-L39 WeakPolarHBondContact O-CA 3.38Å; N36-L39 WeakPolarHBondContact O-CB 3.41Å; N36-L39 PolarHBondContact O-N 2.74Å; N36-E40 VanDerWaalsContact ND2-CD 3.32Å; N36-E40 PolarHBondContact ND2-OE1 2.99Å; N36-E40 PolarHBondContact O-N 3.35Å
37	D	94.8	Very high	94.7	Very high	60 Å²	60	101.6 Å²	101.6	32%	0.321	52%	0.52	S	S	.	.	H	α-helix	trans	-60.8	-34.1	179.7	-67	24.1	0	0	0	111.7	H33 N41	H33-D37 IonicContact CE1-OD1 3.4Å; H33-D37 PolarHBondContact CE1-OD1 3.2Å; H33-D37 IonicContact CE1-OD2 3.43Å; H33-D37 PolarHBondContact CE1-OD2 3.47Å; H33-D37 IonicContact ND1-OD1 2.84Å; H33-D37 PolarHBondContact ND1-OD1 3.26Å; H33-D37 IonicContact ND1-OD2 2.88Å; H33-D37 PolarHBondContact O-N 3Å; D37-N41 WeakPolarHBondContact O-CB 3.48Å; D37-N41 PolarHBondContact O-N 3.48Å; D37-N41 VanDerWaalsContact O-N 3.09Å; D37-N41 PolarHBondContact O-ND2 2.97Å
38	K	94.9	Very high	94.7	Very high	121 Å²	121	96.4 Å²	96.4	53%	0.526	51%	0.512	S	S	.	.	H	α-helix	trans	-68.2	-43.8	173	-71	174.8	-169.5	98.2	0	111.5	D34 L35 N36 N41 E42	D34-K38 WeakPolarHBondContact O-CD 3.44Å; D34-K38 WeakPolarHBondContact O-CE 3.41Å; D34-K38 VanDerWaalsContact O-CG 3.24Å; D34-K38 WeakPolarHBondContact O-CG 3.42Å; D34-K38 PolarHBondContact O-NZ 2.89Å; L35-K38 PolarHBondContact O-N 3.03Å; N36-K38 PolarHBondContact O-N 3.4Å; K38-N41 PolarHBondContact O-N 2.9Å; K38-E42 WeakPolarHBondContact O-CG 3.3Å; K38-E42 PolarHBondContact O-N 3.04Å
39	L	94.8	Very high	94.6	Very high	101 Å²	101	95.1 Å²	95.1	53%	0.529	51%	0.508	S	S	.	.	H	α-helix	trans	-66.2	-38	178.2	-69.8	169.8	0	0	0	112.2	L35 N36 E42 L43	L35-L39 HydrophobicContact CG-CD1 4.27Å; L35-L39 WeakPolarHBondContact O-CG 3.35Å; L35-L39 PolarHBondContact O-N 3.09Å; N36-L39 CarbonylContact O-C 3.13Å; N36-L39 WeakPolarHBondContact O-CA 3.38Å; N36-L39 WeakPolarHBondContact O-CB 3.41Å; N36-L39 PolarHBondContact O-N 2.74Å; L39-E42 PolarHBondContact O-N 2.82Å; L39-L43 VanDerWaalsContact O-CB 3.3Å; L39-L43 WeakPolarHBondContact O-CB 3.46Å; L39-L43 PolarHBondContact O-N 2.89Å
40	E	93.9	Very high	94.5	Very high	114 Å²	114	98 Å²	98	53%	0.533	51%	0.512	S	S	.	.	H	α-helix	trans	-64.4	-43.5	173.3	-72.3	-178.4	-173.9	0	0	111.6	N36 L43 A44	N36-E40 VanDerWaalsContact ND2-CD 3.32Å; N36-E40 PolarHBondContact ND2-OE1 2.99Å; N36-E40 PolarHBondContact O-N 3.35Å; E40-L43 PolarHBondContact O-N 3.36Å; E40-A44 WeakPolarHBondContact O-CB 3.48Å; E40-A44 PolarHBondContact O-N 3.2Å
41	N	94.3	Very high	94.5	Very high	104 Å²	104	101.1 Å²	101.1	56%	0.556	52%	0.515	S	S	*	.	H	α-helix	trans	-64.9	-40.1	173.9	-83.4	-78.7	0	0	0	112.3	D37 K38 N45	D37-N41 WeakPolarHBondContact O-CB 3.48Å; D37-N41 PolarHBondContact O-N 3.48Å; D37-N41 VanDerWaalsContact O-N 3.09Å; D37-N41 PolarHBondContact O-ND2 2.97Å; K38-N41 PolarHBondContact O-N 2.9Å; N41-N45 WeakPolarHBondContact O-CB 3.34Å; N41-N45 PolarHBondContact O-N 2.93Å; N41-N45 VanDerWaalsContact O-N 3.11Å; N41-N45 PolarHBondContact O-ND2 3.3Å
42	E	94.8	Very high	94.3	Very high	123 Å²	123	101.8 Å²	101.8	58%	0.575	51%	0.51	S	S	*	.	H	α-helix	trans	-64.6	-42.4	174	-77.9	-170.8	-162.3	0	0	111.7	K38 L39 N45 K46	K38-E42 WeakPolarHBondContact O-CG 3.3Å; K38-E42 PolarHBondContact O-N 3.04Å; L39-E42 PolarHBondContact O-N 2.82Å; E42-N45 PolarHBondContact O-N 3.38Å; E42-K46 VanDerWaalsContact O-CG 3.25Å; E42-K46 WeakPolarHBondContact O-CG 3.32Å; E42-K46 PolarHBondContact O-N 3.14Å
43	L	94.2	Very high	94.1	Very high	100 Å²	100	99.5 Å²	99.5	52%	0.524	50%	0.503	S	S	.	.	H	α-helix	trans	-60.7	-50.3	176.8	-178	63.4	0	0	0	111.3	L39 E40 N45 K46 E47	L39-L43 VanDerWaalsContact O-CB 3.3Å; L39-L43 WeakPolarHBondContact O-CB 3.46Å; L39-L43 PolarHBondContact O-N 2.89Å; E40-L43 PolarHBondContact O-N 3.36Å; L43-N45 VanDerWaalsContact C-N 3.28Å; L43-N45 PolarHBondContact O-N 3.31Å; L43-K46 WeakPolarHBondContact O-CA 3.43Å; L43-K46 WeakPolarHBondContact O-CB 3.44Å; L43-K46 PolarHBondContact O-N 3.32Å; L43-E47 HydrophobicContact CD1-CG 4.5Å; L43-E47 WeakPolarHBondContact O-CG 3.39Å; L43-E47 PolarHBondContact O-N 3.02Å
44	A	93.7	Very high	94	Very high	55 Å²	55	98.4 Å²	98.4	46%	0.455	50%	0.498	S	S	.	.	H	α-helix	trans	-58.8	-38.3	177.5	0	0	0	0	0	112.5	E40 S48	E40-A44 WeakPolarHBondContact O-CB 3.48Å; E40-A44 PolarHBondContact O-N 3.2Å; A44-S48 WeakPolarHBondContact O-CB 3.49Å; A44-S48 PolarHBondContact O-N 3.07Å
45	N	94.4	Very high	94	Very high	111 Å²	111	99.3 Å²	99.3	59%	0.594	50%	0.5	S	S	*	.	H	α-helix	trans	-67.1	-37.8	173.7	-80.8	-64.1	0	0	0	112.6	N41 E42 L43 L49	N41-N45 WeakPolarHBondContact O-CB 3.34Å; N41-N45 PolarHBondContact O-N 2.93Å; N41-N45 VanDerWaalsContact O-N 3.11Å; N41-N45 PolarHBondContact O-ND2 3.3Å; E42-N45 PolarHBondContact O-N 3.38Å; L43-N45 VanDerWaalsContact C-N 3.28Å; L43-N45 PolarHBondContact O-N 3.31Å; N45-L49 WeakPolarHBondContact O-CB 3.43Å; N45-L49 PolarHBondContact O-N 3.44Å; N45-L49 VanDerWaalsContact O-N 3.07Å
46	K	94	Very high	93.8	Very high	141 Å²	141	100 Å²	100	61%	0.613	50%	0.499	S	S	*	.	H	α-helix	trans	-67.7	-42.5	175.3	-68.3	-73.4	-179.3	178.5	0	112.1	E42 L43 L49 H50	E42-K46 VanDerWaalsContact O-CG 3.25Å; E42-K46 WeakPolarHBondContact O-CG 3.32Å; E42-K46 PolarHBondContact O-N 3.14Å; L43-K46 WeakPolarHBondContact O-CA 3.43Å; L43-K46 WeakPolarHBondContact O-CB 3.44Å; L43-K46 PolarHBondContact O-N 3.32Å; K46-L49 PolarHBondContact O-N 3.22Å; K46-H50 WeakPolarHBondContact O-CB 3.45Å; K46-H50 PolarHBondContact O-N 3Å
47	E	95	Very high	93.6	Very high	104 Å²	104	99.3 Å²	99.3	49%	0.486	50%	0.503	S	S	.	.	H	α-helix	trans	-62.9	-43.8	175.8	-71.7	-177.7	-179.7	0	0	111.9	L43 H50 R51	L43-E47 HydrophobicContact CD1-CG 4.5Å; L43-E47 WeakPolarHBondContact O-CG 3.39Å; L43-E47 PolarHBondContact O-N 3.02Å; E47-H50 PolarHBondContact O-N 3.19Å; E47-R51 WeakPolarHBondContact O-CB 3.35Å; E47-R51 PolarHBondContact O-N 3Å
48	S	93.9	Very high	93.6	Very high	76 Å²	76	103.2 Å²	103.2	53%	0.531	51%	0.513	S	S	.	.	H	α-helix	trans	-59	-46.7	175	-176.3	0	0	0	0	111.9	A44 R51 Q52	A44-S48 WeakPolarHBondContact O-CB 3.49Å; A44-S48 PolarHBondContact O-N 3.07Å; S48-R51 PolarHBondContact O-N 3.41Å; S48-Q52 PolarHBondContact O-N 2.91Å; S48-Q52 VanDerWaalsContact O-N 3.11Å
49	L	93.3	Very high	93.4	Very high	98 Å²	98	102.2 Å²	102.2	51%	0.513	51%	0.51	S	S	.	.	H	α-helix	trans	-65.2	-38.8	176.3	-176.8	62.4	0	0	0	112.4	N45 K46 Q52 C53	N45-L49 WeakPolarHBondContact O-CB 3.43Å; N45-L49 PolarHBondContact O-N 3.44Å; N45-L49 VanDerWaalsContact O-N 3.07Å; K46-L49 PolarHBondContact O-N 3.22Å; L49-Q52 PolarHBondContact O-N 3.11Å; L49-C53 PolarHBondContact O-N 2.9Å; L49-C53 VanDerWaalsContact O-N 3.07Å; L49-C53 PolarHBondContact O-SG 3.08Å
50	H	91.9	Very high	93.2	Very high	118 Å²	118	103 Å²	103	55%	0.546	51%	0.514	S	S	.	.	H	α-helix	trans	-62.7	-48.9	177	-173.9	57.7	0	0	0	111.2	K46 E47 Q52 C53 E54	K46-H50 WeakPolarHBondContact O-CB 3.45Å; K46-H50 PolarHBondContact O-N 3Å; E47-H50 PolarHBondContact O-N 3.19Å; H50-Q52 VanDerWaalsContact C-N 3.31Å; H50-Q52 PolarHBondContact O-N 2.89Å; H50-C53 CarbonylContact O-C 3.59Å; H50-C53 WeakPolarHBondContact O-CA 3.48Å; H50-C53 WeakPolarHBondContact O-CB 3.32Å; H50-C53 PolarHBondContact O-N 3.38Å; H50-E54 PolarHBondContact O-N 3.35Å
51	R	94.5	Very high	93.1	Very high	141 Å²	141	103.5 Å²	103.5	53%	0.532	52%	0.516	S	S	.	.	H	α-helix	trans	-57.1	-42.6	176.7	-170	177.2	-60.7	152.5	8.6	112.2	E47 S48 C53 E54 E55	E47-R51 WeakPolarHBondContact O-CB 3.35Å; E47-R51 PolarHBondContact O-N 3Å; S48-R51 PolarHBondContact O-N 3.41Å; R51-C53 VanDerWaalsContact C-N 3.3Å; R51-C53 PolarHBondContact O-N 3.21Å; R51-E54 PolarHBondContact O-N 2.97Å; R51-E55 WeakPolarHBondContact O-CG 3.49Å; R51-E55 PolarHBondContact O-N 2.86Å
52	Q	92.4	Very high	93.1	Very high	91 Å²	91	103.9 Å²	103.9	43%	0.425	52%	0.515	S	S	.	.	H	α-helix	trans	-64.4	-33.3	175.3	-162.8	-167	78.9	0	0	112.5	S48 L49 H50 K56	S48-Q52 PolarHBondContact O-N 2.91Å; S48-Q52 VanDerWaalsContact O-N 3.11Å; L49-Q52 PolarHBondContact O-N 3.11Å; H50-Q52 VanDerWaalsContact C-N 3.31Å; H50-Q52 PolarHBondContact O-N 2.89Å; Q52-K56 WeakPolarHBondContact O-CB 3.23Å; Q52-K56 WeakPolarHBondContact O-CD 3.32Å; Q52-K56 VanDerWaalsContact O-CG 3.26Å; Q52-K56 WeakPolarHBondContact O-CG 3.44Å; Q52-K56 PolarHBondContact O-N 3.32Å; Q52-K56 VanDerWaalsContact O-N 3.09Å
53	C	90.3	Very high	92.9	Very high	66 Å²	66	102.4 Å²	102.4	45%	0.446	51%	0.511	S	S	.	.	H	α-helix	trans	-70	-38.7	172.5	-74.1	0	0	0	0	112.3	L49 H50 R51 K56 A57	L49-C53 PolarHBondContact O-N 2.9Å; L49-C53 VanDerWaalsContact O-N 3.07Å; L49-C53 PolarHBondContact O-SG 3.08Å; H50-C53 CarbonylContact O-C 3.59Å; H50-C53 WeakPolarHBondContact O-CA 3.48Å; H50-C53 WeakPolarHBondContact O-CB 3.32Å; H50-C53 PolarHBondContact O-N 3.38Å; R51-C53 VanDerWaalsContact C-N 3.3Å; R51-C53 PolarHBondContact O-N 3.21Å; C53-K56 PolarHBondContact O-N 3.06Å; C53-A57 WeakPolarHBondContact O-CB 3.37Å; C53-A57 PolarHBondContact O-N 3.31Å
54	E	93.5	Very high	92.7	Very high	89 Å²	89	101.5 Å²	101.5	42%	0.416	51%	0.506	S	S	.	.	H	α-helix	trans	-65.8	-35.6	174.4	-64.9	-179.8	112.8	0	0	112.8	H50 R51 R58	H50-E54 PolarHBondContact O-N 3.35Å; R51-E54 PolarHBondContact O-N 2.97Å; E54-R58 WeakPolarHBondContact O-CG 3.36Å; E54-R58 PolarHBondContact O-N 3.31Å; E54-R58 PolarHBondContact O-NE 2.9Å; E54-R58 VanDerWaalsContact O-NE 3.15Å
55	E	94.1	Very high	92.8	Very high	101 Å²	101	104 Å²	104	47%	0.472	51%	0.508	S	S	.	.	H	α-helix	trans	-66.8	-45.4	173.4	-72.5	166.5	-176	0	0	111.3	R51 A57 R58 H59	R51-E55 WeakPolarHBondContact O-CG 3.49Å; R51-E55 PolarHBondContact O-N 2.86Å; E55-A57 VanDerWaalsContact C-N 3.34Å; E55-A57 PolarHBondContact O-N 2.88Å; E55-R58 VanDerWaalsContact CG-NH2 3.3Å; E55-R58 PolarHBondContact O-N 2.9Å; E55-H59 PolarHBondContact O-N 3.02Å
56	K	91.8	Very high	92.7	Very high	114 Å²	114	101.7 Å²	101.7	50%	0.496	50%	0.498	S	S	.	.	H	α-helix	trans	-61.1	-40.4	173.5	-73.8	164.8	177.4	170.6	0	112.2	Q52 C53 H59 L60	Q52-K56 WeakPolarHBondContact O-CB 3.23Å; Q52-K56 WeakPolarHBondContact O-CD 3.32Å; Q52-K56 VanDerWaalsContact O-CG 3.26Å; Q52-K56 WeakPolarHBondContact O-CG 3.44Å; Q52-K56 PolarHBondContact O-N 3.32Å; Q52-K56 VanDerWaalsContact O-N 3.09Å; C53-K56 PolarHBondContact O-N 3.06Å; K56-H59 PolarHBondContact O-N 2.91Å; K56-L60 WeakPolarHBondContact O-CG 3.42Å; K56-L60 PolarHBondContact O-N 3.01Å
57	A	90.8	Very high	92.2	Very high	57 Å²	57	97.4 Å²	97.4	47%	0.471	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-45.6	176.9	0	0	0	0	0	111.9	C53 E55 H59 L60 Q61	C53-A57 WeakPolarHBondContact O-CB 3.37Å; C53-A57 PolarHBondContact O-N 3.31Å; E55-A57 VanDerWaalsContact C-N 3.34Å; E55-A57 PolarHBondContact O-N 2.88Å; A57-H59 PolarHBondContact O-N 3.23Å; A57-L60 PolarHBondContact O-N 3.33Å; A57-Q61 PolarHBondContact O-N 2.87Å
58	R	94.5	Very high	92.1	Very high	142 Å²	142	97.3 Å²	97.3	54%	0.536	49%	0.488	S	S	.	.	H	α-helix	trans	-59.4	-46	175	-78.5	177.5	-76.8	170.4	-4.6	112	E54 E55 L60 Q61 E62	E54-R58 WeakPolarHBondContact O-CG 3.36Å; E54-R58 PolarHBondContact O-N 3.31Å; E54-R58 PolarHBondContact O-NE 2.9Å; E54-R58 VanDerWaalsContact O-NE 3.15Å; E55-R58 VanDerWaalsContact CG-NH2 3.3Å; E55-R58 PolarHBondContact O-N 2.9Å; R58-L60 VanDerWaalsContact C-N 3.35Å; R58-L60 PolarHBondContact O-N 3.19Å; R58-Q61 WeakPolarHBondContact O-CB 3.46Å; R58-Q61 PolarHBondContact O-N 2.94Å; R58-Q61 VanDerWaalsContact O-N 3.09Å; R58-E62 WeakPolarHBondContact O-CG 3.27Å; R58-E62 PolarHBondContact O-N 2.91Å
59	H	92.1	Very high	92	Very high	101 Å²	101	98.7 Å²	98.7	47%	0.468	49%	0.487	S	S	.	.	H	α-helix	trans	-64.1	-37.4	178.6	-173.2	50	0	0	0	113.3	E55 K56 A57 Q61 E62 L63	E55-H59 PolarHBondContact O-N 3.02Å; K56-H59 PolarHBondContact O-N 2.91Å; A57-H59 PolarHBondContact O-N 3.23Å; H59-Q61 VanDerWaalsContact C-N 3.3Å; H59-Q61 PolarHBondContact O-N 2.85Å; H59-E62 IonicContact ND1-OE2 2.75Å; H59-E62 PolarHBondContact ND1-OE2 3.14Å; H59-E62 VanDerWaalsContact ND1-OE2 3.16Å; H59-E62 PolarHBondContact O-N 3.44Å; H59-L63 WeakPolarHBondContact O-CG 3.27Å; H59-L63 PolarHBondContact O-N 2.89Å; H59-L63 VanDerWaalsContact O-N 3.1Å
60	L	89.5	Confident	91.8	Very high	117 Å²	117	100.5 Å²	100.5	61%	0.613	49%	0.49	S	S	*	.	H	α-helix	trans	-65.7	-33.5	173.2	-72.1	170.1	0	0	0	112.4	K56 A57 R58 L63 L64	K56-L60 WeakPolarHBondContact O-CG 3.42Å; K56-L60 PolarHBondContact O-N 3.01Å; A57-L60 PolarHBondContact O-N 3.33Å; R58-L60 VanDerWaalsContact C-N 3.35Å; R58-L60 PolarHBondContact O-N 3.19Å; L60-L63 PolarHBondContact O-N 3.36Å; L60-L64 PolarHBondContact O-N 3.32Å
61	Q	91.4	Very high	91.5	Very high	124 Å²	124	99.9 Å²	99.9	58%	0.579	49%	0.491	S	S	*	.	H	α-helix	trans	-67.3	-42.9	175.3	-165.1	67	36	0	0	111.9	A57 R58 H59 L63 L64 E65	A57-Q61 PolarHBondContact O-N 2.87Å; R58-Q61 WeakPolarHBondContact O-CB 3.46Å; R58-Q61 PolarHBondContact O-N 2.94Å; R58-Q61 VanDerWaalsContact O-N 3.09Å; H59-Q61 VanDerWaalsContact C-N 3.3Å; H59-Q61 PolarHBondContact O-N 2.85Å; Q61-L63 PolarHBondContact O-N 3.29Å; Q61-L64 WeakPolarHBondContact O-CB 3.44Å; Q61-L64 PolarHBondContact O-N 2.91Å; Q61-E65 PolarHBondContact O-N 3.3Å
62	E	94.3	Very high	91.4	Very high	113 Å²	113	98.1 Å²	98.1	53%	0.528	49%	0.488	S	S	.	.	H	α-helix	trans	-59.3	-44.5	173.8	-66.5	164.9	173.9	0	0	111.7	R58 H59 L64 E65 V66	R58-E62 WeakPolarHBondContact O-CG 3.27Å; R58-E62 PolarHBondContact O-N 2.91Å; H59-E62 IonicContact ND1-OE2 2.75Å; H59-E62 PolarHBondContact ND1-OE2 3.14Å; H59-E62 VanDerWaalsContact ND1-OE2 3.16Å; H59-E62 PolarHBondContact O-N 3.44Å; E62-L64 VanDerWaalsContact C-N 3.32Å; E62-L64 PolarHBondContact O-N 3.27Å; E62-E65 PolarHBondContact O-N 3.43Å; E62-V66 WeakPolarHBondContact O-CG2 3.38Å; E62-V66 PolarHBondContact O-N 2.97Å; E62-V66 VanDerWaalsContact O-N 3.07Å
63	L	90.8	Very high	91.1	Very high	92 Å²	92	99 Å²	99	48%	0.482	49%	0.493	S	S	.	.	H	α-helix	trans	-65.2	-35	177.8	-71.7	174.4	0	0	0	112.6	H59 L60 Q61 A67	H59-L63 WeakPolarHBondContact O-CG 3.27Å; H59-L63 PolarHBondContact O-N 2.89Å; H59-L63 VanDerWaalsContact O-N 3.1Å; L60-L63 PolarHBondContact O-N 3.36Å; Q61-L63 PolarHBondContact O-N 3.29Å; L63-A67 WeakPolarHBondContact O-CB 3.36Å; L63-A67 PolarHBondContact O-N 3.47Å; L63-A67 VanDerWaalsContact O-N 3.1Å
64	L	90.5	Very high	90.4	Very high	80 Å²	80	99.8 Å²	99.8	42%	0.419	50%	0.495	S	S	.	.	H	α-helix	trans	-65.6	-49.5	174.3	177.8	61.5	0	0	0	111.1	L60 Q61 E62 V66 A67 E68	L60-L64 PolarHBondContact O-N 3.32Å; Q61-L64 WeakPolarHBondContact O-CB 3.44Å; Q61-L64 PolarHBondContact O-N 2.91Å; E62-L64 VanDerWaalsContact C-N 3.32Å; E62-L64 PolarHBondContact O-N 3.27Å; L64-V66 VanDerWaalsContact C-N 3.32Å; L64-V66 PolarHBondContact O-N 3.09Å; L64-A67 WeakPolarHBondContact O-CA 3.45Å; L64-A67 WeakPolarHBondContact O-CB 3.37Å; L64-A67 PolarHBondContact O-N 3.09Å; L64-E68 HydrophobicContact CD1-CG 4.32Å; L64-E68 PolarHBondContact O-N 3.41Å
65	E	95.1	Very high	89.8	Confident	108 Å²	108	100.6 Å²	100.6	51%	0.505	50%	0.5	S	S	.	.	H	α-helix	trans	-59.3	-44.1	179.4	-163.3	-166.3	145	0	0	111.4	Q61 E62 A67 E68 Q69	Q61-E65 PolarHBondContact O-N 3.3Å; E62-E65 PolarHBondContact O-N 3.43Å; E65-A67 VanDerWaalsContact C-N 3.25Å; E65-A67 PolarHBondContact O-N 2.91Å; E65-E68 PolarHBondContact O-N 3.07Å; E65-Q69 VanDerWaalsContact O-CG 3.31Å; E65-Q69 WeakPolarHBondContact O-CG 3.3Å; E65-Q69 PolarHBondContact O-N 2.95Å; E65-Q69 PolarHBondContact OE1-NE2 3.31Å
66	V	92.5	Very high	89.3	Confident	62 Å²	62	103.4 Å²	103.4	38%	0.376	51%	0.507	S	S	.	.	H	α-helix	trans	-63.7	-29.3	175.5	169.8	0	0	0	0	112.4	E62 L64 K70	E62-V66 WeakPolarHBondContact O-CG2 3.38Å; E62-V66 PolarHBondContact O-N 2.97Å; E62-V66 VanDerWaalsContact O-N 3.07Å; L64-V66 VanDerWaalsContact C-N 3.32Å; L64-V66 PolarHBondContact O-N 3.09Å; V66-K70 HydrophobicContact CG1-CD 4.34Å; V66-K70 WeakPolarHBondContact O-CD 3.36Å; V66-K70 VanDerWaalsContact O-CG 3.24Å; V66-K70 WeakPolarHBondContact O-CG 3.42Å; V66-K70 PolarHBondContact O-N 2.96Å
67	A	85	Confident	88.6	Confident	52 Å²	52	103.5 Å²	103.5	43%	0.43	51%	0.507	S	S	.	.	H	α-helix	trans	-74.6	-41.4	173.7	0	0	0	0	0	112	L63 L64 E65 K70 L71	L63-A67 WeakPolarHBondContact O-CB 3.36Å; L63-A67 PolarHBondContact O-N 3.47Å; L63-A67 VanDerWaalsContact O-N 3.1Å; L64-A67 WeakPolarHBondContact O-CA 3.45Å; L64-A67 WeakPolarHBondContact O-CB 3.37Å; L64-A67 PolarHBondContact O-N 3.09Å; E65-A67 VanDerWaalsContact C-N 3.25Å; E65-A67 PolarHBondContact O-N 2.91Å; A67-K70 PolarHBondContact O-N 3.3Å; A67-L71 PolarHBondContact O-N 2.89Å
68	E	91.6	Very high	87.7	Confident	101 Å²	101	103.4 Å²	103.4	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-64.3	-44.4	176.3	-70.1	-179.4	173	0	0	111.9	L64 E65 K70 L71 Q72	L64-E68 HydrophobicContact CD1-CG 4.32Å; L64-E68 PolarHBondContact O-N 3.41Å; E65-E68 PolarHBondContact O-N 3.07Å; E68-K70 VanDerWaalsContact C-N 3.29Å; E68-K70 PolarHBondContact O-N 3.46Å; E68-L71 WeakPolarHBondContact O-CB 3.45Å; E68-L71 PolarHBondContact O-N 3.44Å; E68-L71 VanDerWaalsContact O-N 3.12Å; E68-Q72 WeakPolarHBondContact O-CG 3.46Å; E68-Q72 PolarHBondContact O-N 2.66Å
69	Q	92.6	Very high	86.9	Confident	106 Å²	106	103.3 Å²	103.3	50%	0.495	51%	0.512	S	S	.	.	H	α-helix	trans	-57.9	-41.1	173.8	-69.5	176.6	16.6	0	0	111.7	E65 Q73	E65-Q69 VanDerWaalsContact O-CG 3.31Å; E65-Q69 WeakPolarHBondContact O-CG 3.3Å; E65-Q69 PolarHBondContact O-N 2.95Å; E65-Q69 PolarHBondContact OE1-NE2 3.31Å; Q69-Q73 WeakPolarHBondContact O-CB 3.36Å; Q69-Q73 PolarHBondContact O-N 2.94Å
70	K	88.6	Confident	86.2	Confident	135 Å²	135	102 Å²	102	59%	0.587	51%	0.511	S	S	*	.	H	α-helix	trans	-67.8	-36.6	175.3	-74.5	167.7	-173.5	166.8	0	112.5	V66 A67 E68 T74	V66-K70 HydrophobicContact CG1-CD 4.34Å; V66-K70 WeakPolarHBondContact O-CD 3.36Å; V66-K70 VanDerWaalsContact O-CG 3.24Å; V66-K70 WeakPolarHBondContact O-CG 3.42Å; V66-K70 PolarHBondContact O-N 2.96Å; A67-K70 PolarHBondContact O-N 3.3Å; E68-K70 VanDerWaalsContact C-N 3.29Å; E68-K70 PolarHBondContact O-N 3.46Å; K70-T74 WeakPolarHBondContact O-CB 3.45Å; K70-T74 PolarHBondContact O-N 3.48Å; K70-T74 PolarHBondContact O-OG1 2.89Å
71	L	86.7	Confident	85.5	Confident	106 Å²	106	100.6 Å²	100.6	56%	0.555	50%	0.504	S	S	*	.	H	α-helix	trans	-64.7	-49	174.9	-179.7	59.9	0	0	0	110.9	A67 E68 Q73 T74 M75	A67-L71 PolarHBondContact O-N 2.89Å; E68-L71 WeakPolarHBondContact O-CB 3.45Å; E68-L71 PolarHBondContact O-N 3.44Å; E68-L71 VanDerWaalsContact O-N 3.12Å; L71-Q73 VanDerWaalsContact C-N 3.34Å; L71-Q73 PolarHBondContact O-N 3.28Å; L71-T74 CarbonylContact O-C 3.08Å; L71-T74 WeakPolarHBondContact O-CA 3.49Å; L71-T74 WeakPolarHBondContact O-CB 3.41Å; L71-T74 PolarHBondContact O-N 3.49Å; L71-M75 HydrophobicContact CG-SD 4.45Å; L71-M75 PolarHBondContact O-N 3.23Å
72	Q	90.5	Very high	84.8	Confident	104 Å²	104	98.4 Å²	98.4	49%	0.486	50%	0.501	S	S	.	.	H	α-helix	trans	-58.9	-42.5	175.8	-67.9	-178.7	20.1	0	0	112.2	E68 T74 M75 R76	E68-Q72 WeakPolarHBondContact O-CG 3.46Å; E68-Q72 PolarHBondContact O-N 2.66Å; Q72-T74 PolarHBondContact O-N 2.93Å; Q72-M75 PolarHBondContact O-N 3.43Å; Q72-R76 PolarHBondContact O-N 3Å; Q72-R76 VanDerWaalsContact O-N 3.1Å
73	Q	86.7	Confident	83.9	Confident	110 Å²	110	100.2 Å²	100.2	51%	0.514	51%	0.509	S	S	.	.	H	α-helix	trans	-64.2	-29.1	174.9	-158.1	-155.8	58.2	0	0	112.5	Q69 L71 K77	Q69-Q73 WeakPolarHBondContact O-CB 3.36Å; Q69-Q73 PolarHBondContact O-N 2.94Å; L71-Q73 VanDerWaalsContact C-N 3.34Å; L71-Q73 PolarHBondContact O-N 3.28Å; Q73-K77 WeakPolarHBondContact O-CD 3.36Å; Q73-K77 VanDerWaalsContact O-CG 3.32Å; Q73-K77 WeakPolarHBondContact O-CG 3.38Å; Q73-K77 PolarHBondContact O-N 3.21Å
74	T	76.4	Confident	83.3	Confident	82 Å²	82	100 Å²	100	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-77.2	-38.1	176.7	-56	0	0	0	0	111.5	K70 L71 Q72 K77 A78	K70-T74 WeakPolarHBondContact O-CB 3.45Å; K70-T74 PolarHBondContact O-N 3.48Å; K70-T74 PolarHBondContact O-OG1 2.89Å; L71-T74 CarbonylContact O-C 3.08Å; L71-T74 WeakPolarHBondContact O-CA 3.49Å; L71-T74 WeakPolarHBondContact O-CB 3.41Å; L71-T74 PolarHBondContact O-N 3.49Å; Q72-T74 PolarHBondContact O-N 2.93Å; T74-K77 PolarHBondContact O-N 3.19Å; T74-A78 PolarHBondContact O-N 3.43Å
75	M	81.2	Confident	82.6	Confident	105 Å²	105	101.5 Å²	101.5	52%	0.517	52%	0.516	S	S	.	.	H	α-helix	trans	-61.2	-47.2	173.6	-69.4	176.8	66	0	0	111.6	L71 Q72 K77 A78 E79	L71-M75 HydrophobicContact CG-SD 4.45Å; L71-M75 PolarHBondContact O-N 3.23Å; Q72-M75 PolarHBondContact O-N 3.43Å; M75-K77 PolarHBondContact O-N 3.35Å; M75-K77 VanDerWaalsContact O-N 3.16Å; M75-A78 CarbonylContact O-C 3.56Å; M75-A78 WeakPolarHBondContact O-CA 3.28Å; M75-A78 WeakPolarHBondContact O-CB 3.45Å; M75-A78 PolarHBondContact O-N 2.85Å; M75-E79 WeakPolarHBondContact O-CG 3.42Å; M75-E79 PolarHBondContact O-N 3.39Å
76	R	82.7	Confident	82.1	Confident	161 Å²	161	99.1 Å²	99.1	61%	0.608	52%	0.515	S	S	*	.	H	α-helix	trans	-59.2	-28.9	176	-67.3	179.6	-169.4	160.9	7.9	113.9	Q72 E79	Q72-R76 PolarHBondContact O-N 3Å; Q72-R76 VanDerWaalsContact O-N 3.1Å; R76-E79 WeakPolarHBondContact CA-OE2 3.46Å
77	K	76.5	Confident	81.6	Confident	115 Å²	115	100.3 Å²	100.3	50%	0.5	52%	0.516	S	S	.	.	H	α-helix	trans	-78	-28.4	173.7	-70.2	165.6	-179.8	170.9	0	112.7	Q73 T74 M75 T80	Q73-K77 WeakPolarHBondContact O-CD 3.36Å; Q73-K77 VanDerWaalsContact O-CG 3.32Å; Q73-K77 WeakPolarHBondContact O-CG 3.38Å; Q73-K77 PolarHBondContact O-N 3.21Å; T74-K77 PolarHBondContact O-N 3.19Å; M75-K77 PolarHBondContact O-N 3.35Å; M75-K77 VanDerWaalsContact O-N 3.16Å; K77-T80 PolarHBondContact O-OG1 3.45Å
78	A	72.6	Confident	81.3	Confident	56 Å²	56	102.4 Å²	102.4	46%	0.463	52%	0.52	S	S	.	.	H	α-helix	trans	-74.9	-32.2	172.8	0	0	0	0	0	111.9	T74 M75 T80 L81	T74-A78 PolarHBondContact O-N 3.43Å; M75-A78 CarbonylContact O-C 3.56Å; M75-A78 WeakPolarHBondContact O-CA 3.28Å; M75-A78 WeakPolarHBondContact O-CB 3.45Å; M75-A78 PolarHBondContact O-N 2.85Å; A78-T80 VanDerWaalsContact C-N 3.34Å; A78-T80 PolarHBondContact O-N 3.1Å; A78-L81 VanDerWaalsContact O-CB 3.29Å; A78-L81 WeakPolarHBondContact O-CB 3.5Å; A78-L81 PolarHBondContact O-N 2.91Å
79	E	77.5	Confident	81	Confident	139 Å²	139	101.1 Å²	101.1	65%	0.65	52%	0.522	S	S	*	.	H	α-helix	trans	-62.8	-37.1	173.8	-71.3	160.5	-174.7	0	0	112.2	M75 R76 L81 P82	M75-E79 WeakPolarHBondContact O-CG 3.42Å; M75-E79 PolarHBondContact O-N 3.39Å; R76-E79 WeakPolarHBondContact CA-OE2 3.46Å; E79-L81 VanDerWaalsContact C-N 3.32Å; E79-L81 PolarHBondContact O-N 2.97Å; E79-P82 WeakPolarHBondContact O-CD 3.27Å
80	T	78.4	Confident	80.7	Confident	75 Å²	75	103 Å²	103	46%	0.46	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-6.8	175.7	51.5	0	0	0	0	114.8	K77 A78 E83	K77-T80 PolarHBondContact O-OG1 3.45Å; A78-T80 VanDerWaalsContact C-N 3.34Å; A78-T80 PolarHBondContact O-N 3.1Å; T80-E83 PolarHBondContact O-N 2.95Å
81	L	73.7	Confident	80.6	Confident	86 Å²	86	103.5 Å²	103.5	45%	0.45	53%	0.529	S	S	.	.	H	α-helix	trans	-69.3	-39.7	-170.2	-134	156.1	0	0	0	113.8	A78 E79 E83 V84 E85	A78-L81 VanDerWaalsContact O-CB 3.29Å; A78-L81 WeakPolarHBondContact O-CB 3.5Å; A78-L81 PolarHBondContact O-N 2.91Å; E79-L81 VanDerWaalsContact C-N 3.32Å; E79-L81 PolarHBondContact O-N 2.97Å; L81-E83 VanDerWaalsContact C-N 3.28Å; L81-E83 PolarHBondContact O-N 3.28Å; L81-V84 PolarHBondContact O-N 3.48Å; L81-E85 HydrophobicContact CD2-CG 4.12Å; L81-E85 PolarHBondContact O-N 2.67Å
82	P	76.7	Confident	80.6	Confident	79 Å²	79	103 Å²	103	51%	0.513	53%	0.526	S	S	.	.	H	α-helix	trans	-62.1	-30.4	176.5	-25.3	36.1	0	0	0	114.4	E79 E85 A86	E79-P82 WeakPolarHBondContact O-CD 3.27Å; P82-E85 PolarHBondContact O-N 3.22Å; P82-A86 WeakPolarHBondContact O-CB 3.38Å; P82-A86 PolarHBondContact O-N 3.07Å
83	E	76.6	Confident	80.4	Confident	150 Å²	150	101 Å²	101	70%	0.701	53%	0.527	S	S	*	.	H	α-helix	trans	-68.3	-40.2	176.4	-171.9	174.1	-162.3	0	0	111	T80 L81 A86 E87	T80-E83 PolarHBondContact O-N 2.95Å; L81-E83 VanDerWaalsContact C-N 3.28Å; L81-E83 PolarHBondContact O-N 3.28Å; E83-A86 PolarHBondContact O-N 2.9Å; E83-E87 PolarHBondContact O-N 2.91Å
84	V	77.6	Confident	80.4	Confident	87 Å²	87	98.8 Å²	98.8	53%	0.527	53%	0.528	S	S	.	.	H	α-helix	trans	-68.3	-35.5	173.7	-179.7	0	0	0	0	111.7	L81 L88	L81-V84 PolarHBondContact O-N 3.48Å; V84-L88 VanDerWaalsContact O-CB 3.24Å; V84-L88 WeakPolarHBondContact O-CB 3.31Å; V84-L88 PolarHBondContact O-N 2.91Å
85	E	76.1	Confident	80.5	Confident	112 Å²	112	100 Å²	100	52%	0.523	53%	0.531	S	S	.	.	H	α-helix	trans	-68.1	-37.6	173.9	-71.3	-178.6	163.5	0	0	112.2	L81 P82 L88 S89	L81-E85 HydrophobicContact CD2-CG 4.12Å; L81-E85 PolarHBondContact O-N 2.67Å; P82-E85 PolarHBondContact O-N 3.22Å; E85-L88 PolarHBondContact O-N 2.82Å; E85-S89 WeakPolarHBondContact O-CB 3.3Å; E85-S89 PolarHBondContact O-N 2.88Å; E85-S89 PolarHBondContact O-OG 3.11Å
86	A	84.4	Confident	80.7	Confident	59 Å²	59	98 Å²	98	49%	0.488	53%	0.525	S	S	.	.	H	α-helix	trans	-65.4	-46.4	173.2	0	0	0	0	0	112	P82 E83 L88 S89 Q90	P82-A86 WeakPolarHBondContact O-CB 3.38Å; P82-A86 PolarHBondContact O-N 3.07Å; E83-A86 PolarHBondContact O-N 2.9Å; A86-L88 VanDerWaalsContact C-N 3.33Å; A86-L88 PolarHBondContact O-N 3.41Å; A86-S89 PolarHBondContact O-N 2.96Å; A86-Q90 PolarHBondContact O-N 2.91Å
87	E	81.1	Confident	80.9	Confident	86 Å²	86	96.3 Å²	96.3	40%	0.402	52%	0.522	S	S	.	.	H	α-helix	trans	-63	-40.3	175.8	-158.4	-156.8	-175.3	0	0	111.5	E83 S89 Q90 R91	E83-E87 PolarHBondContact O-N 2.91Å; E87-S89 PolarHBondContact O-N 2.98Å; E87-Q90 PolarHBondContact O-N 3.45Å; E87-R91 VanDerWaalsContact CD-NE 3.33Å; E87-R91 WeakPolarHBondContact O-CB 3.35Å; E87-R91 VanDerWaalsContact O-CG 3.26Å; E87-R91 WeakPolarHBondContact O-CG 3.42Å; E87-R91 PolarHBondContact O-N 2.77Å; E87-R91 IonicContact OE1-CZ 2.96Å; E87-R91 IonicContact OE1-NE 3.73Å; E87-R91 PolarHBondContact OE1-NE 2.89Å; E87-R91 VanDerWaalsContact OE1-NE 3.15Å; E87-R91 IonicContact OE1-NH2 3.04Å; E87-R91 PolarHBondContact OE1-NH2 3.37Å; E87-R91 IonicContact OE2-CZ 2.74Å; E87-R91 IonicContact OE2-NE 3.26Å; E87-R91 IonicContact OE2-NH1 3.52Å; E87-R91 IonicContact OE2-NH2 3.8Å; E87-R91 PolarHBondContact OE2-NH2 2.71Å
88	L	80.2	Confident	81.1	Confident	96 Å²	96	93.3 Å²	93.3	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-41.8	175.2	-178.3	60.4	0	0	0	111.8	V84 E85 A86 R91 I92	V84-L88 VanDerWaalsContact O-CB 3.24Å; V84-L88 WeakPolarHBondContact O-CB 3.31Å; V84-L88 PolarHBondContact O-N 2.91Å; E85-L88 PolarHBondContact O-N 2.82Å; A86-L88 VanDerWaalsContact C-N 3.33Å; A86-L88 PolarHBondContact O-N 3.41Å; L88-R91 PolarHBondContact O-N 2.88Å; L88-I92 HydrophobicContact CD1-CD1 4.32Å; L88-I92 HydrophobicContact CG-CD1 4.04Å; L88-I92 VanDerWaalsContact O-CG1 3.29Å; L88-I92 WeakPolarHBondContact O-CG1 3.43Å; L88-I92 PolarHBondContact O-N 2.94Å
89	S	83.8	Confident	81.3	Confident	75 Å²	75	96 Å²	96	52%	0.524	52%	0.522	S	S	.	.	H	α-helix	trans	-63.1	-42.2	176.1	-59.5	0	0	0	0	111.9	E85 A86 E87 I92 A93	E85-S89 WeakPolarHBondContact O-CB 3.3Å; E85-S89 PolarHBondContact O-N 2.88Å; E85-S89 PolarHBondContact O-OG 3.11Å; A86-S89 PolarHBondContact O-N 2.96Å; E87-S89 PolarHBondContact O-N 2.98Å; S89-I92 PolarHBondContact O-N 2.94Å; S89-A93 PolarHBondContact O-N 2.93Å
90	Q	87.6	Confident	81.6	Confident	144 Å²	144	95 Å²	95	67%	0.673	52%	0.517	S	S	*	.	H	α-helix	trans	-63	-42.3	174.7	-169.4	-177.7	18.9	0	0	111.9	A86 E87 A93 A94	A86-Q90 PolarHBondContact O-N 2.91Å; E87-Q90 PolarHBondContact O-N 3.45Å; Q90-A93 PolarHBondContact O-N 3.31Å; Q90-A94 WeakPolarHBondContact O-CB 3.33Å; Q90-A94 PolarHBondContact O-N 3.06Å
91	R	85.1	Confident	81.8	Confident	146 Å²	146	99.4 Å²	99.4	55%	0.551	53%	0.525	S	S	*	.	H	α-helix	trans	-64.7	-36.4	175.8	-72.1	168	176.6	-172.5	0.9	112.4	E87 L88 L95	E87-R91 VanDerWaalsContact CD-NE 3.33Å; E87-R91 WeakPolarHBondContact O-CB 3.35Å; E87-R91 VanDerWaalsContact O-CG 3.26Å; E87-R91 WeakPolarHBondContact O-CG 3.42Å; E87-R91 PolarHBondContact O-N 2.77Å; E87-R91 IonicContact OE1-CZ 2.96Å; E87-R91 IonicContact OE1-NE 3.73Å; E87-R91 PolarHBondContact OE1-NE 2.89Å; E87-R91 VanDerWaalsContact OE1-NE 3.15Å; E87-R91 IonicContact OE1-NH2 3.04Å; E87-R91 PolarHBondContact OE1-NH2 3.37Å; E87-R91 IonicContact OE2-CZ 2.74Å; E87-R91 IonicContact OE2-NE 3.26Å; E87-R91 IonicContact OE2-NH1 3.52Å; E87-R91 IonicContact OE2-NH2 3.8Å; E87-R91 PolarHBondContact OE2-NH2 2.71Å; L88-R91 PolarHBondContact O-N 2.88Å; R91-L95 PolarHBondContact O-N 2.85Å
92	I	86.8	Confident	82.1	Confident	95 Å²	95	100.5 Å²	100.5	49%	0.487	53%	0.528	S	S	.	.	H	α-helix	trans	-66	-48.2	174.7	-71.1	163.9	0	0	0	110.6	L88 S89 A94 L95 T96	L88-I92 HydrophobicContact CD1-CD1 4.32Å; L88-I92 HydrophobicContact CG-CD1 4.04Å; L88-I92 VanDerWaalsContact O-CG1 3.29Å; L88-I92 WeakPolarHBondContact O-CG1 3.43Å; L88-I92 PolarHBondContact O-N 2.94Å; S89-I92 PolarHBondContact O-N 2.94Å; I92-A94 VanDerWaalsContact C-N 3.28Å; I92-A94 PolarHBondContact O-N 3.37Å; I92-L95 WeakPolarHBondContact O-CA 3.3Å; I92-L95 VanDerWaalsContact O-CB 3.3Å; I92-L95 WeakPolarHBondContact O-CB 3.46Å; I92-L95 PolarHBondContact O-N 3.4Å; I92-T96 PolarHBondContact O-N 3.49Å; I92-T96 PolarHBondContact O-OG1 2.97Å
93	A	87.8	Confident	82.3	Confident	63 Å²	63	98 Å²	98	52%	0.521	52%	0.517	S	S	.	.	H	α-helix	trans	-60.7	-37.3	177.6	0	0	0	0	0	112.6	S89 Q90 L95 K97	S89-A93 PolarHBondContact O-N 2.93Å; Q90-A93 PolarHBondContact O-N 3.31Å; A93-L95 VanDerWaalsContact C-N 3.32Å; A93-K97 PolarHBondContact O-N 2.83Å
94	A	86.1	Confident	82.7	Confident	64 Å²	64	96.3 Å²	96.3	53%	0.529	51%	0.512	S	S	.	.	H	α-helix	trans	-66.9	-31.1	172.8	0	0	0	0	0	113.1	Q90 I92 A98	Q90-A94 WeakPolarHBondContact O-CB 3.33Å; Q90-A94 PolarHBondContact O-N 3.06Å; I92-A94 VanDerWaalsContact C-N 3.28Å; I92-A94 PolarHBondContact O-N 3.37Å; A94-A98 PolarHBondContact O-N 2.95Å
95	L	79	Confident	83.1	Confident	107 Å²	107	96.8 Å²	96.8	56%	0.56	51%	0.511	S	S	*	.	H	α-helix	trans	-70.1	-49.3	176.1	-155.3	90.5	0	0	0	111.2	R91 I92 A93 K97 A98 E99	R91-L95 PolarHBondContact O-N 2.85Å; I92-L95 WeakPolarHBondContact O-CA 3.3Å; I92-L95 VanDerWaalsContact O-CB 3.3Å; I92-L95 WeakPolarHBondContact O-CB 3.46Å; I92-L95 PolarHBondContact O-N 3.4Å; A93-L95 VanDerWaalsContact C-N 3.32Å; L95-K97 VanDerWaalsContact C-N 3.29Å; L95-K97 PolarHBondContact O-N 3.17Å; L95-A98 CarbonylContact O-C 3.57Å; L95-A98 WeakPolarHBondContact O-CA 3.34Å; L95-A98 WeakPolarHBondContact O-CB 3.44Å; L95-A98 PolarHBondContact O-N 2.91Å; L95-E99 WeakPolarHBondContact O-CG 3.38Å; L95-E99 PolarHBondContact O-N 3.02Å
96	T	85	Confident	83.5	Confident	64 Å²	64	96.1 Å²	96.1	39%	0.393	51%	0.508	S	S	.	.	H	α-helix	trans	-59	-41	178.6	-56.4	0	0	0	0	111.6	I92 A98 E99 E100	I92-T96 PolarHBondContact O-N 3.49Å; I92-T96 PolarHBondContact O-OG1 2.97Å; T96-A98 PolarHBondContact O-N 3.47Å; T96-E99 WeakPolarHBondContact CA-OE2 3.49Å; T96-E99 PolarHBondContact O-N 2.96Å; T96-E100 WeakPolarHBondContact O-CG 3.43Å; T96-E100 PolarHBondContact O-N 2.9Å
97	K	86.9	Confident	83.7	Confident	124 Å²	124	99.7 Å²	99.7	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-66	-16.8	173.9	-169.4	164.6	-173.8	166.3	0	114.3	A93 L95 R101	A93-K97 PolarHBondContact O-N 2.83Å; L95-K97 VanDerWaalsContact C-N 3.29Å; L95-K97 PolarHBondContact O-N 3.17Å; K97-R101 VanDerWaalsContact O-CD 3.3Å; K97-R101 WeakPolarHBondContact O-CD 3.38Å; K97-R101 WeakPolarHBondContact O-CG 3.49Å
98	A	79.8	Confident	84.2	Confident	53 Å²	53	100.8 Å²	100.8	44%	0.438	52%	0.519	S	S	.	.	H	α-helix	trans	-89.2	-32.9	170.1	0	0	0	0	0	112.1	A94 L95 T96 R101 H102	A94-A98 PolarHBondContact O-N 2.95Å; L95-A98 CarbonylContact O-C 3.57Å; L95-A98 WeakPolarHBondContact O-CA 3.34Å; L95-A98 WeakPolarHBondContact O-CB 3.44Å; L95-A98 PolarHBondContact O-N 2.91Å; T96-A98 PolarHBondContact O-N 3.47Å; A98-R101 PolarHBondContact O-N 3.02Å; A98-H102 PolarHBondContact O-N 3.42Å; A98-H102 VanDerWaalsContact O-N 3.09Å
99	E	76.9	Confident	84.6	Confident	113 Å²	113	100.5 Å²	100.5	53%	0.528	52%	0.518	S	S	.	.	H	α-helix	trans	-66.2	-43.9	174.3	-67.9	170.3	148.5	0	0	111.3	L95 T96 R101 H102 G103	L95-E99 WeakPolarHBondContact O-CG 3.38Å; L95-E99 PolarHBondContact O-N 3.02Å; T96-E99 WeakPolarHBondContact CA-OE2 3.49Å; T96-E99 PolarHBondContact O-N 2.96Å; E99-R101 VanDerWaalsContact C-N 3.33Å; E99-R101 PolarHBondContact O-N 3.22Å; E99-H102 WeakPolarHBondContact O-CA 3.34Å; E99-H102 WeakPolarHBondContact O-CB 3.26Å; E99-H102 PolarHBondContact O-N 2.81Å; E99-G103 PolarHBondContact O-N 3.31Å
100	E	84.3	Confident	84.9	Confident	118 Å²	118	104.9 Å²	104.9	55%	0.551	52%	0.523	S	S	*	.	H	α-helix	trans	-52.5	-49.3	171.2	-71.7	166.9	175.7	0	0	111.8	T96 H102 G103 N104	T96-E100 WeakPolarHBondContact O-CG 3.43Å; T96-E100 PolarHBondContact O-N 2.9Å; E100-H102 PolarHBondContact O-N 3.03Å; E100-G103 PolarHBondContact O-N 2.98Å; E100-N104 PolarHBondContact O-N 3.05Å; E100-N104 PolarHBondContact O-OD1 3.33Å; E100-N104 VanDerWaalsContact O-OD1 3.14Å
101	R	83.1	Confident	85.1	Confident	166 Å²	166	103.9 Å²	103.9	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-63.8	-28.1	177.4	-70.3	170.3	172.5	178.2	-6.5	112.9	K97 A98 E99 I105	K97-R101 VanDerWaalsContact O-CD 3.3Å; K97-R101 WeakPolarHBondContact O-CD 3.38Å; K97-R101 WeakPolarHBondContact O-CG 3.49Å; A98-R101 PolarHBondContact O-N 3.02Å; E99-R101 VanDerWaalsContact C-N 3.33Å; E99-R101 PolarHBondContact O-N 3.22Å; R101-I105 WeakPolarHBondContact O-CD1 3.34Å; R101-I105 WeakPolarHBondContact O-CG1 3.31Å
102	H	79.1	Confident	85.4	Confident	110 Å²	110	100.8 Å²	100.8	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-73.4	-41.9	176	-152.7	64.2	0	0	0	110.9	A98 E99 E100 N104 I105 E106	A98-H102 PolarHBondContact O-N 3.42Å; A98-H102 VanDerWaalsContact O-N 3.09Å; E99-H102 WeakPolarHBondContact O-CA 3.34Å; E99-H102 WeakPolarHBondContact O-CB 3.26Å; E99-H102 PolarHBondContact O-N 2.81Å; E100-H102 PolarHBondContact O-N 3.03Å; H102-N104 PolarHBondContact O-N 3.36Å; H102-I105 WeakPolarHBondContact O-CA 3.45Å; H102-I105 WeakPolarHBondContact O-CB 3.48Å; H102-I105 PolarHBondContact O-N 3.33Å; H102-E106 IonicContact CD2-OE1 2.73Å; H102-E106 PolarHBondContact CD2-OE1 3.35Å; H102-E106 IonicContact NE2-OE1 2.86Å; H102-E106 PolarHBondContact O-N 3.42Å
103	G	81	Confident	85.5	Confident	27 Å²	27	102.5 Å²	102.5	28%	0.278	52%	0.518	S	S	.	.	H	α-helix	trans	-53.9	-49.5	175.3	0	0	0	0	0	112.7	E99 E100 I105 E106 E107	E99-G103 PolarHBondContact O-N 3.31Å; E100-G103 PolarHBondContact O-N 2.98Å; G103-I105 PolarHBondContact O-N 2.93Å; G103-E106 PolarHBondContact O-N 3.02Å; G103-E106 VanDerWaalsContact O-N 3.11Å; G103-E107 PolarHBondContact O-N 2.89Å
104	N	85.2	Confident	85.8	Confident	114 Å²	114	101.6 Å²	101.6	61%	0.61	52%	0.515	S	S	*	.	H	α-helix	trans	-59.9	-30.1	176.7	-66.8	39.9	0	0	0	113.2	E100 H102 H108	E100-N104 PolarHBondContact O-N 3.05Å; E100-N104 PolarHBondContact O-OD1 3.33Å; E100-N104 VanDerWaalsContact O-OD1 3.14Å; H102-N104 PolarHBondContact O-N 3.36Å; N104-H108 WeakPolarHBondContact O-CB 3.38Å; N104-H108 PolarHBondContact O-N 3.31Å
105	I	86.1	Confident	86.1	Confident	97 Å²	97	103.2 Å²	103.2	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-77.9	-39.6	176.4	-65.6	166.9	0	0	0	110.6	R101 H102 G103 E107 H108 L109	R101-I105 WeakPolarHBondContact O-CD1 3.34Å; R101-I105 WeakPolarHBondContact O-CG1 3.31Å; H102-I105 WeakPolarHBondContact O-CA 3.45Å; H102-I105 WeakPolarHBondContact O-CB 3.48Å; H102-I105 PolarHBondContact O-N 3.33Å; G103-I105 PolarHBondContact O-N 2.93Å; I105-E107 VanDerWaalsContact C-N 3.33Å; I105-H108 PolarHBondContact O-N 2.83Å; I105-L109 HydrophobicContact CG2-CD1 4.11Å; I105-L109 WeakPolarHBondContact O-CB 3.34Å; I105-L109 WeakPolarHBondContact O-CG 3.46Å; I105-L109 PolarHBondContact O-N 3.48Å
106	E	84.4	Confident	86.7	Confident	98 Å²	98	103.3 Å²	103.3	46%	0.458	51%	0.512	S	S	.	.	H	α-helix	trans	-62.6	-38.2	173.3	-70.2	-174.4	-176.8	0	0	112.1	H102 G103 R110	H102-E106 IonicContact CD2-OE1 2.73Å; H102-E106 PolarHBondContact CD2-OE1 3.35Å; H102-E106 IonicContact NE2-OE1 2.86Å; H102-E106 PolarHBondContact O-N 3.42Å; G103-E106 PolarHBondContact O-N 3.02Å; G103-E106 VanDerWaalsContact O-N 3.11Å; E106-R110 VanDerWaalsContact O-CB 3.32Å; E106-R110 WeakPolarHBondContact O-CB 3.36Å; E106-R110 PolarHBondContact O-N 3.09Å
107	E	89.7	Confident	87.1	Confident	134 Å²	134	104.9 Å²	104.9	63%	0.626	52%	0.515	S	S	*	.	H	α-helix	trans	-66	-45.1	174.4	-72	-176.2	167.2	0	0	112	G103 I105 L109 R110 Q111	G103-E107 PolarHBondContact O-N 2.89Å; I105-E107 VanDerWaalsContact C-N 3.33Å; E107-L109 PolarHBondContact O-N 3.33Å; E107-R110 PolarHBondContact O-N 2.96Å; E107-Q111 PolarHBondContact O-N 3.41Å
108	H	90.5	Very high	87.4	Confident	108 Å²	108	105.2 Å²	105.2	50%	0.5	52%	0.518	S	S	.	.	H	α-helix	trans	-64.2	-39.3	176.3	-173.2	-90.6	0	0	0	112.3	N104 I105 Q111 L112	N104-H108 WeakPolarHBondContact O-CB 3.38Å; N104-H108 PolarHBondContact O-N 3.31Å; I105-H108 PolarHBondContact O-N 2.83Å; H108-Q111 PolarHBondContact O-N 2.88Å; H108-L112 WeakPolarHBondContact O-CG 3.29Å; H108-L112 PolarHBondContact O-N 2.74Å
109	L	88.1	Confident	88	Confident	91 Å²	91	109.9 Å²	109.9	48%	0.476	53%	0.529	S	S	.	.	H	α-helix	trans	-62	-47.8	173	-77	169.1	0	0	0	111.4	I105 E107 Q111 L112 E113	I105-L109 HydrophobicContact CG2-CD1 4.11Å; I105-L109 WeakPolarHBondContact O-CB 3.34Å; I105-L109 WeakPolarHBondContact O-CG 3.46Å; I105-L109 PolarHBondContact O-N 3.48Å; E107-L109 PolarHBondContact O-N 3.33Å; L109-Q111 PolarHBondContact O-N 3.44Å; L109-L112 PolarHBondContact O-N 3.11Å; L109-L112 VanDerWaalsContact O-N 3.08Å; L109-E113 WeakPolarHBondContact O-CG 3.49Å; L109-E113 PolarHBondContact O-N 2.9Å
110	R	90.2	Very high	88.8	Confident	166 Å²	166	108.3 Å²	108.3	63%	0.626	52%	0.524	S	S	*	.	H	α-helix	trans	-58.8	-34.9	176.6	-169	-170.2	-53.6	-96.8	-2.7	112.4	E106 E107 G114	E106-R110 VanDerWaalsContact O-CB 3.32Å; E106-R110 WeakPolarHBondContact O-CB 3.36Å; E106-R110 PolarHBondContact O-N 3.09Å; E107-R110 PolarHBondContact O-N 2.96Å; R110-G114 PolarHBondContact O-N 2.66Å; R110-G114 VanDerWaalsContact O-N 3.13Å
111	Q	92.3	Very high	89.2	Confident	124 Å²	124	106.7 Å²	106.7	58%	0.579	52%	0.517	S	S	*	.	H	α-helix	trans	-68.6	-42.4	174.7	-169.1	177.4	15.7	0	0	112.1	E107 H108 L109 G114 Q115	E107-Q111 PolarHBondContact O-N 3.41Å; H108-Q111 PolarHBondContact O-N 2.88Å; L109-Q111 PolarHBondContact O-N 3.44Å; Q111-G114 PolarHBondContact O-N 2.76Å; Q111-Q115 WeakPolarHBondContact O-CG 3.41Å; Q111-Q115 PolarHBondContact O-N 2.85Å; Q111-Q115 VanDerWaalsContact O-N 3.08Å
112	L	92.1	Very high	89.7	Confident	81 Å²	81	102.2 Å²	102.2	42%	0.424	50%	0.502	S	S	.	.	H	α-helix	trans	-66.1	-39.3	175	-70.2	174.3	0	0	0	112.4	H108 L109 G114 Q115 L116	H108-L112 WeakPolarHBondContact O-CG 3.29Å; H108-L112 PolarHBondContact O-N 2.74Å; L109-L112 PolarHBondContact O-N 3.11Å; L109-L112 VanDerWaalsContact O-N 3.08Å; L112-G114 VanDerWaalsContact C-N 3.34Å; L112-G114 PolarHBondContact O-N 3.38Å; L112-Q115 PolarHBondContact O-N 3.35Å; L112-L116 WeakPolarHBondContact O-CB 3.31Å; L112-L116 PolarHBondContact O-N 3.03Å
113	E	89.1	Confident	90.3	Very high	131 Å²	131	100.3 Å²	100.3	61%	0.612	50%	0.496	S	S	*	.	H	α-helix	trans	-59.2	-44	173.5	-72.5	174.8	158.2	0	0	111.3	L109 L116 E117	L109-E113 WeakPolarHBondContact O-CG 3.49Å; L109-E113 PolarHBondContact O-N 2.9Å; E113-L116 PolarHBondContact O-N 3.42Å; E113-E117 PolarHBondContact O-N 3.32Å
114	G	93.5	Very high	90.8	Very high	44 Å²	44	101.7 Å²	101.7	45%	0.454	50%	0.504	S	S	.	.	H	α-helix	trans	-62.2	-42.6	175	0	0	0	0	0	113.5	R110 Q111 L112 E117 E118	R110-G114 PolarHBondContact O-N 2.66Å; R110-G114 VanDerWaalsContact O-N 3.13Å; Q111-G114 PolarHBondContact O-N 2.76Å; L112-G114 VanDerWaalsContact C-N 3.34Å; L112-G114 PolarHBondContact O-N 3.38Å; G114-E117 PolarHBondContact O-N 3.2Å; G114-E118 PolarHBondContact O-N 3.07Å
115	Q	92.5	Very high	91.4	Very high	98 Å²	98	101.1 Å²	101.1	46%	0.458	49%	0.494	S	S	.	.	H	α-helix	trans	-64.9	-39.4	175.2	-71	178.6	9.9	0	0	112.1	Q111 L112 E118 K119	Q111-Q115 WeakPolarHBondContact O-CG 3.41Å; Q111-Q115 PolarHBondContact O-N 2.85Å; Q111-Q115 VanDerWaalsContact O-N 3.08Å; L112-Q115 PolarHBondContact O-N 3.35Å; Q115-E118 PolarHBondContact O-N 2.9Å; Q115-K119 WeakPolarHBondContact O-CB 3.36Å; Q115-K119 WeakPolarHBondContact O-CG 3.26Å; Q115-K119 PolarHBondContact O-N 2.89Å
116	L	91.7	Very high	91.7	Very high	108 Å²	108	99.6 Å²	99.6	57%	0.565	49%	0.489	S	S	*	.	H	α-helix	trans	-64.4	-41.2	177.4	-178.4	61.3	0	0	0	111.4	L112 E113 K119 N120	L112-L116 WeakPolarHBondContact O-CB 3.31Å; L112-L116 PolarHBondContact O-N 3.03Å; E113-L116 PolarHBondContact O-N 3.42Å; L116-K119 PolarHBondContact O-N 3.42Å; L116-N120 WeakPolarHBondContact O-CB 3.47Å; L116-N120 VanDerWaalsContact O-CG 3.32Å; L116-N120 PolarHBondContact O-N 2.9Å; L116-N120 PolarHBondContact O-ND2 3.43Å
117	E	92.4	Very high	92.1	Very high	97 Å²	97	102 Å²	102	45%	0.453	49%	0.494	S	S	.	.	H	α-helix	trans	-65.1	-44.2	176	179.2	52.5	-153.5	0	0	112.1	E113 G114 K119 N120 Q121	E113-E117 PolarHBondContact O-N 3.32Å; G114-E117 PolarHBondContact O-N 3.2Å; E117-K119 VanDerWaalsContact C-N 3.32Å; E117-K119 PolarHBondContact O-N 2.91Å; E117-N120 PolarHBondContact O-N 2.92Å; E117-Q121 WeakPolarHBondContact O-CG 3.29Å; E117-Q121 PolarHBondContact O-N 3.37Å; E117-Q121 WeakPolarHBondContact OE1-CG 3.42Å; E117-Q121 PolarHBondContact OE1-NE2 2.97Å
118	E	93.3	Very high	92.2	Very high	131 Å²	131	102.7 Å²	102.7	61%	0.612	50%	0.497	S	S	*	.	H	α-helix	trans	-58.5	-43.5	174	-175	-179	-159.6	0	0	111.9	G114 Q115 Q121 E122	G114-E118 PolarHBondContact O-N 3.07Å; Q115-E118 PolarHBondContact O-N 2.9Å; E118-Q121 PolarHBondContact O-N 3.37Å; E118-E122 PolarHBondContact O-N 3.24Å
119	K	92.2	Very high	92.4	Very high	152 Å²	152	104.3 Å²	104.3	66%	0.661	50%	0.499	S	S	*	.	H	α-helix	trans	-65.7	-39.2	176.8	-68.2	-71.7	179.2	-179.5	0	112.4	Q115 L116 E117 Q121 E122 L123	Q115-K119 WeakPolarHBondContact O-CB 3.36Å; Q115-K119 WeakPolarHBondContact O-CG 3.26Å; Q115-K119 PolarHBondContact O-N 2.89Å; L116-K119 PolarHBondContact O-N 3.42Å; E117-K119 VanDerWaalsContact C-N 3.32Å; E117-K119 PolarHBondContact O-N 2.91Å; K119-Q121 VanDerWaalsContact C-N 3.34Å; K119-E122 PolarHBondContact O-N 3.46Å; K119-L123 VanDerWaalsContact O-CB 3.29Å; K119-L123 WeakPolarHBondContact O-CB 3.44Å; K119-L123 PolarHBondContact O-N 3.49Å
120	N	93.2	Very high	92.5	Very high	79 Å²	79	105.6 Å²	105.6	42%	0.422	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-42	173.7	-79.2	-30.5	0	0	0	111.7	L116 E117 L123 A124	L116-N120 WeakPolarHBondContact O-CB 3.47Å; L116-N120 VanDerWaalsContact O-CG 3.32Å; L116-N120 PolarHBondContact O-N 2.9Å; L116-N120 PolarHBondContact O-ND2 3.43Å; E117-N120 PolarHBondContact O-N 2.92Å; N120-L123 PolarHBondContact O-N 3Å; N120-A124 PolarHBondContact O-N 3.3Å
121	Q	94.6	Very high	92.6	Very high	85 Å²	85	103.7 Å²	103.7	40%	0.397	50%	0.499	S	S	.	.	H	α-helix	trans	-67	-41.9	177.6	-68.1	179.3	21.9	0	0	112.6	E117 E118 K119 A124 R125	E117-Q121 WeakPolarHBondContact O-CG 3.29Å; E117-Q121 PolarHBondContact O-N 3.37Å; E117-Q121 WeakPolarHBondContact OE1-CG 3.42Å; E117-Q121 PolarHBondContact OE1-NE2 2.97Å; E118-Q121 PolarHBondContact O-N 3.37Å; K119-Q121 VanDerWaalsContact C-N 3.34Å; Q121-A124 WeakPolarHBondContact O-CB 3.46Å; Q121-A124 PolarHBondContact O-N 3.39Å; Q121-R125 WeakPolarHBondContact O-CG 3.34Å; Q121-R125 PolarHBondContact O-N 2.97Å
122	E	93.4	Very high	92.7	Very high	71 Å²	71	104.1 Å²	104.1	33%	0.332	50%	0.502	S	S	.	.	H	α-helix	trans	-68.3	-37.1	175.1	-169.2	58	-148.5	0	0	111.7	E118 K119 A124 R125 V126 R129	E118-E122 PolarHBondContact O-N 3.24Å; K119-E122 PolarHBondContact O-N 3.46Å; E122-A124 VanDerWaalsContact C-N 3.28Å; E122-A124 PolarHBondContact O-N 3.37Å; E122-R125 WeakPolarHBondContact O-CB 3.35Å; E122-R125 PolarHBondContact O-N 2.93Å; E122-R125 VanDerWaalsContact O-N 3.1Å; E122-R125 WeakPolarHBondContact OE2-CD 3.49Å; E122-R125 IonicContact OE2-CZ 3.72Å; E122-R125 IonicContact OE2-NE 3.22Å; E122-R125 IonicContact OE2-NH1 2.75Å; E122-R125 PolarHBondContact OE2-NH1 3.34Å; E122-V126 HydrophobicContact CG-CG2 4.49Å; E122-V126 WeakPolarHBondContact O-CG2 3.36Å; E122-V126 PolarHBondContact O-N 3.49Å; E122-R129 IonicContact OE1-CZ 3.71Å; E122-R129 IonicContact OE1-NH1 3.71Å; E122-R129 PolarHBondContact OE1-NH1 3.02Å; E122-R129 IonicContact OE1-NH2 3.92Å
123	L	91.8	Very high	92.8	Very high	71 Å²	71	105 Å²	105	37%	0.372	51%	0.507	S	S	.	.	H	α-helix	trans	-60.2	-37.1	172.7	-179.2	60.7	0	0	0	112	K119 N120 V126 R127	K119-L123 VanDerWaalsContact O-CB 3.29Å; K119-L123 WeakPolarHBondContact O-CB 3.44Å; K119-L123 PolarHBondContact O-N 3.49Å; N120-L123 PolarHBondContact O-N 3Å; L123-V126 PolarHBondContact O-N 2.91Å; L123-R127 WeakPolarHBondContact O-CB 3.25Å; L123-R127 WeakPolarHBondContact O-CG 3.35Å; L123-R127 PolarHBondContact O-N 3.11Å
124	A	91.4	Very high	93	Very high	55 Å²	55	104.9 Å²	104.9	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-65.5	-41.6	172.5	0	0	0	0	0	112.3	N120 Q121 E122 R127 Q128	N120-A124 PolarHBondContact O-N 3.3Å; Q121-A124 WeakPolarHBondContact O-CB 3.46Å; Q121-A124 PolarHBondContact O-N 3.39Å; E122-A124 VanDerWaalsContact C-N 3.28Å; E122-A124 PolarHBondContact O-N 3.37Å; A124-R127 PolarHBondContact O-N 3.39Å; A124-Q128 PolarHBondContact O-N 2.92Å
125	R	96.1	Very high	93	Very high	102 Å²	102	106.2 Å²	106.2	39%	0.385	50%	0.504	S	S	.	.	H	α-helix	trans	-64.5	-39.9	174.9	-64.9	173.5	-154.8	120	5.3	111.9	Q121 E122 Q128 R129	Q121-R125 WeakPolarHBondContact O-CG 3.34Å; Q121-R125 PolarHBondContact O-N 2.97Å; E122-R125 WeakPolarHBondContact O-CB 3.35Å; E122-R125 PolarHBondContact O-N 2.93Å; E122-R125 VanDerWaalsContact O-N 3.1Å; E122-R125 WeakPolarHBondContact OE2-CD 3.49Å; E122-R125 IonicContact OE2-CZ 3.72Å; E122-R125 IonicContact OE2-NE 3.22Å; E122-R125 IonicContact OE2-NH1 2.75Å; E122-R125 PolarHBondContact OE2-NH1 3.34Å; R125-Q128 PolarHBondContact O-N 2.63Å; R125-R129 WeakPolarHBondContact O-CG 3.33Å; R125-R129 PolarHBondContact O-N 3.21Å
126	V	93.3	Very high	93.1	Very high	66 Å²	66	106.3 Å²	106.3	40%	0.4	50%	0.504	S	S	.	.	H	α-helix	trans	-63.1	-50.2	175.1	171.2	0	0	0	0	110.8	E122 L123 Q128 R129 E130	E122-V126 HydrophobicContact CG-CG2 4.49Å; E122-V126 WeakPolarHBondContact O-CG2 3.36Å; E122-V126 PolarHBondContact O-N 3.49Å; L123-V126 PolarHBondContact O-N 2.91Å; V126-Q128 PolarHBondContact O-N 2.93Å; V126-R129 WeakPolarHBondContact O-CB 3.24Å; V126-R129 PolarHBondContact O-N 2.72Å; V126-E130 WeakPolarHBondContact O-CB 3.45Å; V126-E130 PolarHBondContact O-N 2.99Å
127	R	92.2	Very high	93.1	Very high	149 Å²	149	105.8 Å²	105.8	56%	0.562	50%	0.501	S	S	*	.	H	α-helix	trans	-57.9	-34.3	175.4	-74.9	170.7	173.3	153	-1.8	113.1	L123 A124 K131	L123-R127 WeakPolarHBondContact O-CB 3.25Å; L123-R127 WeakPolarHBondContact O-CG 3.35Å; L123-R127 PolarHBondContact O-N 3.11Å; A124-R127 PolarHBondContact O-N 3.39Å; R127-K131 WeakPolarHBondContact O-CB 3.48Å; R127-K131 PolarHBondContact O-N 2.74Å
128	Q	93.4	Very high	93.3	Very high	148 Å²	148	107.4 Å²	107.4	69%	0.692	51%	0.507	S	S	*	.	H	α-helix	trans	-70	-39.1	174.9	-170.9	176.6	2	0	0	112.5	A124 R125 V126 M132	A124-Q128 PolarHBondContact O-N 2.92Å; R125-Q128 PolarHBondContact O-N 2.63Å; V126-Q128 PolarHBondContact O-N 2.93Å; Q128-M132 WeakPolarHBondContact O-CB 3.37Å; Q128-M132 PolarHBondContact O-N 2.81Å; Q128-M132 VanDerWaalsContact O-N 3.1Å
129	R	93.3	Very high	93.3	Very high	142 Å²	142	108.9 Å²	108.9	54%	0.536	51%	0.507	S	S	.	.	H	α-helix	trans	-65.1	-43	173	-68.3	170.5	-176.6	134.4	0.6	111.3	E122 R125 V126 M132 N133	E122-R129 IonicContact OE1-CZ 3.71Å; E122-R129 IonicContact OE1-NH1 3.71Å; E122-R129 PolarHBondContact OE1-NH1 3.02Å; E122-R129 IonicContact OE1-NH2 3.92Å; R125-R129 WeakPolarHBondContact O-CG 3.33Å; R125-R129 PolarHBondContact O-N 3.21Å; V126-R129 WeakPolarHBondContact O-CB 3.24Å; V126-R129 PolarHBondContact O-N 2.72Å; R129-M132 PolarHBondContact O-N 3.38Å; R129-N133 PolarHBondContact O-N 3.29Å
130	E	89.8	Confident	93.4	Very high	117 Å²	117	105.8 Å²	105.8	55%	0.547	50%	0.497	S	S	.	.	H	α-helix	trans	-58.9	-55.4	177	-179.6	171.6	-131.3	0	0	111	V126 M132 N133 E134	V126-E130 WeakPolarHBondContact O-CB 3.45Å; V126-E130 PolarHBondContact O-N 2.99Å; E130-M132 VanDerWaalsContact C-N 3.3Å; E130-M132 PolarHBondContact O-N 2.9Å; E130-N133 CarbonylContact O-C 3.56Å; E130-N133 WeakPolarHBondContact O-CA 3.4Å; E130-N133 WeakPolarHBondContact O-CB 3.32Å; E130-N133 PolarHBondContact O-N 2.96Å; E130-E134 PolarHBondContact O-N 3.35Å
131	K	93.6	Very high	93.4	Very high	127 Å²	127	104.8 Å²	104.8	55%	0.552	50%	0.496	S	S	*	.	H	α-helix	trans	-56.2	-41.3	175.4	-179.3	177.5	177.4	179.4	0	113	R127 N133 E134 D135	R127-K131 WeakPolarHBondContact O-CB 3.48Å; R127-K131 PolarHBondContact O-N 2.74Å; K131-N133 VanDerWaalsContact C-N 3.25Å; K131-N133 PolarHBondContact O-N 3.48Å; K131-E134 PolarHBondContact O-N 3.16Å; K131-D135 WeakPolarHBondContact O-CB 3.4Å; K131-D135 PolarHBondContact O-N 2.99Å
132	M	93.6	Very high	93.4	Very high	132 Å²	132	105 Å²	105	65%	0.65	50%	0.5	S	S	*	.	H	α-helix	trans	-62.5	-35.3	176.2	-175.8	-171.4	72.6	0	0	111.7	Q128 R129 E130 H136	Q128-M132 WeakPolarHBondContact O-CB 3.37Å; Q128-M132 PolarHBondContact O-N 2.81Å; Q128-M132 VanDerWaalsContact O-N 3.1Å; R129-M132 PolarHBondContact O-N 3.38Å; E130-M132 VanDerWaalsContact C-N 3.3Å; E130-M132 PolarHBondContact O-N 2.9Å; M132-H136 WeakPolarHBondContact O-CB 3.47Å; M132-H136 PolarHBondContact O-N 3.48Å
133	N	93.8	Very high	93.5	Very high	100 Å²	100	105.3 Å²	105.3	54%	0.535	51%	0.507	S	S	.	.	H	α-helix	trans	-72.7	-38.3	175.6	-165.8	44.6	0	0	0	111.9	R129 E130 K131 H136 N137	R129-N133 PolarHBondContact O-N 3.29Å; E130-N133 CarbonylContact O-C 3.56Å; E130-N133 WeakPolarHBondContact O-CA 3.4Å; E130-N133 WeakPolarHBondContact O-CB 3.32Å; E130-N133 PolarHBondContact O-N 2.96Å; K131-N133 VanDerWaalsContact C-N 3.25Å; K131-N133 PolarHBondContact O-N 3.48Å; N133-H136 PolarHBondContact O-N 2.89Å; N133-N137 VanDerWaalsContact O-CB 3.24Å; N133-N137 WeakPolarHBondContact O-CB 3.34Å; N133-N137 PolarHBondContact O-N 3.34Å
134	E	93.4	Very high	93.7	Very high	128 Å²	128	105.7 Å²	105.7	60%	0.598	51%	0.512	S	S	*	.	H	α-helix	trans	-60.3	-50.2	170.3	-65.3	-177.9	134.4	0	0	111.6	E130 K131 H136 N137 K138	E130-E134 PolarHBondContact O-N 3.35Å; K131-E134 PolarHBondContact O-N 3.16Å; E134-H136 PolarHBondContact O-N 2.77Å; E134-N137 PolarHBondContact O-N 3.16Å; E134-K138 VanDerWaalsContact O-CB 3.28Å; E134-K138 WeakPolarHBondContact O-CB 3.49Å; E134-K138 PolarHBondContact O-N 2.99Å
135	D	93.5	Very high	93.8	Very high	73 Å²	73	108 Å²	108	39%	0.39	52%	0.517	S	S	.	.	H	α-helix	trans	-60	-31	177.3	-87.3	-34.6	0	0	0	112.2	K131 R139	K131-D135 WeakPolarHBondContact O-CB 3.4Å; K131-D135 PolarHBondContact O-N 2.99Å; D135-R139 WeakPolarHBondContact O-CD 3.24Å; D135-R139 WeakPolarHBondContact O-CG 3.48Å; D135-R139 PolarHBondContact O-NE 3.39Å
136	H	94.7	Very high	93.7	Very high	100 Å²	100	111.3 Å²	111.3	46%	0.463	53%	0.529	S	S	.	.	H	α-helix	trans	-77.6	-49.2	174.6	177.6	-125.1	0	0	0	112	M132 N133 E134 K138 R139 L140	M132-H136 WeakPolarHBondContact O-CB 3.47Å; M132-H136 PolarHBondContact O-N 3.48Å; N133-H136 PolarHBondContact O-N 2.89Å; E134-H136 PolarHBondContact O-N 2.77Å; H136-K138 VanDerWaalsContact C-N 3.3Å; H136-K138 PolarHBondContact O-N 3.25Å; H136-R139 WeakPolarHBondContact O-CB 3.44Å; H136-R139 PolarHBondContact O-N 3.06Å; H136-R139 VanDerWaalsContact O-N 3.12Å; H136-L140 PolarHBondContact O-N 2.92Å; H136-L140 VanDerWaalsContact O-N 3.08Å
137	N	93.3	Very high	93.8	Very high	96 Å²	96	113.1 Å²	113.1	51%	0.513	54%	0.536	S	S	.	.	H	α-helix	trans	-61.8	-39.7	-179.4	-161.9	16	0	0	0	111.1	N133 E134 R139 L140 S141	N133-N137 VanDerWaalsContact O-CB 3.24Å; N133-N137 WeakPolarHBondContact O-CB 3.34Å; N133-N137 PolarHBondContact O-N 3.34Å; E134-N137 PolarHBondContact O-N 3.16Å; N137-R139 PolarHBondContact O-N 3.35Å; N137-L140 WeakPolarHBondContact O-CB 3.41Å; N137-L140 PolarHBondContact O-N 3.37Å; N137-L140 VanDerWaalsContact O-N 3.16Å; N137-S141 PolarHBondContact O-N 2.92Å; N137-S141 PolarHBondContact O-OG 2.95Å
138	K	95	Very high	93.9	Very high	131 Å²	131	111 Å²	111	57%	0.57	54%	0.536	S	S	*	.	H	α-helix	trans	-58.1	-46.4	172.1	-178.5	174.8	177.7	177.2	0	112.6	E134 H136 L140 S141 D142	E134-K138 VanDerWaalsContact O-CB 3.28Å; E134-K138 WeakPolarHBondContact O-CB 3.49Å; E134-K138 PolarHBondContact O-N 2.99Å; H136-K138 VanDerWaalsContact C-N 3.3Å; H136-K138 PolarHBondContact O-N 3.25Å; K138-L140 PolarHBondContact O-N 2.87Å; K138-S141 WeakPolarHBondContact O-CB 3.25Å; K138-S141 PolarHBondContact O-N 2.97Å; K138-S141 VanDerWaalsContact O-N 3.16Å; K138-D142 VanDerWaalsContact O-CG 3.23Å; K138-D142 PolarHBondContact O-N 2.76Å
139	R	94.7	Very high	93.9	Very high	162 Å²	162	106.6 Å²	106.6	61%	0.611	52%	0.521	S	S	*	.	H	α-helix	trans	-62.8	-32.7	177	-68.7	167.7	-158.9	-147.2	3.8	112.4	D135 H136 N137 T143	D135-R139 WeakPolarHBondContact O-CD 3.24Å; D135-R139 WeakPolarHBondContact O-CG 3.48Å; D135-R139 PolarHBondContact O-NE 3.39Å; H136-R139 WeakPolarHBondContact O-CB 3.44Å; H136-R139 PolarHBondContact O-N 3.06Å; H136-R139 VanDerWaalsContact O-N 3.12Å; N137-R139 PolarHBondContact O-N 3.35Å; R139-T143 WeakPolarHBondContact O-CB 3.48Å; R139-T143 PolarHBondContact O-N 3.45Å; R139-T143 VanDerWaalsContact O-N 3.07Å; R139-T143 PolarHBondContact O-OG1 2.83Å
140	L	93.3	Very high	93.9	Very high	87 Å²	87	104.4 Å²	104.4	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-66.8	-46.4	173.1	-66.1	174.5	0	0	0	110.8	H136 N137 K138 T143 V144	H136-L140 PolarHBondContact O-N 2.92Å; H136-L140 VanDerWaalsContact O-N 3.08Å; N137-L140 WeakPolarHBondContact O-CB 3.41Å; N137-L140 PolarHBondContact O-N 3.37Å; N137-L140 VanDerWaalsContact O-N 3.16Å; K138-L140 PolarHBondContact O-N 2.87Å; L140-T143 WeakPolarHBondContact O-CB 3.48Å; L140-T143 PolarHBondContact O-N 3.04Å; L140-V144 WeakPolarHBondContact O-CG2 3.24Å; L140-V144 PolarHBondContact O-N 3.44Å
141	S	94	Very high	94.1	Very high	58 Å²	58	102.5 Å²	102.5	41%	0.406	52%	0.516	S	S	.	.	H	α-helix	trans	-58.3	-51.1	173	-58.8	0	0	0	0	112.3	N137 K138 T143 V144 D145	N137-S141 PolarHBondContact O-N 2.92Å; N137-S141 PolarHBondContact O-OG 2.95Å; K138-S141 WeakPolarHBondContact O-CB 3.25Å; K138-S141 PolarHBondContact O-N 2.97Å; K138-S141 VanDerWaalsContact O-N 3.16Å; S141-T143 PolarHBondContact O-N 2.93Å; S141-T143 VanDerWaalsContact O-N 3.12Å; S141-V144 PolarHBondContact O-N 3.15Å; S141-D145 PolarHBondContact O-N 3.29Å
142	D	94	Very high	94.1	Very high	89 Å²	89	100.4 Å²	100.4	48%	0.476	51%	0.511	S	S	.	.	H	α-helix	trans	-55.3	-33	177.1	-65.5	-25.9	0	0	0	111.7	K138 R146	K138-D142 VanDerWaalsContact O-CG 3.23Å; K138-D142 PolarHBondContact O-N 2.76Å; D142-R146 WeakPolarHBondContact O-CB 3.29Å; D142-R146 PolarHBondContact O-N 3.05Å
143	T	95.4	Very high	94.2	Very high	78 Å²	78	99.3 Å²	99.3	48%	0.479	50%	0.504	S	S	.	.	H	α-helix	trans	-77.3	-41	176.8	-57.5	0	0	0	0	112.1	R139 L140 S141 R146 L147	R139-T143 WeakPolarHBondContact O-CB 3.48Å; R139-T143 PolarHBondContact O-N 3.45Å; R139-T143 VanDerWaalsContact O-N 3.07Å; R139-T143 PolarHBondContact O-OG1 2.83Å; L140-T143 WeakPolarHBondContact O-CB 3.48Å; L140-T143 PolarHBondContact O-N 3.04Å; S141-T143 PolarHBondContact O-N 2.93Å; S141-T143 VanDerWaalsContact O-N 3.12Å; T143-R146 PolarHBondContact O-N 3.47Å; T143-L147 HydrophobicContact CG2-CD1 4.29Å; T143-L147 WeakPolarHBondContact O-CG 3.37Å; T143-L147 PolarHBondContact O-N 2.81Å
144	V	95.8	Very high	94.3	Very high	79 Å²	79	103.2 Å²	103.2	48%	0.479	51%	0.512	S	S	.	.	H	α-helix	trans	-64.2	-47	176.4	168.6	0	0	0	0	110.6	L140 S141 R146 L147 L148	L140-V144 WeakPolarHBondContact O-CG2 3.24Å; L140-V144 PolarHBondContact O-N 3.44Å; S141-V144 PolarHBondContact O-N 3.15Å; V144-R146 VanDerWaalsContact C-N 3.29Å; V144-R146 PolarHBondContact O-N 3.2Å; V144-L147 PolarHBondContact O-N 2.98Å; V144-L148 HydrophobicContact CG1-CD1 3.89Å; V144-L148 HydrophobicContact CG1-CG 4.35Å; V144-L148 VanDerWaalsContact O-CG 3.32Å; V144-L148 WeakPolarHBondContact O-CG 3.42Å; V144-L148 PolarHBondContact O-N 3.32Å
145	D	93.5	Very high	94.3	Very high	103 Å²	103	102.7 Å²	102.7	55%	0.551	51%	0.512	S	S	*	.	H	α-helix	trans	-61.9	-38	178.7	-72.5	-23.9	0	0	0	111.8	S141 L148 S149	S141-D145 PolarHBondContact O-N 3.29Å; D145-L148 PolarHBondContact O-N 3.15Å; D145-S149 PolarHBondContact O-N 2.81Å
146	R	94.7	Very high	94.3	Very high	173 Å²	173	104.5 Å²	104.5	65%	0.653	52%	0.518	S	S	*	.	H	α-helix	trans	-62.1	-48.2	173.4	-165.6	-173	-155.4	109.9	8.5	112.2	D142 T143 V144 L148 S149 E150	D142-R146 WeakPolarHBondContact O-CB 3.29Å; D142-R146 PolarHBondContact O-N 3.05Å; T143-R146 PolarHBondContact O-N 3.47Å; V144-R146 VanDerWaalsContact C-N 3.29Å; V144-R146 PolarHBondContact O-N 3.2Å; R146-L148 VanDerWaalsContact C-N 3.28Å; R146-L148 PolarHBondContact O-N 2.85Å; R146-S149 PolarHBondContact O-N 3.48Å; R146-E150 WeakPolarHBondContact CG-OE1 3.37Å; R146-E150 IonicContact NE-OE1 3.4Å; R146-E150 WeakPolarHBondContact O-CG 3.42Å; R146-E150 PolarHBondContact O-N 3.18Å
147	L	95.3	Very high	94.3	Very high	103 Å²	103	104.3 Å²	104.3	54%	0.539	52%	0.52	S	S	.	.	H	α-helix	trans	-64.2	-33	177.6	-71	170.5	0	0	0	112.1	T143 V144 S151	T143-L147 HydrophobicContact CG2-CD1 4.29Å; T143-L147 WeakPolarHBondContact O-CG 3.37Å; T143-L147 PolarHBondContact O-N 2.81Å; V144-L147 PolarHBondContact O-N 2.98Å; L147-S151 WeakPolarHBondContact O-CB 3.41Å; L147-S151 PolarHBondContact O-N 2.64Å
148	L	93.9	Very high	94.3	Very high	106 Å²	106	105.2 Å²	105.2	56%	0.555	52%	0.521	S	S	*	.	H	α-helix	trans	-68.6	-41	172.8	-70.7	172.3	0	0	0	111.8	V144 D145 R146 N152	V144-L148 HydrophobicContact CG1-CD1 3.89Å; V144-L148 HydrophobicContact CG1-CG 4.35Å; V144-L148 VanDerWaalsContact O-CG 3.32Å; V144-L148 WeakPolarHBondContact O-CG 3.42Å; V144-L148 PolarHBondContact O-N 3.32Å; D145-L148 PolarHBondContact O-N 3.15Å; R146-L148 VanDerWaalsContact C-N 3.28Å; R146-L148 PolarHBondContact O-N 2.85Å; L148-N152 VanDerWaalsContact O-CB 3.23Å; L148-N152 WeakPolarHBondContact O-CB 3.48Å; L148-N152 PolarHBondContact O-N 3.31Å
149	S	92.6	Very high	94.3	Very high	54 Å²	54	103.8 Å²	103.8	38%	0.378	52%	0.519	S	S	.	.	H	α-helix	trans	-63.3	-52.6	173.7	-160.5	0	0	0	0	111.5	D145 R146 S151 N152 E153	D145-S149 PolarHBondContact O-N 2.81Å; R146-S149 PolarHBondContact O-N 3.48Å; S149-S151 VanDerWaalsContact C-N 3.27Å; S149-S151 PolarHBondContact O-N 3.31Å; S149-N152 WeakPolarHBondContact O-CB 3.28Å; S149-N152 PolarHBondContact O-N 2.9Å; S149-E153 WeakPolarHBondContact O-CB 3.39Å; S149-E153 WeakPolarHBondContact O-CG 3.5Å; S149-E153 PolarHBondContact O-N 3.14Å; S149-E153 PolarHBondContact OG-OE1 3.49Å
150	E	93.7	Very high	94.2	Very high	97 Å²	97	103.4 Å²	103.4	45%	0.453	52%	0.522	S	S	.	.	H	α-helix	trans	-59	-38.1	179.3	-70.9	176.4	-162.6	0	0	111.8	R146 R154	R146-E150 WeakPolarHBondContact CG-OE1 3.37Å; R146-E150 IonicContact NE-OE1 3.4Å; R146-E150 WeakPolarHBondContact O-CG 3.42Å; R146-E150 PolarHBondContact O-N 3.18Å; E150-R154 WeakPolarHBondContact O-CB 3.5Å; E150-R154 PolarHBondContact O-N 3.48Å
151	S	94.1	Very high	94.2	Very high	77 Å²	77	104.1 Å²	104.1	54%	0.538	52%	0.523	S	S	.	.	H	α-helix	trans	-68.6	-38.3	174.3	-173.3	0	0	0	0	112.9	L147 S149 L155	L147-S151 WeakPolarHBondContact O-CB 3.41Å; L147-S151 PolarHBondContact O-N 2.64Å; S149-S151 VanDerWaalsContact C-N 3.27Å; S149-S151 PolarHBondContact O-N 3.31Å; S151-L155 VanDerWaalsContact O-CB 3.27Å; S151-L155 WeakPolarHBondContact O-CB 3.41Å; S151-L155 PolarHBondContact O-N 3.22Å
152	N	94.7	Very high	94.1	Very high	83 Å²	83	110 Å²	110	44%	0.444	54%	0.536	S	S	.	.	H	α-helix	trans	-68.9	-47.3	176.8	-176.6	22.9	0	0	0	111.6	L148 S149 R154 L155 Q156	L148-N152 VanDerWaalsContact O-CB 3.23Å; L148-N152 WeakPolarHBondContact O-CB 3.48Å; L148-N152 PolarHBondContact O-N 3.31Å; S149-N152 WeakPolarHBondContact O-CB 3.28Å; S149-N152 PolarHBondContact O-N 2.9Å; N152-R154 VanDerWaalsContact C-N 3.34Å; N152-R154 PolarHBondContact O-N 2.93Å; N152-L155 PolarHBondContact O-N 3.45Å; N152-Q156 VanDerWaalsContact CG-NE2 3.3Å; N152-Q156 PolarHBondContact ND2-NE2 2.7Å; N152-Q156 VanDerWaalsContact O-CG 3.32Å; N152-Q156 WeakPolarHBondContact O-CG 3.45Å; N152-Q156 PolarHBondContact O-N 2.83Å; N152-Q156 PolarHBondContact OD1-NE2 3.18Å
153	E	95	Very high	94	Very high	108 Å²	108	110.2 Å²	110.2	51%	0.505	54%	0.536	S	S	.	.	H	α-helix	trans	-58	-45.6	175	-71	164.4	-129.7	0	0	111.3	S149 L155 Q156 L157	S149-E153 WeakPolarHBondContact O-CB 3.39Å; S149-E153 WeakPolarHBondContact O-CG 3.5Å; S149-E153 PolarHBondContact O-N 3.14Å; S149-E153 PolarHBondContact OG-OE1 3.49Å; E153-L155 VanDerWaalsContact C-N 3.35Å; E153-L155 PolarHBondContact O-N 3.13Å; E153-Q156 PolarHBondContact O-N 3.24Å; E153-L157 WeakPolarHBondContact O-CB 3.44Å; E153-L157 PolarHBondContact O-N 3.24Å
154	R	94.9	Very high	93.8	Very high	183 Å²	183	108.9 Å²	108.9	69%	0.691	53%	0.532	S	S	*	.	H	α-helix	trans	-66.4	-34.7	177.3	-166	172.9	-169.6	159.9	3.6	112.8	E150 N152 H158	E150-R154 WeakPolarHBondContact O-CB 3.5Å; E150-R154 PolarHBondContact O-N 3.48Å; N152-R154 VanDerWaalsContact C-N 3.34Å; N152-R154 PolarHBondContact O-N 2.93Å; R154-H158 PolarHBondContact O-N 2.83Å; R154-H158 VanDerWaalsContact O-N 3.09Å
155	L	95.1	Very high	93.5	Very high	117 Å²	117	108 Å²	108	61%	0.613	53%	0.534	S	S	*	.	H	α-helix	trans	-68.7	-41.5	173.2	-178.7	63.8	0	0	0	111.9	S151 N152 E153 H158 L159	S151-L155 VanDerWaalsContact O-CB 3.27Å; S151-L155 WeakPolarHBondContact O-CB 3.41Å; S151-L155 PolarHBondContact O-N 3.22Å; N152-L155 PolarHBondContact O-N 3.45Å; E153-L155 VanDerWaalsContact C-N 3.35Å; E153-L155 PolarHBondContact O-N 3.13Å; L155-H158 PolarHBondContact O-N 3.31Å; L155-L159 WeakPolarHBondContact O-CB 3.44Å; L155-L159 PolarHBondContact O-N 3.05Å
156	Q	93.4	Very high	93.3	Very high	110 Å²	110	108 Å²	108	51%	0.514	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-38.6	174.9	-71.5	174.5	36.7	0	0	111.8	N152 E153 L159 K160	N152-Q156 VanDerWaalsContact CG-NE2 3.3Å; N152-Q156 PolarHBondContact ND2-NE2 2.7Å; N152-Q156 VanDerWaalsContact O-CG 3.32Å; N152-Q156 WeakPolarHBondContact O-CG 3.45Å; N152-Q156 PolarHBondContact O-N 2.83Å; N152-Q156 PolarHBondContact OD1-NE2 3.18Å; E153-Q156 PolarHBondContact O-N 3.24Å; Q156-L159 PolarHBondContact O-N 2.83Å; Q156-K160 WeakPolarHBondContact O-CB 3.35Å; Q156-K160 PolarHBondContact O-N 3.12Å
157	L	94.5	Very high	93.1	Very high	97 Å²	97	106.4 Å²	106.4	51%	0.508	53%	0.533	S	S	.	.	H	α-helix	trans	-62.4	-50.7	174.9	-172.7	150.1	0	0	0	111.1	E153 L159 K160 E161	E153-L157 WeakPolarHBondContact O-CB 3.44Å; E153-L157 PolarHBondContact O-N 3.24Å; L157-L159 VanDerWaalsContact C-N 3.3Å; L157-L159 PolarHBondContact O-N 3.11Å; L157-K160 WeakPolarHBondContact O-CB 3.15Å; L157-K160 PolarHBondContact O-N 3.49Å; L157-K160 VanDerWaalsContact O-N 3.14Å; L157-E161 HydrophobicContact CD2-CG 4.18Å; L157-E161 WeakPolarHBondContact CD2-OE1 3.33Å; L157-E161 WeakPolarHBondContact O-CG 3.37Å; L157-E161 PolarHBondContact O-N 2.78Å
158	H	92.7	Very high	92.9	Very high	115 Å²	115	106 Å²	106	53%	0.532	53%	0.529	S	S	.	.	H	α-helix	trans	-62	-34.1	174.4	-92.8	-29.5	0	0	0	113.3	R154 L155 E161 R162	R154-H158 PolarHBondContact O-N 2.83Å; R154-H158 VanDerWaalsContact O-N 3.09Å; L155-H158 PolarHBondContact O-N 3.31Å; H158-E161 IonicContact CE1-OE2 3.7Å; H158-E161 IonicContact CG-OE2 2.66Å; H158-E161 IonicContact ND1-OE2 3.55Å; H158-E161 PolarHBondContact ND1-OE2 2.92Å; H158-R162 VanDerWaalsContact O-CB 3.29Å; H158-R162 WeakPolarHBondContact O-CB 3.43Å; H158-R162 PolarHBondContact O-N 2.87Å
159	L	94.1	Very high	92.7	Very high	101 Å²	101	107.5 Å²	107.5	53%	0.529	53%	0.531	S	S	.	.	H	α-helix	trans	-64.9	-43.4	173.7	-178.1	61.7	0	0	0	111	L155 Q156 L157 R162 M163	L155-L159 WeakPolarHBondContact O-CB 3.44Å; L155-L159 PolarHBondContact O-N 3.05Å; Q156-L159 PolarHBondContact O-N 2.83Å; L157-L159 VanDerWaalsContact C-N 3.3Å; L157-L159 PolarHBondContact O-N 3.11Å; L159-R162 PolarHBondContact O-N 3.43Å; L159-M163 HydrophobicContact CG-CE 4.4Å; L159-M163 WeakPolarHBondContact O-CG 3.44Å; L159-M163 PolarHBondContact O-N 3.08Å
160	K	93.7	Very high	92.6	Very high	154 Å²	154	106.3 Å²	106.3	67%	0.67	53%	0.527	S	S	*	.	H	α-helix	trans	-63.7	-45.8	176.6	-174.6	-179.6	179	-178.4	0	112.3	Q156 L157 R162 M163 A164	Q156-K160 WeakPolarHBondContact O-CB 3.35Å; Q156-K160 PolarHBondContact O-N 3.12Å; L157-K160 WeakPolarHBondContact O-CB 3.15Å; L157-K160 PolarHBondContact O-N 3.49Å; L157-K160 VanDerWaalsContact O-N 3.14Å; K160-R162 VanDerWaalsContact C-N 3.3Å; K160-R162 PolarHBondContact O-N 3Å; K160-M163 PolarHBondContact O-N 3.18Å; K160-A164 PolarHBondContact O-N 3.33Å
161	E	93.4	Very high	92.5	Very high	101 Å²	101	107 Å²	107	47%	0.472	53%	0.526	S	S	.	.	H	α-helix	trans	-57.1	-44.4	172.9	-71	174.7	154	0	0	111.4	L157 H158 A164 A165	L157-E161 HydrophobicContact CD2-CG 4.18Å; L157-E161 WeakPolarHBondContact CD2-OE1 3.33Å; L157-E161 WeakPolarHBondContact O-CG 3.37Å; L157-E161 PolarHBondContact O-N 2.78Å; H158-E161 IonicContact CE1-OE2 3.7Å; H158-E161 IonicContact CG-OE2 2.66Å; H158-E161 IonicContact ND1-OE2 3.55Å; H158-E161 PolarHBondContact ND1-OE2 2.92Å; E161-A164 PolarHBondContact O-N 2.99Å; E161-A165 WeakPolarHBondContact O-CB 3.31Å; E161-A165 PolarHBondContact O-N 3.19Å
162	R	92.7	Very high	92.3	Very high	181 Å²	181	106.8 Å²	106.8	68%	0.683	52%	0.518	S	S	*	.	H	α-helix	trans	-67.9	-34.6	179.1	-172.8	175.6	179.9	-177.3	-0	112.8	H158 L159 K160 L166	H158-R162 VanDerWaalsContact O-CB 3.29Å; H158-R162 WeakPolarHBondContact O-CB 3.43Å; H158-R162 PolarHBondContact O-N 2.87Å; L159-R162 PolarHBondContact O-N 3.43Å; K160-R162 VanDerWaalsContact C-N 3.3Å; K160-R162 PolarHBondContact O-N 3Å; R162-L166 HydrophobicContact CG-CD1 4.45Å; R162-L166 VanDerWaalsContact O-CG 3.27Å; R162-L166 WeakPolarHBondContact O-CG 3.48Å; R162-L166 PolarHBondContact O-N 2.82Å; R162-L166 VanDerWaalsContact O-N 3.09Å
163	M	91.8	Very high	91.9	Very high	94 Å²	94	105.7 Å²	105.7	46%	0.463	52%	0.516	S	S	.	.	H	α-helix	trans	-66.9	-48.7	172.8	-71	-173.6	-56.4	0	0	110.9	L159 K160 A165 L166 E167	L159-M163 HydrophobicContact CG-CE 4.4Å; L159-M163 WeakPolarHBondContact O-CG 3.44Å; L159-M163 PolarHBondContact O-N 3.08Å; K160-M163 PolarHBondContact O-N 3.18Å; M163-A165 VanDerWaalsContact C-N 3.29Å; M163-A165 PolarHBondContact O-N 3.3Å; M163-L166 WeakPolarHBondContact O-CA 3.48Å; M163-L166 WeakPolarHBondContact O-CB 3.47Å; M163-L166 PolarHBondContact O-N 3.35Å; M163-E167 WeakPolarHBondContact O-CG 3.01Å; M163-E167 PolarHBondContact O-N 2.88Å
164	A	90.6	Very high	91.7	Very high	50 Å²	50	107.2 Å²	107.2	41%	0.413	52%	0.524	S	S	.	.	H	α-helix	trans	-58.5	-39.5	176.1	0	0	0	0	0	112.5	K160 E161 L166 E167 E168	K160-A164 PolarHBondContact O-N 3.33Å; E161-A164 PolarHBondContact O-N 2.99Å; A164-L166 VanDerWaalsContact C-N 3.32Å; A164-L166 PolarHBondContact O-N 3.49Å; A164-E167 PolarHBondContact O-N 3.14Å; A164-E168 PolarHBondContact O-N 2.79Å
165	A	89.6	Confident	91.4	Very high	62 Å²	62	102.8 Å²	102.8	51%	0.512	51%	0.511	S	S	.	.	H	α-helix	trans	-68.8	-27	174.8	0	0	0	0	0	113.6	E161 M163 K169	E161-A165 WeakPolarHBondContact O-CB 3.31Å; E161-A165 PolarHBondContact O-N 3.19Å; M163-A165 VanDerWaalsContact C-N 3.29Å; M163-A165 PolarHBondContact O-N 3.3Å; A165-K169 VanDerWaalsContact O-CB 3.27Å; A165-K169 WeakPolarHBondContact O-CB 3.46Å; A165-K169 PolarHBondContact O-N 3.43Å; A165-K169 VanDerWaalsContact O-N 3.09Å
166	L	89.3	Confident	91	Very high	103 Å²	103	101.6 Å²	101.6	54%	0.539	50%	0.504	S	S	.	.	H	α-helix	trans	-76.4	-35.7	171.8	-74.6	167.3	0	0	0	111.7	R162 M163 A164 K169 G170	R162-L166 HydrophobicContact CG-CD1 4.45Å; R162-L166 VanDerWaalsContact O-CG 3.27Å; R162-L166 WeakPolarHBondContact O-CG 3.48Å; R162-L166 PolarHBondContact O-N 2.82Å; R162-L166 VanDerWaalsContact O-N 3.09Å; M163-L166 WeakPolarHBondContact O-CA 3.48Å; M163-L166 WeakPolarHBondContact O-CB 3.47Å; M163-L166 PolarHBondContact O-N 3.35Å; A164-L166 VanDerWaalsContact C-N 3.32Å; A164-L166 PolarHBondContact O-N 3.49Å; L166-K169 PolarHBondContact O-N 2.9Å; L166-G170 PolarHBondContact O-N 3.34Å
167	E	89.3	Confident	90.7	Very high	138 Å²	138	100.8 Å²	100.8	65%	0.645	50%	0.5	S	S	*	.	H	α-helix	trans	-65.6	-48.1	173.4	-69.4	165.1	-179.2	0	0	111.3	M163 A164 K169 G170 R171	M163-E167 WeakPolarHBondContact O-CG 3.01Å; M163-E167 PolarHBondContact O-N 2.88Å; A164-E167 PolarHBondContact O-N 3.14Å; E167-K169 VanDerWaalsContact C-N 3.34Å; E167-K169 PolarHBondContact O-N 2.98Å; E167-G170 WeakPolarHBondContact O-CA 3.33Å; E167-G170 PolarHBondContact O-N 3.26Å; E167-G170 VanDerWaalsContact O-N 3.07Å; E167-R171 PolarHBondContact O-N 3.48Å
168	E	91.3	Very high	90.4	Very high	95 Å²	95	102 Å²	102	44%	0.444	50%	0.502	S	S	.	.	H	α-helix	trans	-58.5	-43.6	172.2	-109.6	-86.1	103.3	0	0	111.6	A164 G170 R171 L172	A164-E168 PolarHBondContact O-N 2.79Å; E168-G170 VanDerWaalsContact C-N 3.3Å; E168-G170 PolarHBondContact O-N 2.95Å; E168-R171 PolarHBondContact O-N 2.65Å; E168-R171 IonicContact OE1-CZ 3.53Å; E168-R171 VanDerWaalsContact OE1-CZ 3.26Å; E168-R171 IonicContact OE1-NE 2.79Å; E168-R171 PolarHBondContact OE1-NE 3.36Å; E168-R171 IonicContact OE1-NH2 3.64Å; E168-R171 PolarHBondContact OE1-NH2 3.32Å; E168-L172 WeakPolarHBondContact O-CB 3.47Å; E168-L172 VanDerWaalsContact O-CG 3.3Å; E168-L172 WeakPolarHBondContact O-CG 3.42Å; E168-L172 PolarHBondContact O-N 3.14Å
169	K	90.2	Very high	90	Very high	138 Å²	138	100.9 Å²	100.9	60%	0.6	50%	0.499	S	S	*	.	H	α-helix	trans	-61.5	-38.2	173.7	-175.6	-173.1	173.7	-169.4	0	111.9	A165 L166 E167 S173	A165-K169 VanDerWaalsContact O-CB 3.27Å; A165-K169 WeakPolarHBondContact O-CB 3.46Å; A165-K169 PolarHBondContact O-N 3.43Å; A165-K169 VanDerWaalsContact O-N 3.09Å; L166-K169 PolarHBondContact O-N 2.9Å; E167-K169 VanDerWaalsContact C-N 3.34Å; E167-K169 PolarHBondContact O-N 2.98Å; K169-S173 WeakPolarHBondContact O-CB 3.47Å; K169-S173 PolarHBondContact O-N 3.17Å; K169-S173 PolarHBondContact O-OG 2.81Å
170	G	90.6	Very high	89.4	Confident	29 Å²	29	103.1 Å²	103.1	30%	0.299	50%	0.5	S	S	.	.	H	α-helix	trans	-59.8	-56.4	173.9	0	0	0	0	0	111.3	L166 E167 E168 L172 S173 E174	L166-G170 PolarHBondContact O-N 3.34Å; E167-G170 WeakPolarHBondContact O-CA 3.33Å; E167-G170 PolarHBondContact O-N 3.26Å; E167-G170 VanDerWaalsContact O-N 3.07Å; E168-G170 VanDerWaalsContact C-N 3.3Å; E168-G170 PolarHBondContact O-N 2.95Å; G170-L172 VanDerWaalsContact C-N 3.32Å; G170-L172 PolarHBondContact O-N 2.95Å; G170-S173 WeakPolarHBondContact O-CA 3.47Å; G170-S173 WeakPolarHBondContact O-CB 3.42Å; G170-S173 PolarHBondContact O-N 3.31Å; G170-E174 PolarHBondContact O-N 3.26Å
171	R	92.2	Very high	88.8	Confident	112 Å²	112	100.8 Å²	100.8	42%	0.423	49%	0.492	S	S	.	.	H	α-helix	trans	-53.3	-45.8	176.6	-166.6	-165.9	68.2	66.9	2.6	112.5	E167 E168 S173 E174 E175	E167-R171 PolarHBondContact O-N 3.48Å; E168-R171 PolarHBondContact O-N 2.65Å; E168-R171 IonicContact OE1-CZ 3.53Å; E168-R171 VanDerWaalsContact OE1-CZ 3.26Å; E168-R171 IonicContact OE1-NE 2.79Å; E168-R171 PolarHBondContact OE1-NE 3.36Å; E168-R171 IonicContact OE1-NH2 3.64Å; E168-R171 PolarHBondContact OE1-NH2 3.32Å; R171-S173 VanDerWaalsContact C-N 3.33Å; R171-S173 PolarHBondContact O-N 3.25Å; R171-E174 PolarHBondContact O-N 3.13Å; R171-E175 IonicContact CZ-OE2 3.97Å; R171-E175 IonicContact NH1-OE2 3.18Å; R171-E175 PolarHBondContact NH1-OE2 3.3Å; R171-E175 IonicContact NH2-OE2 2.71Å; R171-E175 WeakPolarHBondContact O-CB 3.32Å; R171-E175 PolarHBondContact O-N 2.99Å
172	L	89	Confident	88.2	Confident	71 Å²	71	99.8 Å²	99.8	37%	0.372	49%	0.487	S	S	.	.	H	α-helix	trans	-68.5	-29.8	177	-71.8	169.6	0	0	0	112.8	E168 G170 I176	E168-L172 WeakPolarHBondContact O-CB 3.47Å; E168-L172 VanDerWaalsContact O-CG 3.3Å; E168-L172 WeakPolarHBondContact O-CG 3.42Å; E168-L172 PolarHBondContact O-N 3.14Å; G170-L172 VanDerWaalsContact C-N 3.32Å; G170-L172 PolarHBondContact O-N 2.95Å; L172-I176 WeakPolarHBondContact O-CB 3.49Å; L172-I176 WeakPolarHBondContact O-CD1 3.36Å; L172-I176 WeakPolarHBondContact O-CG1 3.43Å; L172-I176 PolarHBondContact O-N 3.26Å
173	S	87.6	Confident	87.3	Confident	60 Å²	60	94.6 Å²	94.6	42%	0.42	48%	0.476	S	S	.	.	H	α-helix	trans	-72.3	-39.5	175.1	-57.4	0	0	0	0	111.5	K169 G170 R171 I176 E177	K169-S173 WeakPolarHBondContact O-CB 3.47Å; K169-S173 PolarHBondContact O-N 3.17Å; K169-S173 PolarHBondContact O-OG 2.81Å; G170-S173 WeakPolarHBondContact O-CA 3.47Å; G170-S173 WeakPolarHBondContact O-CB 3.42Å; G170-S173 PolarHBondContact O-N 3.31Å; R171-S173 VanDerWaalsContact C-N 3.33Å; R171-S173 PolarHBondContact O-N 3.25Å; S173-I176 PolarHBondContact O-N 2.97Å; S173-E177 WeakPolarHBondContact O-CB 3.37Å; S173-E177 PolarHBondContact O-N 3.11Å
174	E	90	Very high	86.5	Confident	140 Å²	140	94.3 Å²	94.3	65%	0.654	48%	0.476	S	S	*	.	H	α-helix	trans	-64.1	-41.8	171.8	-67.2	169.9	-176.5	0	0	111.6	G170 R171 E177 K178	G170-E174 PolarHBondContact O-N 3.26Å; R171-E174 PolarHBondContact O-N 3.13Å; E174-E177 PolarHBondContact O-N 3.27Å; E174-K178 WeakPolarHBondContact O-CB 3.32Å; E174-K178 PolarHBondContact O-N 3.14Å
175	E	88.7	Confident	85.4	Confident	90 Å²	90	98.5 Å²	98.5	42%	0.421	49%	0.487	S	S	.	.	H	α-helix	trans	-65.7	-40.6	176.2	-171.3	164.1	-154.9	0	0	112.1	R171 L179	R171-E175 IonicContact CZ-OE2 3.97Å; R171-E175 IonicContact NH1-OE2 3.18Å; R171-E175 PolarHBondContact NH1-OE2 3.3Å; R171-E175 IonicContact NH2-OE2 2.71Å; R171-E175 WeakPolarHBondContact O-CB 3.32Å; R171-E175 PolarHBondContact O-N 2.99Å; E175-L179 HydrophobicContact CG-CD1 4.49Å; E175-L179 WeakPolarHBondContact O-CB 3.39Å; E175-L179 VanDerWaalsContact O-CG 3.28Å; E175-L179 WeakPolarHBondContact O-CG 3.44Å; E175-L179 PolarHBondContact O-N 3.26Å
176	I	86.6	Confident	84.1	Confident	93 Å²	93	101.9 Å²	101.9	48%	0.477	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-41.4	171.3	-75.4	165.4	0	0	0	111.6	L172 S173 L179 R180	L172-I176 WeakPolarHBondContact O-CB 3.49Å; L172-I176 WeakPolarHBondContact O-CD1 3.36Å; L172-I176 WeakPolarHBondContact O-CG1 3.43Å; L172-I176 PolarHBondContact O-N 3.26Å; S173-I176 PolarHBondContact O-N 2.97Å; I176-L179 PolarHBondContact O-N 3.27Å; I176-R180 VanDerWaalsContact O-CG 3.3Å; I176-R180 WeakPolarHBondContact O-CG 3.45Å; I176-R180 PolarHBondContact O-N 2.93Å
177	E	86.3	Confident	82.5	Confident	92 Å²	92	103.4 Å²	103.4	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-68.7	-40.3	179.9	-177.4	50.4	-146.8	0	0	111.8	S173 E174 L179 R180 Q181	S173-E177 WeakPolarHBondContact O-CB 3.37Å; S173-E177 PolarHBondContact O-N 3.11Å; E174-E177 PolarHBondContact O-N 3.27Å; E177-L179 PolarHBondContact O-N 3.35Å; E177-R180 WeakPolarHBondContact O-CB 3.44Å; E177-R180 PolarHBondContact O-N 2.98Å; E177-R180 WeakPolarHBondContact OE2-CD 3.47Å; E177-Q181 WeakPolarHBondContact O-CG 3.43Å; E177-Q181 PolarHBondContact O-N 3.06Å; E177-Q181 PolarHBondContact OE1-NE2 2.85Å
178	K	88.2	Confident	80.9	Confident	123 Å²	123	100.4 Å²	100.4	54%	0.535	50%	0.504	S	S	.	.	H	α-helix	trans	-58.6	-46.2	169.6	-179.2	176.7	179.4	-75.6	0	111.8	E174 R180 Q181 E182	E174-K178 WeakPolarHBondContact O-CB 3.32Å; E174-K178 PolarHBondContact O-N 3.14Å; K178-R180 VanDerWaalsContact C-N 3.32Å; K178-R180 PolarHBondContact O-N 3.13Å; K178-Q181 PolarHBondContact O-N 3.24Å; K178-E182 WeakPolarHBondContact CE-OE1 3.41Å; K178-E182 IonicContact NZ-OE1 2.68Å; K178-E182 PolarHBondContact NZ-OE1 2.92Å; K178-E182 WeakPolarHBondContact O-CG 3.21Å; K178-E182 PolarHBondContact O-N 2.9Å
179	L	84.3	Confident	79	Confident	91 Å²	91	107 Å²	107	48%	0.476	53%	0.525	S	S	.	.	H	α-helix	trans	-64.9	-33.1	177.1	-73.3	168.4	0	0	0	112.7	E175 I176 E177 E182 V183	E175-L179 HydrophobicContact CG-CD1 4.49Å; E175-L179 WeakPolarHBondContact O-CB 3.39Å; E175-L179 VanDerWaalsContact O-CG 3.28Å; E175-L179 WeakPolarHBondContact O-CG 3.44Å; E175-L179 PolarHBondContact O-N 3.26Å; I176-L179 PolarHBondContact O-N 3.27Å; E177-L179 PolarHBondContact O-N 3.35Å; L179-E182 PolarHBondContact O-N 3.48Å; L179-V183 WeakPolarHBondContact O-CB 3.44Å; L179-V183 VanDerWaalsContact O-CG2 3.32Å; L179-V183 WeakPolarHBondContact O-CG2 3.47Å; L179-V183 PolarHBondContact O-N 3.38Å
180	R	82.2	Confident	76.5	Confident	148 Å²	148	103.4 Å²	103.4	56%	0.558	53%	0.527	S	S	*	.	H	α-helix	trans	-63.3	-46.2	171.1	-74.7	167.5	177.2	-78.4	-3.9	111.4	I176 E177 K178 E182 V183 D184	I176-R180 VanDerWaalsContact O-CG 3.3Å; I176-R180 WeakPolarHBondContact O-CG 3.45Å; I176-R180 PolarHBondContact O-N 2.93Å; E177-R180 WeakPolarHBondContact O-CB 3.44Å; E177-R180 PolarHBondContact O-N 2.98Å; E177-R180 WeakPolarHBondContact OE2-CD 3.47Å; K178-R180 VanDerWaalsContact C-N 3.32Å; K178-R180 PolarHBondContact O-N 3.13Å; R180-E182 VanDerWaalsContact C-N 3.31Å; R180-E182 PolarHBondContact O-N 3.37Å; R180-V183 PolarHBondContact O-N 3.46Å; R180-D184 PolarHBondContact O-N 3.14Å
181	Q	82.1	Confident	73.9	Confident	105 Å²	105	105.5 Å²	105.5	49%	0.491	55%	0.548	S	S	.	.	H	α-helix	trans	-64.9	-33.7	177.9	-67.3	169.1	20.2	0	0	112.2	E177 K178 Q185	E177-Q181 WeakPolarHBondContact O-CG 3.43Å; E177-Q181 PolarHBondContact O-N 3.06Å; E177-Q181 PolarHBondContact OE1-NE2 2.85Å; K178-Q181 PolarHBondContact O-N 3.24Å; Q181-Q185 WeakPolarHBondContact O-CB 3.37Å; Q181-Q185 VanDerWaalsContact O-CG 3.26Å; Q181-Q185 WeakPolarHBondContact O-CG 3.12Å; Q181-Q185 PolarHBondContact O-N 3.29Å; Q181-Q185 VanDerWaalsContact O-N 3.1Å; Q181-Q185 PolarHBondContact O-NE2 3.29Å
182	E	80.5	Confident	72.1	Confident	80 Å²	80	106.1 Å²	106.1	37%	0.374	57%	0.567	S	S	.	*	H	α-helix	trans	-68.5	-42.7	170.8	-72.2	173.6	-161.6	0	0	112	K178 L179 R180 Q185 L186	K178-E182 WeakPolarHBondContact CE-OE1 3.41Å; K178-E182 IonicContact NZ-OE1 2.68Å; K178-E182 PolarHBondContact NZ-OE1 2.92Å; K178-E182 WeakPolarHBondContact O-CG 3.21Å; K178-E182 PolarHBondContact O-N 2.9Å; L179-E182 PolarHBondContact O-N 3.48Å; R180-E182 VanDerWaalsContact C-N 3.31Å; R180-E182 PolarHBondContact O-N 3.37Å; E182-Q185 PolarHBondContact O-N 2.94Å; E182-L186 WeakPolarHBondContact O-CG 3.38Å; E182-L186 PolarHBondContact O-N 3.16Å; E182-L186 VanDerWaalsContact O-N 3.11Å
183	V	73.6	Confident	69.6	Low	73 Å²	73	112.3 Å²	112.3	44%	0.442	59%	0.591	S	S	.	*	H	α-helix	trans	-64.1	-40.8	175.8	164.2	0	0	0	0	112.5	L179 R180 L186 K187	L179-V183 WeakPolarHBondContact O-CB 3.44Å; L179-V183 VanDerWaalsContact O-CG2 3.32Å; L179-V183 WeakPolarHBondContact O-CG2 3.47Å; L179-V183 PolarHBondContact O-N 3.38Å; R180-V183 PolarHBondContact O-N 3.46Å; V183-L186 WeakPolarHBondContact O-CB 3.13Å; V183-L186 PolarHBondContact O-N 3.44Å; V183-K187 PolarHBondContact O-N 3.3Å
184	D	73.8	Confident	67.3	Low	87 Å²	87	114.7 Å²	114.7	47%	0.465	60%	0.603	S	S	.	*	H	α-helix	trans	-76.6	-27.9	-179.6	-71.5	-22.5	0	0	0	112.3	R180 L186 K187 G188	R180-D184 PolarHBondContact O-N 3.14Å; D184-L186 VanDerWaalsContact C-N 3.32Å; D184-K187 PolarHBondContact O-N 3.16Å; D184-K187 WeakPolarHBondContact OD1-CD 3.41Å; D184-K187 WeakPolarHBondContact OD1-CE 3.2Å; D184-K187 IonicContact OD1-NZ 2.81Å; D184-K187 PolarHBondContact OD1-NZ 2.95Å; D184-G188 PolarHBondContact O-N 2.84Å
185	Q	68.7	Low	64.5	Low	138 Å²	138	115 Å²	115	65%	0.645	61%	0.609	S	S	*	*	H	α-helix	trans	-62.2	-37	164.5	-79.5	171.5	94.6	0	0	112.4	Q181 E182	Q181-Q185 WeakPolarHBondContact O-CB 3.37Å; Q181-Q185 VanDerWaalsContact O-CG 3.26Å; Q181-Q185 WeakPolarHBondContact O-CG 3.12Å; Q181-Q185 PolarHBondContact O-N 3.29Å; Q181-Q185 VanDerWaalsContact O-N 3.1Å; Q181-Q185 PolarHBondContact O-NE2 3.29Å; E182-Q185 PolarHBondContact O-N 2.94Å
186	L	62.3	Low	61.8	Low	134 Å²	134	114.1 Å²	114.1	70%	0.702	62%	0.624	S	S	*	*	H	α-helix	trans	-69.8	-41.2	174.7	-69.9	168.8	0	0	0	112	E182 V183 D184 G188 R189	E182-L186 WeakPolarHBondContact O-CG 3.38Å; E182-L186 PolarHBondContact O-N 3.16Å; E182-L186 VanDerWaalsContact O-N 3.11Å; V183-L186 WeakPolarHBondContact O-CB 3.13Å; V183-L186 PolarHBondContact O-N 3.44Å; D184-L186 VanDerWaalsContact C-N 3.32Å; L186-G188 VanDerWaalsContact C-N 3.34Å; L186-G188 PolarHBondContact O-N 2.94Å; L186-R189 PolarHBondContact O-N 3.49Å
187	K	55.8	Low	59.3	Low	135 Å²	135	116.1 Å²	116.1	59%	0.587	63%	0.634	S	S	*	*	H	α-helix	trans	-62.4	-39.1	173.1	-68.6	178.1	-161.7	150.8	0	112.4	V183 D184 R189 G190	V183-K187 PolarHBondContact O-N 3.3Å; D184-K187 PolarHBondContact O-N 3.16Å; D184-K187 WeakPolarHBondContact OD1-CD 3.41Å; D184-K187 WeakPolarHBondContact OD1-CE 3.2Å; D184-K187 IonicContact OD1-NZ 2.81Å; D184-K187 PolarHBondContact OD1-NZ 2.95Å; K187-R189 PolarHBondContact O-N 3.1Å; K187-G190 PolarHBondContact O-N 2.9Å; K187-G190 VanDerWaalsContact O-N 3.07Å
188	G	55.9	Low	56.8	Low	74 Å²	74	120.5 Å²	120.5	76%	0.763	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-6.1	177.8	0	0	0	0	0	115.2	D184 L186	D184-G188 PolarHBondContact O-N 2.84Å; L186-G188 VanDerWaalsContact C-N 3.34Å; L186-G188 PolarHBondContact O-N 2.94Å
189	R	49.8	Very low	54.2	Low	234 Å²	234	120.3 Å²	120.3	88%	0.883	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	1.7	177.6	-124	173.8	-175.2	-89.3	1.2	114.7	L186 K187	L186-R189 PolarHBondContact O-N 3.49Å; K187-R189 PolarHBondContact O-N 3.1Å
190	G	39	Very low	51.7	Low	63 Å²	63	127.2 Å²	127.2	65%	0.649	69%	0.688	S	S	*	*			trans	-107.9	112.1	-179.1	0	0	0	0	0	113.6	K187	K187-G190 PolarHBondContact O-N 2.9Å; K187-G190 VanDerWaalsContact O-N 3.07Å
191	G	36	Very low	49.3	Very low	72 Å²	72	124.3 Å²	124.3	74%	0.742	69%	0.691	S	S	*	*			trans	-76	166.1	171.7	0	0	0	0	0	113.8
192	P	54.7	Low	46.8	Very low	125 Å²	125	127.7 Å²	127.7	81%	0.812	71%	0.707	S	S	*	*			trans	-92.6	155.1	-162.6	36	-37.2	0	0	0	115.7
193	F	35.1	Very low	44.6	Very low	201 Å²	201	130.1 Å²	130.1	88%	0.882	73%	0.727	S	S	*	*			trans	167.7	148.6	151.9	-110.1	-129.3	0	0	0	107.1
194	V	39.2	Very low	42.4	Very low	111 Å²	111	130 Å²	130	67%	0.673	74%	0.74	S	S	*	*			cis	-156.1	-179.3	-10.6	95	0	0	0	0	110
195	D	32.5	Very low	40.6	Very low	145 Å²	145	132 Å²	132	78%	0.775	76%	0.76	S	S	*	*			trans	-50.2	163.9	-169.5	-60.4	-80.2	0	0	0	120.9
196	G	31.5	Very low	38.6	Very low	73 Å²	73	130.3 Å²	130.3	75%	0.753	77%	0.771	S	S	*	*			trans	-161.3	13.2	178.5	0	0	0	0	0	120.1
197	I	34.6	Very low	37.1	Very low	134 Å²	134	128.2 Å²	128.2	69%	0.687	77%	0.772	S	S	*	*			trans	27.6	120.1	161.5	-41	177.6	0	0	0	119.5
198	H	33.5	Very low	35.8	Very low	184 Å²	184	128.1 Å²	128.1	85%	0.852	78%	0.778	S	S	*	*				172	144	118.1	-91.3	96	0	0	0	113.3
199	S	33.6	Very low	34.8	Very low	119 Å²	119	130.5 Å²	130.5	83%	0.832	78%	0.778	S	S	*	*			trans	-129.6	136.5	178.9	-59.6	0	0	0	0	112.1
200	R	31	Very low	34.1	Very low	236 Å²	236	129.6 Å²	129.6	89%	0.891	77%	0.774	S	S	*	*			trans	-167.2	137	151.4	-125.2	-175.5	168.9	-165	-6.1	116.1
201	S	31.8	Very low	33.6	Very low	88 Å²	88	135.1 Å²	135.1	62%	0.615	78%	0.781	S	S	*	*			trans	30	128.5	144.3	55.9	0	0	0	0	121
202	H	30.1	Very low	33.2	Very low	176 Å²	176	136.5 Å²	136.5	82%	0.815	78%	0.779	S	S	*	*				61.6	125.7	68.9	-149.5	-93.2	0	0	0	111.1
203	V	33.9	Very low	32	Very low	131 Å²	131	138.2 Å²	138.2	79%	0.794	78%	0.781	S	S	*	*			cis	-133.8	-178.5	25.2	-135.4	0	0	0	0	108.7
204	G	27.4	Very low	31.7	Very low	70 Å²	70	133.3 Å²	133.3	72%	0.722	77%	0.771	S	S	*	*			cis	166.1	-167.9	23.2	0	0	0	0	0	110.2
205	S	36.3	Very low	31.3	Very low	128 Å²	128	134.5 Å²	134.5	90%	0.895	78%	0.779	S	S	*	*			trans	-118.9	135	-171.4	178.4	0	0	0	0	113.2
206	A	26.9	Very low	31.3	Very low	104 Å²	104	131.4 Å²	131.4	86%	0.86	77%	0.773	S	S	*	*			trans	-166.3	158.6	156.8	0	0	0	0	0	113.5
207	A	31	Very low	31.2	Very low	89 Å²	89	133.7 Å²	133.7	74%	0.736	77%	0.773	S	S	*	*			trans	-69.6	-179.1	-168.7	0	0	0	0	0	119.4
208	D	27.3	Very low	31.1	Very low	133 Å²	133	136 Å²	136	71%	0.711	78%	0.781	S	S	*	*			trans	65.7	128.9	160	-71.6	-0.8	0	0	0	119.7
209	V	36.3	Very low	30.9	Very low	125 Å²	125	131.8 Å²	131.8	76%	0.758	78%	0.777	S	S	*	*			cis	79.9	111	37.6	-178.6	0	0	0	0	113.8
210	R	33.6	Very low	31	Very low	214 Å²	214	132 Å²	132	81%	0.808	78%	0.776	S	S	*	*			trans	159.1	144.2	164.7	-95.3	174.4	-125.3	-163.8	0.1	107.6
211	F	28.3	Very low	31.8	Very low	179 Å²	179	126.5 Å²	126.5	79%	0.785	77%	0.771	S	S	*	*			cis	-135.5	133.3	-12.9	-112.9	-95.6	0	0	0	103.9
212	S	28.4	Very low	31.8	Very low	102 Å²	102	125.2 Å²	125.2	71%	0.713	77%	0.771	S	S	*	*				57.3	114.8	67.7	-65.2	0	0	0	0	115.2
213	L	30.7	Very low	32.1	Very low	160 Å²	160	124 Å²	124	84%	0.838	77%	0.77	S	S	*	*				-178.6	119.8	115.4	-172.5	62.7	0	0	0	113.3
214	S	27.5	Very low	32.1	Very low	98 Å²	98	123.9 Å²	123.9	69%	0.685	76%	0.761	S	S	*	*			trans	55.1	158.3	155.4	-55.1	0	0	0	0	120
215	T	31	Very low	32.4	Very low	137 Å²	137	128.9 Å²	128.9	84%	0.84	76%	0.758	S	S	*	*			cis	-145.7	178.7	10.2	-26.3	0	0	0	0	111.2
216	A	31.8	Very low	32.2	Very low	79 Å²	79	131.6 Å²	131.6	65%	0.653	75%	0.748	S	S	*	*			trans	-45.9	163.3	173.5	0	0	0	0	0	115.3
217	T	31	Very low	32.3	Very low	121 Å²	121	137.3 Å²	137.3	74%	0.742	75%	0.749	S	S	*	*			cis	-161.4	173.8	33.6	-31.4	0	0	0	0	112.7
218	H	32.3	Very low	32.2	Very low	183 Å²	183	138 Å²	138	85%	0.847	75%	0.749	S	S	*	*			trans	71.4	109.4	168.1	-79.4	-79	0	0	0	118.5
219	A	29	Very low	32.1	Very low	95 Å²	95	136.5 Å²	136.5	79%	0.785	76%	0.755	S	S	*	*			trans	-88	159.3	166.5	0	0	0	0	0	111.7
220	P	36.3	Very low	32	Very low	124 Å²	124	138.6 Å²	138.6	81%	0.805	76%	0.761	S	S	*	*			trans	-107.1	-110.4	-174.4	21	2.9	0	0	0	114
221	P	46.7	Very low	31.7	Very low	120 Å²	120	138.8 Å²	138.8	78%	0.779	76%	0.762	S	S	*	*				-117.7	179.8	-128.8	37.5	-19.5	0	0	0	114.6
222	G	31.8	Very low	31.6	Very low	61 Å²	61	135.6 Å²	135.6	63%	0.629	75%	0.753	S	S	*	*			trans	-86.3	163	-179.1	0	0	0	0	0	115.6
223	L	36.4	Very low	31.5	Very low	151 Å²	151	138.8 Å²	138.8	79%	0.791	76%	0.757	S	S	*	*			trans	53.7	128.4	157.6	-70.6	85	0	0	0	117.5
224	H	33.8	Very low	31.4	Very low	129 Å²	129	136 Å²	136	60%	0.597	75%	0.75	S	S	*	*				-169.8	146.7	65.1	-112	-34.4	0	0	0	114.1
225	R	33.1	Very low	31.7	Very low	174 Å²	174	136 Å²	136	66%	0.657	76%	0.756	S	S	*	*				58.8	132.3	123.7	-134.9	-170.4	-66.6	-145.5	7	117.4
226	R	33.6	Very low	31.8	Very low	185 Å²	185	137.3 Å²	137.3	70%	0.698	75%	0.75	S	S	*	*			cis	-165.5	163.3	17.3	-146.4	-179.1	-49.6	-153.7	6.3	108.6
227	Y	27.8	Very low	31.6	Very low	224 Å²	224	139.5 Å²	139.5	88%	0.878	75%	0.751	S	S	*	*				-175.4	179.1	123.3	-101.9	-66.7	0	0	0	110.3
228	S	28.6	Very low	31.4	Very low	105 Å²	105	144.9 Å²	144.9	73%	0.734	76%	0.758	S	S	*	*			trans	-121.1	154.9	-155.1	-43.3	0	0	0	0	114
229	A	27	Very low	31.1	Very low	100 Å²	100	144.6 Å²	144.6	83%	0.826	75%	0.754	S	S	*	*			trans	159	166.8	133.2	0	0	0	0	0	113.2
230	L	32.9	Very low	31.8	Very low	170 Å²	170	145.8 Å²	145.8	89%	0.89	75%	0.753	S	S	*	*			trans	-75.6	142.3	-171.1	-60.2	82.2	0	0	0	114.3
231	R	27.4	Very low	31.6	Very low	218 Å²	218	145.4 Å²	145.4	82%	0.823	75%	0.754	S	S	*	*				-172.3	155.9	117	-120.5	-172.2	-168	-110.9	4	114.2
232	D	26.2	Very low	31.4	Very low	111 Å²	111	145.3 Å²	145.3	59%	0.594	75%	0.753	S	S	*	*			trans	38.5	118.9	143.4	-70.1	-16.4	0	0	0	123.4
233	E	26.5	Very low	31.5	Very low	170 Å²	170	150.3 Å²	150.3	79%	0.794	77%	0.765	S	S	*	*				66.5	153.6	114.6	-112	-68	81.5	0	0	122.8
234	S	28.6	Very low	31.6	Very low	100 Å²	100	149 Å²	149	70%	0.699	77%	0.766	S	S	*	*			trans	72.1	96.5	162.7	69.7	0	0	0	0	117.4
235	A	34.2	Very low	31.4	Very low	98 Å²	98	146.4 Å²	146.4	81%	0.81	77%	0.773	S	S	*	*			trans	-103.6	120.6	162.9	0	0	0	0	0	110.7
236	K	32	Very low	31.4	Very low	165 Å²	165	145.2 Å²	145.2	72%	0.717	79%	0.785	S	S	*	*			trans	-160.8	155.4	161.5	-116.6	158.7	-170.6	162.8	0	112.2
237	D	27.8	Very low	31.4	Very low	125 Å²	125	144.6 Å²	144.6	67%	0.668	80%	0.795	S	S	*	*			trans	63.6	141.7	-177.2	-55.9	-47.1	0	0	0	114.5
238	W	27.1	Very low	31.5	Very low	235 Å²	235	137.5 Å²	137.5	89%	0.89	79%	0.79	S	S	*	*			cis	-131.8	172.2	32.5	-82	75.9	0	0	0	116.2
239	K	26.9	Very low	31.7	Very low	177 Å²	177	137.3 Å²	137.3	77%	0.77	79%	0.794	S	S	*	*			trans	-73.9	156	-170.5	-62.3	177	178.3	178.4	0	115.3
240	P	43.8	Very low	31.8	Very low	119 Å²	119	139.4 Å²	139.4	77%	0.773	80%	0.797	S	S	*	*			trans	-85.5	146.8	166.7	35.4	-34.7	0	0	0	113
241	S	31.1	Very low	31.9	Very low	117 Å²	117	137.6 Å²	137.6	82%	0.818	79%	0.793	S	S	*	*			trans	179.6	160.4	163.1	-86.1	0	0	0	0	111
242	P	43.7	Very low	32.9	Very low	117 Å²	117	132.9 Å²	132.9	76%	0.76	79%	0.791	S	S	*	*			cis	-131.4	169.5	-24.1	37.5	-22.3	0	0	0	113.6
243	L	33.2	Very low	33.1	Very low	166 Å²	166	131.3 Å²	131.3	87%	0.869	79%	0.793	S	S	*	*			trans	-118.5	150	152.2	-82.4	173.1	0	0	0	109.5	G245	L243-G245 PolarHBondContact O-N 3.16Å
244	P	37.6	Very low	33.2	Very low	125 Å²	125	132.5 Å²	132.5	81%	0.812	80%	0.796	S	S	*	*			trans	-88.8	116.7	-164.4	-6	26	0	0	0	114.1
245	G	31.5	Very low	33	Very low	73 Å²	73	134.3 Å²	134.3	75%	0.753	80%	0.798	S	S	*	*			trans	20.4	135.1	142	0	0	0	0	0	123	L243	L243-G245 PolarHBondContact O-N 3.16Å
246	V	31.5	Very low	32.8	Very low	149 Å²	149	134.4 Å²	134.4	90%	0.903	79%	0.793	S	S	*	*			trans	-123.4	135.5	141.2	175.3	0	0	0	0	107.8
247	L	34.8	Very low	33	Very low	173 Å²	173	133.7 Å²	133.7	91%	0.906	80%	0.797	S	S	*	*			trans	-93.9	158.9	174.7	-61.8	167.1	0	0	0	109.3
248	G	29.7	Very low	34.1	Very low	75 Å²	75	132 Å²	132	77%	0.773	79%	0.793	S	S	*	*			cis	-177.4	177.1	1.3	0	0	0	0	0	109.8
249	A	32.1	Very low	34.5	Very low	101 Å²	101	129 Å²	129	84%	0.835	79%	0.789	S	S	*	*			trans	-95.8	152.7	-173.2	0	0	0	0	0	114
250	T	28.8	Very low	34.8	Very low	143 Å²	143	127.4 Å²	127.4	88%	0.877	79%	0.787	S	S	*	*			trans	-141.4	132.8	151.7	40.8	0	0	0	0	111.1
251	T	35.2	Very low	34.2	Very low	132 Å²	132	126 Å²	126	81%	0.81	78%	0.78	S	S	*	*			trans	-106.9	174.3	154.8	50.8	0	0	0	0	106.4
252	P	49	Very low	34.4	Very low	120 Å²	120	126.7 Å²	126.7	78%	0.779	77%	0.774	S	S	*	*			cis	-149.5	-157.1	25.5	41.3	-17.1	0	0	0	116.2
253	A	30.4	Very low	34.3	Very low	78 Å²	78	126.8 Å²	126.8	65%	0.645	77%	0.773	S	S	*	*			trans	95.1	118.4	142.4	0	0	0	0	0	121.7
254	F	28.1	Very low	34.6	Very low	194 Å²	194	125.5 Å²	125.5	85%	0.851	77%	0.767	S	S	*	*			trans	61.6	158.7	155.5	-74.2	-103.2	0	0	0	117.7
255	D	25.5	Very low	35.1	Very low	138 Å²	138	127.7 Å²	127.7	74%	0.738	77%	0.766	S	S	*	*			cis	-136.6	-159.5	9.7	-150.9	-22.5	0	0	0	112.7
256	S	30.1	Very low	35.4	Very low	100 Å²	100	132.1 Å²	132.1	70%	0.699	77%	0.773	S	S	*	*			trans	-107.1	169	-149.4	-50.2	0	0	0	0	117.9
257	D	34.2	Very low	36.1	Very low	150 Å²	150	132.4 Å²	132.4	80%	0.802	76%	0.764	S	S	*	*			trans	-60.4	178.2	161.7	-135.2	20.2	0	0	0	112.1
258	P	52.4	Low	36.8	Very low	91 Å²	91	130 Å²	130	59%	0.591	76%	0.759	S	S	*	*			cis	-152.7	-178	34.9	44.9	-22.8	0	0	0	120.4
259	E	34	Very low	37	Very low	171 Å²	171	129.4 Å²	129.4	80%	0.799	75%	0.753	S	S	*	*			trans	69	152.2	147.4	-81.8	161.2	-161.9	0	0	119.8
260	I	34.1	Very low	37	Very low	143 Å²	143	127.9 Å²	127.9	73%	0.733	75%	0.746	S	S	*	*			cis	-141.4	137.9	14.5	19.1	172.1	0	0	0	109.6
261	S	31.1	Very low	37.4	Very low	89 Å²	89	129.5 Å²	129.5	62%	0.622	75%	0.749	S	S	*	*				66.6	144.2	97.1	99.5	0	0	0	0	115.6
262	D	34.6	Very low	37.3	Very low	132 Å²	132	129.4 Å²	129.4	71%	0.706	75%	0.748	S	S	*	*			cis	-152.8	140.3	22.5	-96.2	-48.6	0	0	0	110.5
263	V	42.6	Very low	36.3	Very low	119 Å²	119	126.7 Å²	126.7	72%	0.721	74%	0.742	S	S	*	*				75.4	140.9	87.9	171.4	0	0	0	0	113.7
264	D	39.6	Very low	36.4	Very low	139 Å²	139	128.6 Å²	128.6	74%	0.743	75%	0.746	S	S	*	*			cis	-126.8	147.1	15.6	-94.2	-53.6	0	0	0	110.9
265	E	48	Very low	36.5	Very low	171 Å²	171	127.8 Å²	127.8	80%	0.799	75%	0.745	S	S	*	*				74.7	116.8	69.9	-75.6	-81.4	92.9	0	0	117.1
266	D	37	Very low	36.9	Very low	167 Å²	167	126.7 Å²	126.7	89%	0.893	74%	0.742	S	S	*	*			trans	178.9	112.8	135.4	-119.1	-26.4	0	0	0	112.3
267	E	46.2	Very low	36.9	Very low	154 Å²	154	128.7 Å²	128.7	72%	0.72	75%	0.746	S	S	*	*			trans	-156.3	146.5	171.7	-157.9	-84.4	157.1	0	0	109.6	G269	E267-G269 PolarHBondContact OE1-N 3.31Å; E267-G269 PolarHBondContact OE2-N 2.88Å
268	P	49.8	Very low	37.1	Very low	124 Å²	124	127.4 Å²	127.4	81%	0.805	74%	0.743	S	S	*	*			trans	-148.6	99	150.8	34.5	-15.2	0	0	0	117.4
269	G	33.9	Very low	36.1	Very low	62 Å²	62	130.1 Å²	130.1	64%	0.639	75%	0.751	S	S	*	*				77.5	160.6	126.6	0	0	0	0	0	120.7	E267	E267-G269 PolarHBondContact OE1-N 3.31Å; E267-G269 PolarHBondContact OE2-N 2.88Å
270	G	31.7	Very low	36.2	Very low	68 Å²	68	128 Å²	128	70%	0.701	75%	0.754	S	S	*	*			cis	160.1	177.8	-5.7	0	0	0	0	0	113.9
271	L	38.4	Very low	36.4	Very low	177 Å²	177	126.6 Å²	126.6	93%	0.927	76%	0.755	S	S	*	*			trans	69.6	131.3	169.3	-59.5	163.2	0	0	0	115.4
272	V	32.5	Very low	36.7	Very low	130 Å²	130	124.9 Å²	124.9	79%	0.788	75%	0.751	S	S	*	*			cis	-145.1	158.3	9	-175.1	0	0	0	0	106.2
273	G	28	Very low	37.3	Very low	64 Å²	64	122.3 Å²	122.3	66%	0.66	76%	0.756	S	S	*	*			cis	108.1	159	20.6	0	0	0	0	0	111.2
274	T	32.6	Very low	37.7	Very low	118 Å²	118	122.8 Å²	122.8	72%	0.724	75%	0.75	S	S	*	*			cis	-168.4	148.7	-3.4	-76.9	0	0	0	0	109.3
275	Q	30.6	Very low	38.3	Very low	177 Å²	177	119.8 Å²	119.8	83%	0.827	74%	0.74	S	S	*	*			trans	65.8	172.2	170	-80.2	179.5	-86.1	0	0	118.5
276	V	32.7	Very low	39	Very low	114 Å²	114	117.6 Å²	117.6	69%	0.691	73%	0.733	S	S	*	*				-177.6	147.2	-51.6	136.8	0	0	0	0	108.6
277	D	31.5	Very low	40.5	Very low	143 Å²	143	113.1 Å²	113.1	77%	0.765	72%	0.72	S	S	*	*			trans	67.2	126.1	163.7	-80.5	-18.6	0	0	0	124.3
278	V	37.8	Very low	41.8	Very low	122 Å²	122	112.9 Å²	112.9	74%	0.739	72%	0.719	S	S	*	*			trans	59.8	105.9	134	-174.7	0	0	0	0	120.1
279	I	31.2	Very low	43.3	Very low	149 Å²	149	110.6 Å²	110.6	76%	0.764	70%	0.702	S	S	*	*				-170.2	136.2	116.1	-93.4	153.9	0	0	0	108.4
280	S	36.2	Very low	45.3	Very low	125 Å²	125	112.5 Å²	112.5	87%	0.874	70%	0.698	S	S	*	*			trans	-99.5	124.3	169.6	-59	0	0	0	0	111.4
281	P	38.4	Very low	47.7	Very low	115 Å²	115	111.8 Å²	111.8	75%	0.747	69%	0.685	S	S	*	*			trans	-118	107.5	165.3	34.3	-21.5	0	0	0	112.3
282	G	37.8	Very low	49.9	Very low	52 Å²	52	109.6 Å²	109.6	54%	0.536	67%	0.671	S	S	.	*			trans	77	109.2	158.3	0	0	0	0	0	117.7	H284	G282-H284 PolarHBondContact O-N 3.06Å
283	G	46.8	Very low	52.5	Low	78 Å²	78	108.7 Å²	108.7	80%	0.804	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	60.2	166.5	0	0	0	0	0	113.2
284	H	50.2	Low	55.4	Low	129 Å²	129	110.4 Å²	110.4	60%	0.597	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.6	-20.1	177.5	-74.2	-90.1	0	0	0	112.9	G282	G282-H284 PolarHBondContact O-N 3.06Å
285	S	53.5	Low	58	Low	77 Å²	77	109.5 Å²	109.5	54%	0.538	64%	0.641	S	S	.	*	H	α-helix	trans	-66.6	-48.4	176.5	46.2	0	0	0	0	112.7	A287 Q288 T289	S285-A287 PolarHBondContact O-N 3.23Å; S285-Q288 PolarHBondContact O-N 3.47Å; S285-T289 PolarHBondContact O-N 2.98Å; S285-T289 PolarHBondContact O-OG1 3.25Å
286	D	61.6	Low	60.8	Low	124 Å²	124	107.3 Å²	107.3	66%	0.663	63%	0.631	S	S	*	*	H	α-helix	trans	-55.1	-51.3	-173.9	-172.1	44.1	0	0	0	112.9	Q288 T289 L290	D286-Q288 VanDerWaalsContact C-N 3.28Å; D286-Q288 PolarHBondContact O-N 2.59Å; D286-T289 PolarHBondContact O-N 2.82Å; D286-L290 WeakPolarHBondContact O-CB 3.26Å; D286-L290 PolarHBondContact O-N 3.25Å
287	A	69.1	Low	63.4	Low	73 Å²	73	107.7 Å²	107.7	60%	0.603	63%	0.625	S	S	*	*	H	α-helix	trans	-63.1	-31.8	176.8	0	0	0	0	0	113.3	S285 A291	S285-A287 PolarHBondContact O-N 3.23Å; A287-A291 VanDerWaalsContact O-CB 3.27Å; A287-A291 WeakPolarHBondContact O-CB 3.47Å; A287-A291 PolarHBondContact O-N 3.48Å
288	Q	73.8	Confident	66	Low	150 Å²	150	105.4 Å²	105.4	70%	0.701	61%	0.612	S	S	*	*	H	α-helix	trans	-80.8	-34.8	179.9	-168.2	163	-1.1	0	0	112.2	S285 D286 M292	S285-Q288 PolarHBondContact O-N 3.47Å; D286-Q288 VanDerWaalsContact C-N 3.28Å; D286-Q288 PolarHBondContact O-N 2.59Å; Q288-M292 WeakPolarHBondContact O-CB 3.29Å; Q288-M292 PolarHBondContact O-N 3.03Å
289	T	80.1	Confident	68.6	Low	75 Å²	75	103.3 Å²	103.3	46%	0.46	60%	0.597	S	S	.	*	H	α-helix	trans	-64.2	-45.1	168.2	-64.7	0	0	0	0	110.9	S285 D286 A291 M292 M293	S285-T289 PolarHBondContact O-N 2.98Å; S285-T289 PolarHBondContact O-OG1 3.25Å; D286-T289 PolarHBondContact O-N 2.82Å; T289-A291 PolarHBondContact O-N 3.3Å; T289-M292 PolarHBondContact O-N 3.08Å; T289-M292 VanDerWaalsContact O-N 3.17Å; T289-M293 HydrophobicContact CG2-SD 4.42Å; T289-M293 WeakPolarHBondContact O-CG 3.2Å; T289-M293 PolarHBondContact O-N 3.35Å
290	L	77.8	Confident	71.3	Confident	103 Å²	103	98.7 Å²	98.7	54%	0.539	58%	0.581	S	S	.	*	H	α-helix	trans	-63.4	-40.8	177	-162.7	108.5	0	0	0	111.9	D286 M292 M293 L294	D286-L290 WeakPolarHBondContact O-CB 3.26Å; D286-L290 PolarHBondContact O-N 3.25Å; L290-M292 VanDerWaalsContact C-N 3.34Å; L290-M293 PolarHBondContact O-N 3.47Å; L290-L294 HydrophobicContact CD2-CD1 3.97Å; L290-L294 HydrophobicContact CG-CD1 4.44Å; L290-L294 WeakPolarHBondContact O-CB 3.45Å; L290-L294 VanDerWaalsContact O-CG 3.31Å; L290-L294 WeakPolarHBondContact O-CG 3.38Å; L290-L294 PolarHBondContact O-N 2.96Å
291	A	81.8	Confident	73.8	Confident	53 Å²	53	96.9 Å²	96.9	44%	0.438	56%	0.561	S	S	.	*	H	α-helix	trans	-63.2	-38.6	173	0	0	0	0	0	112.5	A287 T289 L294 Q295	A287-A291 VanDerWaalsContact O-CB 3.27Å; A287-A291 WeakPolarHBondContact O-CB 3.47Å; A287-A291 PolarHBondContact O-N 3.48Å; T289-A291 PolarHBondContact O-N 3.3Å; A291-L294 PolarHBondContact O-N 3.2Å; A291-Q295 WeakPolarHBondContact O-CB 3.48Å; A291-Q295 PolarHBondContact O-N 2.95Å
292	M	83.3	Confident	76.2	Confident	130 Å²	130	95.1 Å²	95.1	64%	0.64	55%	0.545	S	S	*	.	H	α-helix	trans	-68	-40.1	176.9	-164	173.3	76.4	0	0	111.9	Q288 T289 L290 Q295 E296	Q288-M292 WeakPolarHBondContact O-CB 3.29Å; Q288-M292 PolarHBondContact O-N 3.03Å; T289-M292 PolarHBondContact O-N 3.08Å; T289-M292 VanDerWaalsContact O-N 3.17Å; L290-M292 VanDerWaalsContact C-N 3.34Å; M292-Q295 PolarHBondContact O-N 3.02Å; M292-E296 WeakPolarHBondContact O-CB 3.12Å; M292-E296 PolarHBondContact O-N 3.34Å
293	M	88.6	Confident	78.7	Confident	112 Å²	112	98 Å²	98	55%	0.552	54%	0.544	S	S	*	.	H	α-helix	trans	-65.5	-40.9	172.7	-70.4	179.8	69.1	0	0	112.2	T289 L290 Q295 E296 Q297	T289-M293 HydrophobicContact CG2-SD 4.42Å; T289-M293 WeakPolarHBondContact O-CG 3.2Å; T289-M293 PolarHBondContact O-N 3.35Å; L290-M293 PolarHBondContact O-N 3.47Å; M293-Q295 VanDerWaalsContact C-N 3.33Å; M293-E296 PolarHBondContact O-N 3.29Å; M293-Q297 WeakPolarHBondContact O-CB 3.37Å; M293-Q297 VanDerWaalsContact O-CG 3.29Å; M293-Q297 WeakPolarHBondContact O-CG 3.44Å; M293-Q297 PolarHBondContact O-N 3.12Å
294	L	87.6	Confident	80.9	Confident	99 Å²	99	99.6 Å²	99.6	52%	0.518	53%	0.531	S	S	.	.	H	α-helix	trans	-65.1	-37.3	175	-74.7	169.2	0	0	0	111.9	L290 A291 L298	L290-L294 HydrophobicContact CD2-CD1 3.97Å; L290-L294 HydrophobicContact CG-CD1 4.44Å; L290-L294 WeakPolarHBondContact O-CB 3.45Å; L290-L294 VanDerWaalsContact O-CG 3.31Å; L290-L294 WeakPolarHBondContact O-CG 3.38Å; L290-L294 PolarHBondContact O-N 2.96Å; A291-L294 PolarHBondContact O-N 3.2Å; L294-L298 VanDerWaalsContact O-CD1 3.31Å; L294-L298 WeakPolarHBondContact O-CD1 3.33Å; L294-L298 PolarHBondContact O-N 3.04Å
295	Q	88.3	Confident	82.8	Confident	100 Å²	100	98 Å²	98	47%	0.467	53%	0.526	S	S	.	.	H	α-helix	trans	-65.3	-45.6	173.3	-175.8	60.6	49.7	0	0	111.4	A291 M292 M293 Q297 L298 D299	A291-Q295 WeakPolarHBondContact O-CB 3.48Å; A291-Q295 PolarHBondContact O-N 2.95Å; M292-Q295 PolarHBondContact O-N 3.02Å; M293-Q295 VanDerWaalsContact C-N 3.33Å; Q295-Q297 VanDerWaalsContact C-N 3.33Å; Q295-Q297 PolarHBondContact O-N 3.01Å; Q295-L298 WeakPolarHBondContact O-CB 3.37Å; Q295-L298 PolarHBondContact O-N 3.25Å; Q295-L298 VanDerWaalsContact O-N 3.15Å; Q295-D299 VanDerWaalsContact NE2-CG 3.27Å; Q295-D299 PolarHBondContact NE2-OD1 2.91Å; Q295-D299 PolarHBondContact NE2-OD2 3.22Å; Q295-D299 WeakPolarHBondContact O-CB 3.29Å; Q295-D299 PolarHBondContact O-N 3.17Å
296	E	89.5	Confident	84.7	Confident	130 Å²	130	101 Å²	101	61%	0.607	53%	0.525	S	S	*	.	H	α-helix	trans	-61.9	-38.7	176.3	-175	172.7	-147.7	0	0	112.2	M292 M293 D299 A300	M292-E296 WeakPolarHBondContact O-CB 3.12Å; M292-E296 PolarHBondContact O-N 3.34Å; M293-E296 PolarHBondContact O-N 3.29Å; E296-D299 PolarHBondContact O-N 3.21Å; E296-A300 WeakPolarHBondContact O-CB 3.47Å; E296-A300 PolarHBondContact O-N 3.16Å
297	Q	85.6	Confident	86.1	Confident	122 Å²	122	100.3 Å²	100.3	57%	0.57	52%	0.52	S	S	*	.	H	α-helix	trans	-66.4	-41.4	171.4	-69.7	-66.5	-81.9	0	0	112.4	M293 Q295 I301	M293-Q297 WeakPolarHBondContact O-CB 3.37Å; M293-Q297 VanDerWaalsContact O-CG 3.29Å; M293-Q297 WeakPolarHBondContact O-CG 3.44Å; M293-Q297 PolarHBondContact O-N 3.12Å; Q295-Q297 VanDerWaalsContact C-N 3.33Å; Q295-Q297 PolarHBondContact O-N 3.01Å; Q297-I301 WeakPolarHBondContact O-CB 3.45Å; Q297-I301 WeakPolarHBondContact O-CD1 3.25Å; Q297-I301 VanDerWaalsContact O-CG1 3.24Å; Q297-I301 WeakPolarHBondContact O-CG1 3.43Å; Q297-I301 PolarHBondContact O-N 2.91Å
298	L	87.8	Confident	87	Confident	95 Å²	95	101.5 Å²	101.5	50%	0.497	52%	0.515	S	S	.	.	H	α-helix	trans	-61.5	-43.8	173.6	-105.9	92.4	0	0	0	111.7	L294 Q295 I301 N302	L294-L298 VanDerWaalsContact O-CD1 3.31Å; L294-L298 WeakPolarHBondContact O-CD1 3.33Å; L294-L298 PolarHBondContact O-N 3.04Å; Q295-L298 WeakPolarHBondContact O-CB 3.37Å; Q295-L298 PolarHBondContact O-N 3.25Å; Q295-L298 VanDerWaalsContact O-N 3.15Å; L298-I301 PolarHBondContact O-N 3.44Å; L298-N302 WeakPolarHBondContact O-CB 3.39Å; L298-N302 PolarHBondContact O-N 3.04Å; L298-N302 PolarHBondContact O-ND2 2.93Å
299	D	90.9	Very high	87.6	Confident	79 Å²	79	99.8 Å²	99.8	42%	0.422	51%	0.507	S	S	.	.	H	α-helix	trans	-71.2	-34.7	-178.1	-70.9	-32.7	0	0	0	112	Q295 E296 N302 Q303	Q295-D299 VanDerWaalsContact NE2-CG 3.27Å; Q295-D299 PolarHBondContact NE2-OD1 2.91Å; Q295-D299 PolarHBondContact NE2-OD2 3.22Å; Q295-D299 WeakPolarHBondContact O-CB 3.29Å; Q295-D299 PolarHBondContact O-N 3.17Å; E296-D299 PolarHBondContact O-N 3.21Å; D299-N302 PolarHBondContact O-N 3.26Å; D299-Q303 WeakPolarHBondContact O-CB 3.31Å; D299-Q303 PolarHBondContact O-N 3.46Å
300	A	88.9	Confident	88.2	Confident	51 Å²	51	101.8 Å²	101.8	42%	0.421	51%	0.511	S	S	.	.	H	α-helix	trans	-61.3	-47.8	168.2	0	0	0	0	0	111.9	E296 N302 Q303 E304	E296-A300 WeakPolarHBondContact O-CB 3.47Å; E296-A300 PolarHBondContact O-N 3.16Å; A300-N302 PolarHBondContact O-N 3.36Å; A300-Q303 PolarHBondContact O-N 2.61Å; A300-Q303 VanDerWaalsContact O-N 3.16Å; A300-E304 PolarHBondContact O-N 3.08Å
301	I	88.3	Confident	88.7	Confident	88 Å²	88	103.3 Å²	103.3	45%	0.451	52%	0.515	S	S	.	.	H	α-helix	trans	-62.3	-42.4	176.3	-70.1	164.4	0	0	0	110.9	Q297 L298 Q303 E304 I305	Q297-I301 WeakPolarHBondContact O-CB 3.45Å; Q297-I301 WeakPolarHBondContact O-CD1 3.25Å; Q297-I301 VanDerWaalsContact O-CG1 3.24Å; Q297-I301 WeakPolarHBondContact O-CG1 3.43Å; Q297-I301 PolarHBondContact O-N 2.91Å; L298-I301 PolarHBondContact O-N 3.44Å; I301-Q303 VanDerWaalsContact C-N 3.27Å; I301-Q303 PolarHBondContact O-N 3.38Å; I301-E304 PolarHBondContact O-N 3Å; I301-I305 HydrophobicContact CG2-CD1 3.77Å; I301-I305 HydrophobicContact CG2-CG1 4.4Å; I301-I305 WeakPolarHBondContact O-CB 3.43Å; I301-I305 VanDerWaalsContact O-CG1 3.25Å; I301-I305 WeakPolarHBondContact O-CG1 3.43Å; I301-I305 PolarHBondContact O-N 3.06Å
302	N	88.3	Confident	89.1	Confident	77 Å²	77	105 Å²	105	41%	0.412	51%	0.512	S	S	.	.	H	α-helix	trans	-63.8	-32	175.8	-74.2	-38.2	0	0	0	112.4	L298 D299 A300 R306	L298-N302 WeakPolarHBondContact O-CB 3.39Å; L298-N302 PolarHBondContact O-N 3.04Å; L298-N302 PolarHBondContact O-ND2 2.93Å; D299-N302 PolarHBondContact O-N 3.26Å; A300-N302 PolarHBondContact O-N 3.36Å; N302-R306 WeakPolarHBondContact O-CB 3.33Å; N302-R306 PolarHBondContact O-N 2.79Å; N302-R306 VanDerWaalsContact O-N 3.16Å
303	Q	91.6	Very high	89.4	Confident	113 Å²	113	104.3 Å²	104.3	53%	0.528	51%	0.508	S	S	.	.	H	α-helix	trans	-78.3	-36.5	175.7	-170.3	160.5	15	0	0	112.1	D299 A300 I301 R306 M307	D299-Q303 WeakPolarHBondContact O-CB 3.31Å; D299-Q303 PolarHBondContact O-N 3.46Å; A300-Q303 PolarHBondContact O-N 2.61Å; A300-Q303 VanDerWaalsContact O-N 3.16Å; I301-Q303 VanDerWaalsContact C-N 3.27Å; I301-Q303 PolarHBondContact O-N 3.38Å; Q303-R306 WeakPolarHBondContact O-CB 3.47Å; Q303-R306 PolarHBondContact O-N 3.32Å; Q303-M307 WeakPolarHBondContact O-CG 3.34Å; Q303-M307 PolarHBondContact O-N 3.07Å
304	E	92.8	Very high	89.4	Confident	112 Å²	112	102 Å²	102	52%	0.523	50%	0.502	S	S	.	.	H	α-helix	trans	-64.8	-46.3	171.6	-173.2	173.7	-160.4	0	0	111.4	A300 I301 R306 M307 I308	A300-E304 PolarHBondContact O-N 3.08Å; I301-E304 PolarHBondContact O-N 3Å; E304-R306 PolarHBondContact O-N 2.92Å; E304-M307 PolarHBondContact O-N 3.18Å; E304-M307 VanDerWaalsContact O-N 3.14Å; E304-I308 HydrophobicContact CG-CD1 3.93Å; E304-I308 WeakPolarHBondContact O-CB 3.49Å; E304-I308 VanDerWaalsContact O-CG1 3.32Å; E304-I308 WeakPolarHBondContact O-CG1 3.36Å; E304-I308 PolarHBondContact O-N 3.27Å
305	I	90.1	Very high	89.1	Confident	96 Å²	96	100.6 Å²	100.6	49%	0.492	50%	0.498	S	S	.	.	H	α-helix	trans	-56.6	-39.6	172.6	-71	167.4	0	0	0	110.9	I301 I308 Q309	I301-I305 HydrophobicContact CG2-CD1 3.77Å; I301-I305 HydrophobicContact CG2-CG1 4.4Å; I301-I305 WeakPolarHBondContact O-CB 3.43Å; I301-I305 VanDerWaalsContact O-CG1 3.25Å; I301-I305 WeakPolarHBondContact O-CG1 3.43Å; I301-I305 PolarHBondContact O-N 3.06Å; I305-I308 PolarHBondContact O-N 3.33Å; I305-Q309 WeakPolarHBondContact O-CB 3.39Å; I305-Q309 PolarHBondContact O-N 3.49Å
306	R	93.9	Very high	89.1	Confident	139 Å²	139	100.2 Å²	100.2	53%	0.525	50%	0.496	S	S	.	.	H	α-helix	trans	-65.3	-46.8	175.6	-167.9	-175.2	-55	147.9	11.8	111.9	N302 Q303 E304 I308 Q309 E310	N302-R306 WeakPolarHBondContact O-CB 3.33Å; N302-R306 PolarHBondContact O-N 2.79Å; N302-R306 VanDerWaalsContact O-N 3.16Å; Q303-R306 WeakPolarHBondContact O-CB 3.47Å; Q303-R306 PolarHBondContact O-N 3.32Å; E304-R306 PolarHBondContact O-N 2.92Å; R306-I308 VanDerWaalsContact C-N 3.33Å; R306-I308 PolarHBondContact O-N 2.93Å; R306-Q309 PolarHBondContact O-N 3.31Å; R306-Q309 VanDerWaalsContact O-N 3.15Å; R306-E310 WeakPolarHBondContact CD-OE1 3.3Å; R306-E310 WeakPolarHBondContact CG-OE1 3.35Å; R306-E310 WeakPolarHBondContact O-CB 3.5Å; R306-E310 WeakPolarHBondContact O-CG 3.39Å; R306-E310 PolarHBondContact O-N 2.8Å
307	M	90.3	Very high	88.7	Confident	110 Å²	110	98.8 Å²	98.8	54%	0.542	49%	0.493	S	S	.	.	H	α-helix	trans	-62.5	-38.8	176.7	-69.7	-172.5	-59.2	0	0	112.1	Q303 E304 Q309 E310 E311	Q303-M307 WeakPolarHBondContact O-CG 3.34Å; Q303-M307 PolarHBondContact O-N 3.07Å; E304-M307 PolarHBondContact O-N 3.18Å; E304-M307 VanDerWaalsContact O-N 3.14Å; M307-Q309 VanDerWaalsContact C-N 3.33Å; M307-Q309 PolarHBondContact O-N 3.07Å; M307-E310 PolarHBondContact O-N 2.83Å; M307-E311 WeakPolarHBondContact O-CB 3.48Å; M307-E311 PolarHBondContact O-N 2.89Å
308	I	89.1	Confident	88.5	Confident	98 Å²	98	100.4 Å²	100.4	50%	0.503	49%	0.493	S	S	.	.	H	α-helix	trans	-64.2	-38.4	174.1	-69.5	167.2	0	0	0	111	E304 I305 R306 K312	E304-I308 HydrophobicContact CG-CD1 3.93Å; E304-I308 WeakPolarHBondContact O-CB 3.49Å; E304-I308 VanDerWaalsContact O-CG1 3.32Å; E304-I308 WeakPolarHBondContact O-CG1 3.36Å; E304-I308 PolarHBondContact O-N 3.27Å; I305-I308 PolarHBondContact O-N 3.33Å; R306-I308 VanDerWaalsContact C-N 3.33Å; R306-I308 PolarHBondContact O-N 2.93Å; I308-K312 VanDerWaalsContact O-CB 3.3Å; I308-K312 WeakPolarHBondContact O-CB 3.47Å; I308-K312 PolarHBondContact O-N 3.48Å
309	Q	85.1	Confident	88.1	Confident	114 Å²	114	98.4 Å²	98.4	53%	0.533	49%	0.491	S	S	.	.	H	α-helix	trans	-71.8	-38.6	177.2	-164.3	71.6	9	0	0	112.1	I305 R306 M307 K312 E313	I305-Q309 WeakPolarHBondContact O-CB 3.39Å; I305-Q309 PolarHBondContact O-N 3.49Å; R306-Q309 PolarHBondContact O-N 3.31Å; R306-Q309 VanDerWaalsContact O-N 3.15Å; M307-Q309 VanDerWaalsContact C-N 3.33Å; M307-Q309 PolarHBondContact O-N 3.07Å; Q309-K312 WeakPolarHBondContact O-CB 3.45Å; Q309-K312 PolarHBondContact O-N 2.95Å; Q309-E313 PolarHBondContact O-N 3.32Å
310	E	92.3	Very high	87.7	Confident	116 Å²	116	99.9 Å²	99.9	54%	0.542	50%	0.495	S	S	.	.	H	α-helix	trans	-67	-40.1	173.3	-72.5	173	-161.8	0	0	111.6	R306 M307 E313 S314	R306-E310 WeakPolarHBondContact CD-OE1 3.3Å; R306-E310 WeakPolarHBondContact CG-OE1 3.35Å; R306-E310 WeakPolarHBondContact O-CB 3.5Å; R306-E310 WeakPolarHBondContact O-CG 3.39Å; R306-E310 PolarHBondContact O-N 2.8Å; M307-E310 PolarHBondContact O-N 2.83Å; E310-E313 PolarHBondContact O-N 3.39Å; E310-S314 WeakPolarHBondContact O-CB 3.37Å; E310-S314 PolarHBondContact O-N 3.45Å
311	E	89.4	Confident	87	Confident	135 Å²	135	101.6 Å²	101.6	63%	0.631	49%	0.494	S	S	*	.	H	α-helix	trans	-67.1	-40.9	172.3	-175.2	169.4	-166	0	0	111.1	M307 S314 T315	M307-E311 WeakPolarHBondContact O-CB 3.48Å; M307-E311 PolarHBondContact O-N 2.89Å; E311-S314 WeakPolarHBondContact O-CB 3.47Å; E311-S314 PolarHBondContact O-N 3.3Å; E311-T315 HydrophobicContact CG-CG2 4.42Å; E311-T315 WeakPolarHBondContact O-CG2 3.33Å; E311-T315 PolarHBondContact O-N 3.47Å; E311-T315 PolarHBondContact O-OG1 3.28Å
312	K	90.6	Very high	86.4	Confident	88 Å²	88	102 Å²	102	38%	0.383	50%	0.496	S	S	.	.	H	α-helix	trans	-54.9	-55.7	171.9	-178.8	-173	176.6	-76.5	0	110	I308 Q309 S314 T315 E316	I308-K312 VanDerWaalsContact O-CB 3.3Å; I308-K312 WeakPolarHBondContact O-CB 3.47Å; I308-K312 PolarHBondContact O-N 3.48Å; Q309-K312 WeakPolarHBondContact O-CB 3.45Å; Q309-K312 PolarHBondContact O-N 2.95Å; K312-S314 VanDerWaalsContact C-N 3.27Å; K312-S314 PolarHBondContact O-N 2.87Å; K312-T315 CarbonylContact O-C 3.39Å; K312-T315 PolarHBondContact O-N 2.97Å; K312-T315 PolarHBondContact O-OG1 3.4Å; K312-E316 IonicContact NZ-OE1 3.67Å; K312-E316 PolarHBondContact NZ-OE1 3.31Å; K312-E316 IonicContact NZ-OE2 2.79Å; K312-E316 PolarHBondContact NZ-OE2 3.11Å; K312-E316 VanDerWaalsContact O-CB 3.32Å; K312-E316 WeakPolarHBondContact O-CB 3.36Å; K312-E316 PolarHBondContact O-N 2.81Å
313	E	88.4	Confident	85.6	Confident	117 Å²	117	104.6 Å²	104.6	55%	0.547	51%	0.506	S	S	.	.	H	α-helix	trans	-58.8	-38.9	179.7	-170.6	174.6	173.4	0	0	111.5	Q309 E310 T315 E316 L317	Q309-E313 PolarHBondContact O-N 3.32Å; E310-E313 PolarHBondContact O-N 3.39Å; E313-T315 PolarHBondContact O-N 3.28Å; E313-E316 PolarHBondContact O-N 3.1Å; E313-L317 HydrophobicContact CG-CD1 4.22Å; E313-L317 WeakPolarHBondContact O-CB 3.42Å; E313-L317 VanDerWaalsContact O-CG 3.32Å; E313-L317 WeakPolarHBondContact O-CG 3.25Å; E313-L317 PolarHBondContact O-N 3.5Å
314	S	89.3	Confident	84.4	Confident	62 Å²	62	103 Å²	103	43%	0.434	50%	0.504	S	S	.	.	H	α-helix	trans	-63.8	-38.7	173.8	-161.5	0	0	0	0	113.4	E310 E311 K312 R318	E310-S314 WeakPolarHBondContact O-CB 3.37Å; E310-S314 PolarHBondContact O-N 3.45Å; E311-S314 WeakPolarHBondContact O-CB 3.47Å; E311-S314 PolarHBondContact O-N 3.3Å; K312-S314 VanDerWaalsContact C-N 3.27Å; K312-S314 PolarHBondContact O-N 2.87Å; S314-R318 VanDerWaalsContact O-CB 3.31Å; S314-R318 WeakPolarHBondContact O-CB 3.43Å; S314-R318 PolarHBondContact O-N 3.31Å; S314-R318 VanDerWaalsContact O-N 3.14Å
315	T	81.3	Confident	83.1	Confident	70 Å²	70	103.9 Å²	103.9	43%	0.429	50%	0.503	S	S	.	.	H	α-helix	trans	-74.3	-32	174.6	61.1	0	0	0	0	112.9	E311 K312 E313 R318 A319	E311-T315 HydrophobicContact CG-CG2 4.42Å; E311-T315 WeakPolarHBondContact O-CG2 3.33Å; E311-T315 PolarHBondContact O-N 3.47Å; E311-T315 PolarHBondContact O-OG1 3.28Å; K312-T315 CarbonylContact O-C 3.39Å; K312-T315 PolarHBondContact O-N 2.97Å; K312-T315 PolarHBondContact O-OG1 3.4Å; E313-T315 PolarHBondContact O-N 3.28Å; T315-R318 PolarHBondContact O-N 3.31Å; T315-A319 WeakPolarHBondContact O-CB 3.49Å; T315-A319 PolarHBondContact O-N 2.98Å
316	E	87.3	Confident	81.6	Confident	92 Å²	92	103.9 Å²	103.9	43%	0.43	51%	0.507	S	S	.	.	H	α-helix	trans	-69.6	-49.6	177.5	-161.4	156.5	-134.9	0	0	110	K312 E313 R318 A319 E320	K312-E316 IonicContact NZ-OE1 3.67Å; K312-E316 PolarHBondContact NZ-OE1 3.31Å; K312-E316 IonicContact NZ-OE2 2.79Å; K312-E316 PolarHBondContact NZ-OE2 3.11Å; K312-E316 VanDerWaalsContact O-CB 3.32Å; K312-E316 WeakPolarHBondContact O-CB 3.36Å; K312-E316 PolarHBondContact O-N 2.81Å; E313-E316 PolarHBondContact O-N 3.1Å; E316-R318 VanDerWaalsContact C-N 3.27Å; E316-R318 PolarHBondContact O-N 3.02Å; E316-A319 CarbonylContact O-C 3.57Å; E316-A319 WeakPolarHBondContact O-CA 3.46Å; E316-A319 WeakPolarHBondContact O-CB 3.29Å; E316-A319 PolarHBondContact O-N 2.82Å; E316-E320 WeakPolarHBondContact O-CG 3.38Å; E316-E320 PolarHBondContact O-N 3.15Å
317	L	82.6	Confident	79.2	Confident	101 Å²	101	102.2 Å²	102.2	53%	0.529	51%	0.512	S	S	.	.	H	α-helix	trans	-59.4	-34.8	171.1	-70.5	169.3	0	0	0	112.7	E313 E321	E313-L317 HydrophobicContact CG-CD1 4.22Å; E313-L317 WeakPolarHBondContact O-CB 3.42Å; E313-L317 VanDerWaalsContact O-CG 3.32Å; E313-L317 WeakPolarHBondContact O-CG 3.25Å; E313-L317 PolarHBondContact O-N 3.5Å; L317-E321 WeakPolarHBondContact O-CB 3.45Å; L317-E321 PolarHBondContact O-N 2.91Å
318	R	80.9	Confident	77.2	Confident	155 Å²	155	102 Å²	102	59%	0.585	52%	0.522	S	S	*	.	H	α-helix	trans	-71.4	-33.3	173.4	179.7	175.9	-74.9	139.1	-0.5	112.2	S314 T315 E316 I322	S314-R318 VanDerWaalsContact O-CB 3.31Å; S314-R318 WeakPolarHBondContact O-CB 3.43Å; S314-R318 PolarHBondContact O-N 3.31Å; S314-R318 VanDerWaalsContact O-N 3.14Å; T315-R318 PolarHBondContact O-N 3.31Å; E316-R318 VanDerWaalsContact C-N 3.27Å; E316-R318 PolarHBondContact O-N 3.02Å; R318-I322 HydrophobicContact CG-CD1 4.44Å; R318-I322 WeakPolarHBondContact O-CG1 3.22Å; R318-I322 PolarHBondContact O-N 3.13Å; R318-I322 VanDerWaalsContact O-N 3.14Å
319	A	78.5	Confident	75.1	Confident	54 Å²	54	100.3 Å²	100.3	45%	0.446	53%	0.529	S	S	.	.	H	α-helix	trans	-70	-43.9	174	0	0	0	0	0	110.8	T315 E316 E321 I322 E323	T315-A319 WeakPolarHBondContact O-CB 3.49Å; T315-A319 PolarHBondContact O-N 2.98Å; E316-A319 CarbonylContact O-C 3.57Å; E316-A319 WeakPolarHBondContact O-CA 3.46Å; E316-A319 WeakPolarHBondContact O-CB 3.29Å; E316-A319 PolarHBondContact O-N 2.82Å; A319-E321 VanDerWaalsContact C-N 3.32Å; A319-E321 PolarHBondContact O-N 3.23Å; A319-I322 CarbonylContact O-C 3.55Å; A319-I322 WeakPolarHBondContact O-CA 3.31Å; A319-I322 WeakPolarHBondContact O-CB 3.31Å; A319-I322 PolarHBondContact O-N 3.23Å; A319-E323 PolarHBondContact O-N 2.85Å
320	E	82.2	Confident	72.9	Confident	109 Å²	109	99.4 Å²	99.4	51%	0.509	54%	0.535	S	S	.	.	H	α-helix	trans	-60.8	-38.3	171.6	-69.8	-175.1	166.8	0	0	111.9	E316 I322 E323 T324	E316-E320 WeakPolarHBondContact O-CG 3.38Å; E316-E320 PolarHBondContact O-N 3.15Å; E320-I322 VanDerWaalsContact C-N 3.28Å; E320-I322 PolarHBondContact O-N 3.01Å; E320-E323 PolarHBondContact O-N 3.45Å; E320-T324 WeakPolarHBondContact O-CB 3.4Å; E320-T324 VanDerWaalsContact O-CG2 3.31Å; E320-T324 WeakPolarHBondContact O-CG2 3.24Å; E320-T324 PolarHBondContact O-N 2.83Å; E320-T324 PolarHBondContact O-OG1 2.77Å
321	E	75.4	Confident	70.3	Confident	88 Å²	88	102.2 Å²	102.2	41%	0.411	55%	0.55	S	S	.	.	H	α-helix	trans	-62	-37.1	172.4	-158.1	-161.3	-156.6	0	0	111.4	L317 A319 T324 R325	L317-E321 WeakPolarHBondContact O-CB 3.45Å; L317-E321 PolarHBondContact O-N 2.91Å; A319-E321 VanDerWaalsContact C-N 3.32Å; A319-E321 PolarHBondContact O-N 3.23Å; E321-T324 WeakPolarHBondContact CA-OG1 3.44Å; E321-T324 PolarHBondContact O-OG1 3.4Å; E321-R325 VanDerWaalsContact O-CB 3.23Å; E321-R325 WeakPolarHBondContact O-CB 3.11Å; E321-R325 WeakPolarHBondContact O-CD 3.17Å; E321-R325 WeakPolarHBondContact O-CG 3.17Å; E321-R325 PolarHBondContact O-N 3.41Å; E321-R325 VanDerWaalsContact O-N 3.12Å; E321-R325 IonicContact OE1-CZ 2.77Å; E321-R325 IonicContact OE1-NE 3.49Å; E321-R325 IonicContact OE1-NH1 3.12Å; E321-R325 IonicContact OE1-NH2 2.69Å; E321-R325 PolarHBondContact OE1-NH2 3.5Å; E321-R325 IonicContact OE2-CZ 3.79Å; E321-R325 IonicContact OE2-NE 2.61Å; E321-R325 IonicContact OE2-NH1 2.8Å; E321-R325 PolarHBondContact OE2-NH1 2.81Å; E321-R325 IonicContact OE2-NH2 2.63Å; E321-R325 PolarHBondContact OE2-NH2 2.92Å
322	I	75.6	Confident	67.7	Low	96 Å²	96	104.4 Å²	104.4	49%	0.492	56%	0.56	S	S	.	*	H	α-helix	trans	-71.9	-44.5	176	-68.6	164.5	0	0	0	110.7	R318 A319 E320 R325 V326	R318-I322 HydrophobicContact CG-CD1 4.44Å; R318-I322 WeakPolarHBondContact O-CG1 3.22Å; R318-I322 PolarHBondContact O-N 3.13Å; R318-I322 VanDerWaalsContact O-N 3.14Å; A319-I322 CarbonylContact O-C 3.55Å; A319-I322 WeakPolarHBondContact O-CA 3.31Å; A319-I322 WeakPolarHBondContact O-CB 3.31Å; A319-I322 PolarHBondContact O-N 3.23Å; E320-I322 VanDerWaalsContact C-N 3.28Å; E320-I322 PolarHBondContact O-N 3.01Å; I322-R325 CarbonylContact O-C 3.58Å; I322-R325 WeakPolarHBondContact O-CB 3.5Å; I322-R325 PolarHBondContact O-N 3.39Å; I322-V326 HydrophobicContact CG2-CG2 4.37Å; I322-V326 WeakPolarHBondContact O-CG2 3.46Å; I322-V326 PolarHBondContact O-N 3.27Å
323	E	71.1	Confident	64.8	Low	132 Å²	132	104.7 Å²	104.7	62%	0.617	58%	0.579	S	S	*	*	H	α-helix	trans	-66.4	-42.3	-179.1	-174.9	165.3	-160.7	0	0	112	A319 E320 R325 V326 T327	A319-E323 PolarHBondContact O-N 2.85Å; E320-E323 PolarHBondContact O-N 3.45Å; E323-R325 VanDerWaalsContact C-N 3.33Å; E323-R325 PolarHBondContact O-N 2.75Å; E323-V326 PolarHBondContact O-N 2.88Å; E323-T327 VanDerWaalsContact O-CB 3.24Å; E323-T327 WeakPolarHBondContact O-CB 3.43Å; E323-T327 PolarHBondContact O-N 3.34Å; E323-T327 PolarHBondContact O-OG1 2.76Å
324	T	66.1	Low	62.2	Low	80 Å²	80	107.5 Å²	107.5	49%	0.491	60%	0.597	S	S	.	*	H	α-helix	trans	-64.1	-36.8	171.5	53.7	0	0	0	0	111.7	E320 E321 S328	E320-T324 WeakPolarHBondContact O-CB 3.4Å; E320-T324 VanDerWaalsContact O-CG2 3.31Å; E320-T324 WeakPolarHBondContact O-CG2 3.24Å; E320-T324 PolarHBondContact O-N 2.83Å; E320-T324 PolarHBondContact O-OG1 2.77Å; E321-T324 WeakPolarHBondContact CA-OG1 3.44Å; E321-T324 PolarHBondContact O-OG1 3.4Å; T324-S328 WeakPolarHBondContact O-CB 3.41Å; T324-S328 PolarHBondContact O-N 2.83Å; T324-S328 PolarHBondContact O-OG 3.38Å
325	R	66.2	Low	59.3	Low	130 Å²	130	111.7 Å²	111.7	49%	0.491	62%	0.615	S	S	.	*	H	α-helix	trans	-69.6	-31.2	174.5	-77	168.1	173.4	176.6	-2.9	113.7	E321 I322 E323	E321-R325 VanDerWaalsContact O-CB 3.23Å; E321-R325 WeakPolarHBondContact O-CB 3.11Å; E321-R325 WeakPolarHBondContact O-CD 3.17Å; E321-R325 WeakPolarHBondContact O-CG 3.17Å; E321-R325 PolarHBondContact O-N 3.41Å; E321-R325 VanDerWaalsContact O-N 3.12Å; E321-R325 IonicContact OE1-CZ 2.77Å; E321-R325 IonicContact OE1-NE 3.49Å; E321-R325 IonicContact OE1-NH1 3.12Å; E321-R325 IonicContact OE1-NH2 2.69Å; E321-R325 PolarHBondContact OE1-NH2 3.5Å; E321-R325 IonicContact OE2-CZ 3.79Å; E321-R325 IonicContact OE2-NE 2.61Å; E321-R325 IonicContact OE2-NH1 2.8Å; E321-R325 PolarHBondContact OE2-NH1 2.81Å; E321-R325 IonicContact OE2-NH2 2.63Å; E321-R325 PolarHBondContact OE2-NH2 2.92Å; I322-R325 CarbonylContact O-C 3.58Å; I322-R325 WeakPolarHBondContact O-CB 3.5Å; I322-R325 PolarHBondContact O-N 3.39Å; E323-R325 VanDerWaalsContact C-N 3.33Å; E323-R325 PolarHBondContact O-N 2.75Å
326	V	57.4	Low	57	Low	96 Å²	96	115 Å²	115	58%	0.582	63%	0.629	S	S	*	*	H	α-helix	trans	-78.2	-47.5	176.1	168.6	0	0	0	0	110.5	I322 E323 S328 G329	I322-V326 HydrophobicContact CG2-CG2 4.37Å; I322-V326 WeakPolarHBondContact O-CG2 3.46Å; I322-V326 PolarHBondContact O-N 3.27Å; E323-V326 PolarHBondContact O-N 2.88Å; V326-S328 PolarHBondContact O-N 2.85Å; V326-G329 WeakPolarHBondContact O-CA 3.19Å; V326-G329 PolarHBondContact O-N 3.25Å
327	T	45	Very low	54.2	Low	103 Å²	103	116.2 Å²	116.2	63%	0.632	64%	0.642	S	S	*	*	H	α-helix	trans	-63.1	-40.3	178.2	-55.2	0	0	0	0	111.8	E323 G329	E323-T327 VanDerWaalsContact O-CB 3.24Å; E323-T327 WeakPolarHBondContact O-CB 3.43Å; E323-T327 PolarHBondContact O-N 3.34Å; E323-T327 PolarHBondContact O-OG1 2.76Å; T327-G329 PolarHBondContact O-N 3.15Å
328	S	47.6	Very low	51.7	Low	106 Å²	106	119.6 Å²	119.6	74%	0.741	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	1.2	172.6	-47.8	0	0	0	0	114.2	T324 V326	T324-S328 WeakPolarHBondContact O-CB 3.41Å; T324-S328 PolarHBondContact O-N 2.83Å; T324-S328 PolarHBondContact O-OG 3.38Å; V326-S328 PolarHBondContact O-N 2.85Å
329	G	44.2	Very low	49.3	Very low	63 Å²	63	118.5 Å²	118.5	65%	0.649	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	-0.8	-172	0	0	0	0	0	115.3	V326 T327	V326-G329 WeakPolarHBondContact O-CA 3.19Å; V326-G329 PolarHBondContact O-N 3.25Å; T327-G329 PolarHBondContact O-N 3.15Å
330	S	39.6	Very low	46.9	Very low	94 Å²	94	126.1 Å²	126.1	66%	0.657	68%	0.678	S	S	*	*			trans	-138.4	66	-162.5	-177.5	0	0	0	0	115.7
331	M	37.8	Very low	44.5	Very low	175 Å²	175	129.9 Å²	129.9	86%	0.862	69%	0.693	S	S	*	*	S	Bend	trans	-166.9	173.4	133.8	-113.8	169.5	54.3	0	0	112.7
332	E	33.8	Very low	42.4	Very low	182 Å²	182	137.8 Å²	137.8	85%	0.85	72%	0.719	S	S	*	*			trans	75.3	52.1	168.8	-49.8	-154.6	133.7	0	0	119.4
333	A	30.2	Very low	40.2	Very low	94 Å²	94	136.8 Å²	136.8	78%	0.777	73%	0.732	S	S	*	*	S	Bend	trans	-152.2	82.9	147.8	0	0	0	0	0	112.8
334	L	33.6	Very low	38.2	Very low	176 Å²	176	135.9 Å²	135.9	92%	0.921	74%	0.74	S	S	*	*			trans	152.1	70	151.8	-82.1	-176.1	0	0	0	112.2
335	N	29.6	Very low	36.7	Very low	150 Å²	150	139.3 Å²	139.3	80%	0.802	75%	0.754	S	S	*	*			trans	-86.3	157.5	140.1	-73.3	-73.7	0	0	0	106.7
336	L	31.6	Very low	35.4	Very low	139 Å²	139	138.6 Å²	138.6	73%	0.728	77%	0.766	S	S	*	*			cis	-155.5	133.4	25.3	-179.8	66.5	0	0	0	111.8
337	T	29	Very low	34	Very low	117 Å²	117	141 Å²	141	72%	0.718	78%	0.781	S	S	*	*	S	Bend	trans	151.7	134.5	133.4	44.7	0	0	0	0	109.2
338	Q	30	Very low	33.5	Very low	173 Å²	173	141.6 Å²	141.6	81%	0.808	79%	0.789	S	S	*	*			cis	-145.7	156.7	-5	-116.5	175.8	17.3	0	0	110.5
339	L	30.3	Very low	32.8	Very low	132 Å²	132	144.4 Å²	144.4	69%	0.691	80%	0.795	S	S	*	*			trans	-9.8	145.6	162.6	-84.7	58.9	0	0	0	118.5
340	R	29.5	Very low	32.2	Very low	213 Å²	213	148.5 Å²	148.5	80%	0.804	81%	0.808	S	S	*	*			cis	-168.6	150.6	35.4	-130.5	165.2	-169	159	4.3	114.7
341	K	31.8	Very low	31.8	Very low	188 Å²	188	147.9 Å²	147.9	82%	0.817	81%	0.808	S	S	*	*			trans	69.9	110.8	155.4	-74.6	-175.4	176.9	-174.7	0	121.6
342	R	30.8	Very low	31.4	Very low	255 Å²	255	147.3 Å²	147.3	96%	0.962	81%	0.808	S	S	*	*			trans	16.9	142.5	132	-65.6	-176.1	172.8	-164.3	-2.9	120.1
343	G	29.2	Very low	31.1	Very low	74 Å²	74	143.7 Å²	143.7	76%	0.763	80%	0.803	S	S	*	*			cis	168.9	175.7	-0.9	0	0	0	0	0	115.6
344	S	29.5	Very low	31.1	Very low	113 Å²	113	146.5 Å²	146.5	79%	0.79	80%	0.804	S	S	*	*			trans	-64.7	170.2	177	-129.8	0	0	0	0	113
345	I	34	Very low	30.8	Very low	152 Å²	152	142.3 Å²	142.3	78%	0.779	80%	0.795	S	S	*	*			cis	-145.3	-177.9	27.3	2.6	178.4	0	0	0	110.7
346	P	39.3	Very low	30.7	Very low	115 Å²	115	140.5 Å²	140.5	75%	0.747	79%	0.794	S	S	*	*			trans	-99	-178.9	-156	42.2	-41.1	0	0	0	115.4
347	T	28.1	Very low	30.5	Very low	146 Å²	146	138.4 Å²	138.4	90%	0.896	80%	0.797	S	S	*	*			trans	-140.4	146.8	164.3	-17.6	0	0	0	0	112.1
348	S	33.7	Very low	30.5	Very low	116 Å²	116	138.3 Å²	138.3	81%	0.811	80%	0.801	S	S	*	*			trans	-95.5	176.4	176.1	47.8	0	0	0	0	112.8
349	L	32.4	Very low	32	Very low	165 Å²	165	135.8 Å²	135.8	86%	0.864	80%	0.799	S	S	*	*			trans	-64.2	148.2	-178.6	-57.1	166.9	0	0	0	113.5
350	T	33.1	Very low	33.3	Very low	150 Å²	150	134.6 Å²	134.6	92%	0.92	80%	0.799	S	S	*	*				176.7	171.9	126.1	-70.3	0	0	0	0	109.2
351	A	29.9	Very low	33.3	Very low	80 Å²	80	132.2 Å²	132.2	66%	0.661	80%	0.802	S	S	*	*			trans	-124.3	167.5	-150.5	0	0	0	0	0	117.5
352	L	29.2	Very low	33.4	Very low	164 Å²	164	128.6 Å²	128.6	86%	0.859	80%	0.8	S	S	*	*			trans	77.6	145.5	152.2	-74	165.6	0	0	0	122.1
353	S	27.6	Very low	33.5	Very low	105 Å²	105	119.8 Å²	119.8	73%	0.734	79%	0.789	S	S	*	*			trans	71.1	144.2	161.9	-67.1	0	0	0	0	117.9
354	L	31.5	Very low	33.8	Very low	153 Å²	153	127.7 Å²	127.7	80%	0.801	80%	0.796	S	S	*	*			cis	-161.2	147.6	3.3	-121.7	165.3	0	0	0	110.7
355	A	27.4	Very low	33.9	Very low	89 Å²	89	126.1 Å²	126.1	74%	0.736	79%	0.785	S	S	*	*			trans	61.6	158.5	155.9	0	0	0	0	0	120.1
356	S	27.6	Very low	33.9	Very low	112 Å²	112	125 Å²	125	78%	0.783	79%	0.785	S	S	*	*			cis	-169.4	169	-23.7	57	0	0	0	0	112.1
357	A	27.6	Very low	34.5	Very low	95 Å²	95	124.6 Å²	124.6	79%	0.785	78%	0.782	S	S	*	*			trans	74	168.3	160.1	0	0	0	0	0	120.1
358	S	27.6	Very low	34.6	Very low	115 Å²	115	126.4 Å²	126.4	80%	0.804	78%	0.778	S	S	*	*			trans	-148.9	-145.5	-165.7	-58.9	0	0	0	0	114
359	P	63.1	Low	34.4	Very low	120 Å²	120	127.4 Å²	127.4	78%	0.779	77%	0.773	S	S	*	*				-111.3	-156.4	-128.4	41.2	-20.2	0	0	0	112.2
360	P	55.6	Low	34.2	Very low	106 Å²	106	125.5 Å²	125.5	69%	0.688	77%	0.769	S	S	*	*			cis	-139.6	-144.6	1.3	41	-17.3	0	0	0	114.8
361	L	31.1	Very low	33.9	Very low	163 Å²	163	123.2 Å²	123.2	85%	0.853	76%	0.759	S	S	*	*			trans	89.4	145.5	166.8	-53	-178.6	0	0	0	118.2
362	S	34	Very low	33.9	Very low	112 Å²	112	130.9 Å²	130.9	78%	0.783	77%	0.771	S	S	*	*			cis	-170.9	140.8	-21	-177.8	0	0	0	0	113.7
363	G	32.4	Very low	33.7	Very low	71 Å²	71	128.7 Å²	128.7	73%	0.732	77%	0.769	S	S	*	*			trans	74.4	161.3	159.7	0	0	0	0	0	118.3
364	R	35.3	Very low	33.7	Very low	240 Å²	240	128.2 Å²	128.2	91%	0.906	77%	0.771	S	S	*	*			cis	-173.6	168.1	-4.6	-136.8	-172.1	-174.2	-168.4	2.8	107.3
365	S	32.1	Very low	33.6	Very low	79 Å²	79	125.3 Å²	125.3	55%	0.552	77%	0.77	S	S	*	*			cis	-159.5	138.1	2.7	-16.3	0	0	0	0	108.9
366	T	33.3	Very low	33.9	Very low	128 Å²	128	130.4 Å²	130.4	79%	0.785	78%	0.778	S	S	*	*				61.4	154.7	94.7	71.9	0	0	0	0	119.1
367	P	51.4	Low	34	Very low	107 Å²	107	132 Å²	132	70%	0.695	78%	0.778	S	S	*	*			cis	-149.1	-169.8	-31.8	38.6	-17.6	0	0	0	116.8
368	K	30.6	Very low	34.2	Very low	185 Å²	185	134.6 Å²	134.6	80%	0.804	78%	0.778	S	S	*	*			trans	81.4	154.8	157.1	-69	-178	176.7	-177.6	0	119.9
369	L	30.5	Very low	34.5	Very low	137 Å²	137	135.1 Å²	135.1	72%	0.717	77%	0.772	S	S	*	*			cis	-171.7	155.1	-29.4	-108.6	178.2	0	0	0	109.9
370	T	26.8	Very low	33.1	Very low	125 Å²	125	138.6 Å²	138.6	77%	0.767	77%	0.769	S	S	*	*			trans	60.5	162.4	158	46.8	0	0	0	0	119.3
371	S	27.3	Very low	32	Very low	101 Å²	101	141.4 Å²	141.4	71%	0.706	78%	0.775	S	S	*	*			cis	-170.6	153.3	-26.1	54.5	0	0	0	0	112.6
372	R	29.3	Very low	32.1	Very low	242 Å²	242	137.2 Å²	137.2	91%	0.913	77%	0.771	S	S	*	*			trans	43	106.8	154.5	-75.8	-172	170.1	-165.3	-2.4	122.4
373	S	25.8	Very low	31.9	Very low	117 Å²	117	138 Å²	138	82%	0.818	77%	0.771	S	S	*	*				28.5	124.8	119.9	-154	0	0	0	0	123.5
374	A	28.2	Very low	31.7	Very low	95 Å²	95	142.2 Å²	142.2	79%	0.785	77%	0.774	S	S	*	*			trans	61.4	127.2	137.3	0	0	0	0	0	123.3
375	A	27.9	Very low	31.4	Very low	93 Å²	93	137.1 Å²	137.1	77%	0.769	77%	0.769	S	S	*	*				171.7	164	101.4	0	0	0	0	0	114
376	Q	33.9	Very low	31.4	Very low	195 Å²	195	141.2 Å²	141.2	91%	0.911	78%	0.784	S	S	*	*			trans	72.5	152.4	164.3	-63.4	179	-18	0	0	119.6
377	D	31	Very low	32.5	Very low	147 Å²	147	140.3 Å²	140.3	79%	0.786	78%	0.78	S	S	*	*				173.3	169.8	-64.4	-173.9	20.8	0	0	0	109.9
378	L	31.4	Very low	31.4	Very low	149 Å²	149	140.7 Å²	140.7	78%	0.78	79%	0.786	S	S	*	*			trans	74.4	146	-176	-83.3	66.8	0	0	0	116.5
379	D	33.7	Very low	31.4	Very low	126 Å²	126	139 Å²	139	67%	0.674	79%	0.785	S	S	*	*			cis	-144.2	165.9	6.1	-173.2	25.5	0	0	0	112.9
380	R	33.9	Very low	31.3	Very low	193 Å²	193	138 Å²	138	73%	0.728	78%	0.78	S	S	*	*			trans	81.5	87.9	163.2	-54.8	-153.6	163.8	-155.3	-8	121.5
381	M	32.4	Very low	31.5	Very low	165 Å²	165	141.4 Å²	141.4	81%	0.813	78%	0.779	S	S	*	*			trans	47.4	118	132.1	-65.6	171.1	-90.2	0	0	118.5
382	G	33.3	Very low	31.6	Very low	75 Å²	75	145.3 Å²	145.3	77%	0.773	78%	0.783	S	S	*	*			cis	149.4	-167.3	11.4	0	0	0	0	0	108.6
383	V	28.7	Very low	31.5	Very low	128 Å²	128	141.4 Å²	141.4	78%	0.776	78%	0.775	S	S	*	*			cis	-162.1	138.8	-7.9	174.5	0	0	0	0	105.8
384	M	28	Very low	31.7	Very low	160 Å²	160	144 Å²	144	79%	0.788	77%	0.767	S	S	*	*			cis	-158.2	120.4	-19.4	-110.1	171.8	56.9	0	0	110.6
385	T	30.1	Very low	31.8	Very low	133 Å²	133	148.9 Å²	148.9	82%	0.816	77%	0.765	S	S	*	*			trans	68.6	160.5	139.3	-23.7	0	0	0	0	122.8
386	L	31.8	Very low	31.8	Very low	164 Å²	164	153.4 Å²	153.4	86%	0.859	77%	0.767	S	S	*	*			trans	-104.6	178.8	-170.2	-84	168.9	0	0	0	113.1
387	P	55.8	Low	31.5	Very low	109 Å²	109	151.2 Å²	151.2	71%	0.708	76%	0.761	S	S	*	*			trans	-103.9	170.6	-160.6	40.4	-36.8	0	0	0	115.8
388	S	28.7	Very low	31.3	Very low	115 Å²	115	152.4 Å²	152.4	80%	0.804	77%	0.766	S	S	*	*			trans	179.4	126.6	132	-79.2	0	0	0	0	115.1
389	D	31.2	Very low	31	Very low	149 Å²	149	150 Å²	150	80%	0.797	76%	0.763	S	S	*	*			trans	66.9	150.3	135.9	-113.2	-29.5	0	0	0	128.1
390	L	28.2	Very low	31.4	Very low	118 Å²	118	149.2 Å²	149.2	62%	0.618	76%	0.764	S	S	*	*			trans	71.8	129.1	156	-106.3	72.3	0	0	0	124.7
391	R	30.3	Very low	31.1	Very low	195 Å²	195	146 Å²	146	74%	0.736	77%	0.766	S	S	*	*			trans	84	113.4	147.4	-74.3	178.1	-82.7	-150.4	-12.2	121.5
392	K	29.2	Very low	30.7	Very low	184 Å²	184	143.5 Å²	143.5	80%	0.8	77%	0.765	S	S	*	*				52.7	136.8	123.7	-56.1	179	-177.6	-176.9	0	117.5
393	H	27.9	Very low	30.4	Very low	159 Å²	159	149.8 Å²	149.8	74%	0.736	77%	0.765	S	S	*	*			cis	-175.8	152.6	34.8	-145.5	-23.1	0	0	0	113.5
394	R	29.2	Very low	30.2	Very low	173 Å²	173	150.8 Å²	150.8	65%	0.653	76%	0.761	S	S	*	*			trans	84.1	124.4	132.4	-139.7	-177.3	-166.6	-174.2	7.6	120.8
395	R	31.6	Very low	30.1	Very low	196 Å²	196	151.8 Å²	151.8	74%	0.74	76%	0.764	S	S	*	*			trans	70.6	154	157.9	-72	157.5	-178.8	176	-4	115.8
396	K	27.3	Very low	30	Very low	188 Å²	188	150.7 Å²	150.7	82%	0.817	75%	0.753	S	S	*	*			cis	-147.5	167.7	13.3	-142.6	175.1	-176.5	-172.5	0	112.4
397	L	28.2	Very low	29.9	Very low	150 Å²	150	153.6 Å²	153.6	79%	0.785	75%	0.753	S	S	*	*			trans	-41.2	145.1	173.4	-58.8	155.8	0	0	0	115.8
398	L	27.3	Very low	29	Very low	171 Å²	171	154.6 Å²	154.6	90%	0.895	75%	0.748	S	S	*	*				178.8	154.4	111.8	-95.4	165.2	0	0	0	113.2
399	S	25.2	Very low	29.1	Very low	100 Å²	100	154.9 Å²	154.9	70%	0.699	74%	0.74	S	S	*	*			trans	-89.9	176	162	57.9	0	0	0	0	109.1
400	P	41.8	Very low	29	Very low	109 Å²	109	155.5 Å²	155.5	71%	0.708	74%	0.736	S	S	*	*			cis	-149.3	-176.4	22.7	46.7	-26.2	0	0	0	118.1
401	V	26.5	Very low	29.2	Very low	126 Å²	126	153.8 Å²	153.8	76%	0.764	74%	0.739	S	S	*	*			trans	39.4	140.6	135.1	169.5	0	0	0	0	121.3
402	S	25.3	Very low	29.2	Very low	112 Å²	112	150.8 Å²	150.8	78%	0.783	74%	0.742	S	S	*	*			trans	77.5	154	159.3	78.8	0	0	0	0	116.9
403	R	26.6	Very low	29.4	Very low	206 Å²	206	148.9 Å²	148.9	78%	0.777	74%	0.739	S	S	*	*			cis	-173.9	139.4	-14.5	152.4	178.9	-176.1	-159.7	-5.4	111.3
404	E	24.6	Very low	29.3	Very low	150 Å²	150	150.1 Å²	150.1	70%	0.701	74%	0.743	S	S	*	*			trans	52.5	169.3	156	-73.2	179	143.1	0	0	123
405	E	25.3	Very low	29.4	Very low	180 Å²	180	147.9 Å²	147.9	84%	0.841	75%	0.752	S	S	*	*			trans	74.5	95.9	158.9	-130.7	164.3	-149.3	0	0	118
406	N	28	Very low	29.3	Very low	111 Å²	111	147.2 Å²	147.2	59%	0.594	76%	0.757	S	S	*	*				82.3	119.9	55.9	-178.7	48	0	0	0	114.6	E408	N406-E408 PolarHBondContact ND2-OE1 3.33Å
407	R	29.8	Very low	29.3	Very low	225 Å²	225	144.8 Å²	144.8	85%	0.849	76%	0.758	S	S	*	*			trans	177.4	140.6	151.8	-105.4	157	-179.6	156.9	7.5	111
408	E	36.2	Very low	29.5	Very low	129 Å²	129	143.2 Å²	143.2	60%	0.603	76%	0.76	S	S	*	*			cis	-168.3	-178.6	-33.1	-123.3	157.5	-172.6	0	0	108.8	N406	N406-E408 PolarHBondContact ND2-OE1 3.33Å
409	D	31.8	Very low	30.6	Very low	121 Å²	121	140.9 Å²	140.9	65%	0.647	76%	0.755	S	S	*	*			trans	71.8	137.9	165.3	-83.7	4.7	0	0	0	119
410	K	28	Very low	31.2	Very low	162 Å²	162	142.3 Å²	142.3	70%	0.704	76%	0.762	S	S	*	*			cis	-162.2	146	-5.4	-134.9	166.2	-163.9	27.4	0	114.1
411	A	33.5	Very low	30.5	Very low	83 Å²	83	142.8 Å²	142.8	69%	0.686	77%	0.768	S	S	*	*			trans	60.4	151.1	143.3	0	0	0	0	0	120.5
412	T	29.1	Very low	30.8	Very low	131 Å²	131	142.5 Å²	142.5	80%	0.804	77%	0.771	S	S	*	*			cis	-164.6	163.2	-17.9	30.5	0	0	0	0	105.8
413	I	33.7	Very low	31.5	Very low	144 Å²	144	143.3 Å²	143.3	74%	0.738	77%	0.774	S	S	*	*				-160.7	143.1	52.7	-71.8	175.1	0	0	0	110.2
414	K	26.3	Very low	31.7	Very low	186 Å²	186	144.4 Å²	144.4	81%	0.809	78%	0.778	S	S	*	*			trans	10.2	128.4	153.9	-50.9	171.4	-175.8	-178.7	0	119.1
415	C	31.9	Very low	31.9	Very low	125 Å²	125	143.1 Å²	143.1	85%	0.845	78%	0.781	S	S	*	*			cis	81	117.2	43.1	-61.5	0	0	0	0	116.2
416	E	28.1	Very low	32	Very low	183 Å²	183	142.1 Å²	142.1	86%	0.855	78%	0.78	S	S	*	*				-170.8	148	127.1	-115.2	175.6	-169.3	0	0	116.3
417	T	28.8	Very low	32.1	Very low	137 Å²	137	146.9 Å²	146.9	84%	0.84	79%	0.79	S	S	*	*			trans	66.8	151.7	159.9	59.2	0	0	0	0	123
418	S	32.4	Very low	32	Very low	117 Å²	117	142.5 Å²	142.5	82%	0.818	78%	0.783	S	S	*	*			trans	-126.1	168.7	-169.9	-61.9	0	0	0	0	111.8
419	P	49.3	Very low	31.9	Very low	122 Å²	122	142.7 Å²	142.7	79%	0.792	78%	0.783	S	S	*	*			trans	-100.5	169.5	-159	39.2	-37.3	0	0	0	116.1
420	P	37.6	Very low	32.1	Very low	129 Å²	129	143.7 Å²	143.7	84%	0.838	78%	0.782	S	S	*	*			trans	-120.5	171.2	162.2	39.5	-28.5	0	0	0	114.9
421	S	28.6	Very low	32.2	Very low	120 Å²	120	143.8 Å²	143.8	84%	0.839	79%	0.789	S	S	*	*			trans	-95.5	171.2	-168.8	-48.9	0	0	0	0	115.9
422	S	32.9	Very low	31.8	Very low	119 Å²	119	143 Å²	143	83%	0.832	79%	0.79	S	S	*	*			trans	-74.4	152.1	173.3	-42.3	0	0	0	0	114.7
423	P	39.6	Very low	32	Very low	130 Å²	130	145.7 Å²	145.7	84%	0.844	79%	0.793	S	S	*	*			trans	-124.5	-175	151.3	37.6	-26.1	0	0	0	113.6
424	R	30.1	Very low	32.7	Very low	229 Å²	229	145 Å²	145	86%	0.864	80%	0.798	S	S	*	*			trans	-126.3	148.6	-162	-106	-177.7	174	148	-5.7	114.3
425	T	28.8	Very low	32.7	Very low	122 Å²	122	139.7 Å²	139.7	75%	0.748	80%	0.795	S	S	*	*			trans	71.4	171.3	142	57.1	0	0	0	0	122.3
426	L	27.6	Very low	32.5	Very low	160 Å²	160	141.4 Å²	141.4	84%	0.838	80%	0.795	S	S	*	*			trans	81.8	142.9	-176.6	-47.5	-177.8	0	0	0	113.6
427	R	29.2	Very low	32.6	Very low	210 Å²	210	137.8 Å²	137.8	79%	0.792	79%	0.79	S	S	*	*			cis	-152.3	135.2	11.5	-170.5	168	173	93.4	3.4	108.5
428	L	29.4	Very low	32.6	Very low	134 Å²	134	138.8 Å²	138.8	70%	0.702	79%	0.785	S	S	*	*				50.4	142.4	87.9	-138.2	86.1	0	0	0	114.6
429	E	32.6	Very low	32.4	Very low	132 Å²	132	140 Å²	140	62%	0.617	78%	0.778	S	S	*	*			cis	-147.3	-168.4	4.3	-147.2	-177.6	-177.6	0	0	107.2
430	K	35.6	Very low	31.4	Very low	142 Å²	142	141.2 Å²	141.2	62%	0.617	77%	0.773	S	S	*	*			cis	-160.4	-179.3	4.3	-146.2	171.3	-173	77.6	0	105
431	L	30.5	Very low	30.9	Very low	164 Å²	164	138 Å²	138	86%	0.859	76%	0.763	S	S	*	*			cis	-144.2	171	9	-56.6	81.3	0	0	0	109.8
432	G	25.8	Very low	31.1	Very low	67 Å²	67	139.8 Å²	139.8	69%	0.691	76%	0.756	S	S	*	*			trans	139.4	109.5	161	0	0	0	0	0	114.2
433	H	32.2	Very low	30.7	Very low	188 Å²	188	139.7 Å²	139.7	87%	0.87	76%	0.756	S	S	*	*			trans	-140.7	176	-179	-66.6	-67.2	0	0	0	109.7
434	P	49.1	Very low	30.3	Very low	130 Å²	130	137.3 Å²	137.3	84%	0.844	75%	0.747	S	S	*	*			cis	-128.5	-178.3	-14.7	21.3	2.7	0	0	0	113.4
435	G	25.8	Very low	30.3	Very low	73 Å²	73	133.9 Å²	133.9	75%	0.753	75%	0.745	S	S	*	*			trans	170.5	69.6	166.8	0	0	0	0	0	118.5
436	L	29.3	Very low	30.4	Very low	162 Å²	162	136.2 Å²	136.2	85%	0.848	75%	0.747	S	S	*	*			trans	18.7	121	151.9	-58.5	177.6	0	0	0	120
437	S	28.4	Very low	30.5	Very low	106 Å²	106	131.8 Å²	131.8	74%	0.741	74%	0.74	S	S	*	*				81.6	148.3	102.5	83.2	0	0	0	0	114.6
438	Q	29.1	Very low	30.6	Very low	159 Å²	159	129.9 Å²	129.9	74%	0.743	74%	0.74	S	S	*	*			cis	-172.5	-173.3	-5.5	-162.1	-174.8	-58.6	0	0	106.1
439	E	29	Very low	30.4	Very low	141 Å²	141	129.6 Å²	129.6	66%	0.659	74%	0.739	S	S	*	*			trans	70.3	130.9	166.4	-56.9	-52	90.3	0	0	117.2
440	E	28.1	Very low	30.4	Very low	148 Å²	148	128.9 Å²	128.9	69%	0.692	75%	0.749	S	S	*	*				79.5	164.5	66.5	-106.2	-98.4	179.4	0	0	113.3	K442	E440-K442 IonicContact OE1-NZ 2.78Å; E440-K442 PolarHBondContact OE1-NZ 2.9Å; E440-K442 IonicContact OE2-NZ 3.83Å; E440-K442 PolarHBondContact OE2-NZ 3.12Å
441	G	28	Very low	30.4	Very low	62 Å²	62	129.7 Å²	129.7	64%	0.639	76%	0.76	S	S	*	*			trans	103.8	57.4	164.8	0	0	0	0	0	120.5
442	K	31.2	Very low	31.4	Very low	158 Å²	158	127.2 Å²	127.2	69%	0.687	75%	0.754	S	S	*	*			trans	10.3	141.5	137.1	-54.5	147.3	-174.7	122.2	0	120	E440	E440-K442 IonicContact OE1-NZ 2.78Å; E440-K442 PolarHBondContact OE1-NZ 2.9Å; E440-K442 IonicContact OE2-NZ 3.83Å; E440-K442 PolarHBondContact OE2-NZ 3.12Å
443	S	26.2	Very low	31.7	Very low	117 Å²	117	129.1 Å²	129.1	82%	0.818	76%	0.756	S	S	*	*			trans	66.5	154.3	140.1	57.5	0	0	0	0	120.4
444	A	30.6	Very low	31.6	Very low	80 Å²	80	125.7 Å²	125.7	66%	0.661	75%	0.754	S	S	*	*			cis	-170.6	162.8	-19.7	0	0	0	0	0	110.3
445	L	30.9	Very low	30.6	Very low	156 Å²	156	124.9 Å²	124.9	82%	0.817	75%	0.751	S	S	*	*			trans	64.7	161.8	164.2	-60.2	159	0	0	0	114.9
446	E	29.8	Very low	30.6	Very low	172 Å²	172	129.1 Å²	129.1	80%	0.804	76%	0.757	S	S	*	*			cis	-152.6	154.7	0.9	-146.4	158	-144.8	0	0	111.6
447	G	28.9	Very low	30.7	Very low	67 Å²	67	126.3 Å²	126.3	69%	0.691	75%	0.751	S	S	*	*			trans	63.7	175.8	162.3	0	0	0	0	0	118.8
448	Q	32.3	Very low	30.9	Very low	170 Å²	170	125.9 Å²	125.9	79%	0.794	75%	0.748	S	S	*	*			cis	-163.5	141.2	-37.4	-133.5	-176.9	-65.3	0	0	109.4
449	D	25.9	Very low	31	Very low	127 Å²	127	127.4 Å²	127.4	68%	0.679	76%	0.755	S	S	*	*			trans	60.4	165	154.1	-56.5	-31	0	0	0	122.9
450	S	31.1	Very low	30.9	Very low	117 Å²	117	127.4 Å²	127.4	82%	0.818	76%	0.759	S	S	*	*			trans	85.2	88.5	160	-49	0	0	0	0	120.6
451	N	36.7	Very low	31	Very low	159 Å²	159	124.9 Å²	124.9	85%	0.85	76%	0.758	S	S	*	*			trans	-59.3	164.8	132.3	-94.9	-31	0	0	0	110.1
452	P	51.9	Low	31.3	Very low	112 Å²	112	127.9 Å²	127.9	73%	0.727	76%	0.759	S	S	*	*			cis	-150.5	172.7	36.4	43.3	-22.7	0	0	0	119.8
453	S	30.4	Very low	31.5	Very low	107 Å²	107	128 Å²	128	75%	0.748	76%	0.761	S	S	*	*			trans	24	119.5	141.2	-53.6	0	0	0	0	122.5
454	S	30.7	Very low	32	Very low	117 Å²	117	132.5 Å²	132.5	82%	0.818	77%	0.766	S	S	*	*				172.3	164.3	124.9	35.7	0	0	0	0	109.7
455	S	28.9	Very low	32.1	Very low	113 Å²	113	132.3 Å²	132.3	79%	0.79	77%	0.772	S	S	*	*			cis	167.6	143.4	-32.4	-90	0	0	0	0	105.5
456	N	25.4	Very low	32.3	Very low	162 Å²	162	129.4 Å²	129.4	87%	0.866	77%	0.77	S	S	*	*			trans	81	144.5	155.2	-125.6	15.6	0	0	0	121.7
457	S	30.5	Very low	32.4	Very low	103 Å²	103	130.7 Å²	130.7	72%	0.72	77%	0.774	S	S	*	*			trans	66.8	145.8	151.2	-159.9	0	0	0	0	120.1
458	S	33.4	Very low	32.9	Very low	97 Å²	97	139 Å²	139	68%	0.678	78%	0.784	S	S	*	*			cis	162.2	148.5	-35.6	-91.5	0	0	0	0	107.9
459	Q	30.6	Very low	33.2	Very low	190 Å²	190	140.9 Å²	140.9	89%	0.888	79%	0.789	S	S	*	*			trans	66.5	156.1	172.4	-60.9	-178.4	-87	0	0	116.7
460	D	26.9	Very low	33.4	Very low	141 Å²	141	138.3 Å²	138.3	75%	0.754	79%	0.793	S	S	*	*			cis	-168.1	-177.7	-30.6	-172.1	16.1	0	0	0	107.5
461	S	31	Very low	33.8	Very low	95 Å²	95	141 Å²	141	66%	0.664	80%	0.796	S	S	*	*			trans	86.6	136.5	160.7	-166.9	0	0	0	0	118.8
462	L	34.2	Very low	33.7	Very low	126 Å²	126	142.5 Å²	142.5	66%	0.66	80%	0.795	S	S	*	*			cis	-159.7	154.9	-18.7	-105.8	-175.6	0	0	0	112
463	H	35.6	Very low	32.8	Very low	159 Å²	159	142.1 Å²	142.1	74%	0.736	80%	0.795	S	S	*	*			trans	52	118.4	152.8	-63.8	-39	0	0	0	123.8
464	K	36.5	Very low	32.7	Very low	212 Å²	212	141.9 Å²	141.9	92%	0.922	79%	0.794	S	S	*	*				-161.3	147.6	100.1	-105.6	168	-176	171.4	0	111.7
465	G	33.5	Very low	32.8	Very low	77 Å²	77	144.1 Å²	144.1	79%	0.794	80%	0.795	S	S	*	*			trans	-95.9	-179.4	-179.7	0	0	0	0	0	113.5
466	A	34.4	Very low	32.9	Very low	94 Å²	94	141.8 Å²	141.8	78%	0.777	79%	0.789	S	S	*	*			cis	-157.7	-171.2	7.2	0	0	0	0	0	108.4
467	K	32.3	Very low	34.1	Very low	200 Å²	200	145.3 Å²	145.3	87%	0.87	79%	0.79	S	S	*	*			cis	-157.5	163.2	38.5	-63	169.3	-174.2	170.5	0	112.9
468	R	39.7	Very low	34.4	Very low	241 Å²	241	146.9 Å²	146.9	91%	0.909	79%	0.79	S	S	*	*			trans	-14.6	151.3	159.2	-59.6	180	-178.2	-133.7	-2.1	117.9
469	K	38.5	Very low	34.5	Very low	209 Å²	209	151.8 Å²	151.8	91%	0.909	80%	0.799	S	S	*	*			cis	-136.7	152.8	34.8	-64.7	174.9	178.8	174.9	0	114.9
470	G	29.3	Very low	34.5	Very low	73 Å²	73	146.6 Å²	146.6	75%	0.753	80%	0.796	S	S	*	*			trans	-155.3	157.6	157.1	0	0	0	0	0	109.4
471	I	40.3	Very low	34.8	Very low	174 Å²	174	149.4 Å²	149.4	89%	0.892	80%	0.802	S	S	*	*			trans	-136.9	140.2	172.7	-60.6	-179	0	0	0	107.5
472	K	33.3	Very low	34.8	Very low	190 Å²	190	152.7 Å²	152.7	83%	0.826	80%	0.804	S	S	*	*			trans	-113.7	147.2	178.6	-66.7	-176.6	174.2	-177.7	0	111.2
473	S	32.5	Very low	34.5	Very low	104 Å²	104	152.2 Å²	152.2	73%	0.727	80%	0.799	S	S	*	*			trans	58	146.4	136	64.3	0	0	0	0	123.1
474	S	29.7	Very low	34.2	Very low	102 Å²	102	153.4 Å²	153.4	71%	0.713	80%	0.802	S	S	*	*			trans	104.4	142.6	138.1	80.2	0	0	0	0	119.4
475	I	33.2	Very low	33.9	Very low	165 Å²	165	147.2 Å²	147.2	85%	0.846	80%	0.798	S	S	*	*			trans	24	128.4	133.6	-54.1	166.6	0	0	0	116
476	G	30.2	Very low	33.8	Very low	64 Å²	64	154.6 Å²	154.6	66%	0.66	80%	0.802	S	S	*	*			cis	139.2	155.7	3.1	0	0	0	0	0	111.8
477	R	50	Low	33.3	Very low	236 Å²	236	156.5 Å²	156.5	89%	0.891	80%	0.798	S	S	*	*			trans	72	134.1	173.3	-76	-168.4	-157.9	-128.9	5.6	119.9
478	L	38	Very low	33.3	Very low	136 Å²	136	153.9 Å²	153.9	71%	0.712	79%	0.792	S	S	*	*			trans	82.6	127.6	138.6	-66.8	163.5	0	0	0	122.5
479	F	34.9	Very low	32.8	Very low	199 Å²	199	149.6 Å²	149.6	87%	0.873	78%	0.783	S	S	*	*			trans	48	115.4	155.6	-69.7	-67.4	0	0	0	122.1
480	G	30.1	Very low	32.3	Very low	81 Å²	81	148.2 Å²	148.2	84%	0.835	78%	0.784	S	S	*	*			trans	-159.6	107	160.9	0	0	0	0	0	110.4
481	K	33.1	Very low	32.3	Very low	200 Å²	200	148.9 Å²	148.9	87%	0.87	78%	0.778	S	S	*	*			trans	-100.7	124	-166.1	179.9	177.4	176.8	-179	0	111.5
482	K	31.4	Very low	31.8	Very low	164 Å²	164	152.2 Å²	152.2	71%	0.713	78%	0.779	S	S	*	*			trans	35.3	124.9	148.3	-177.9	-166.8	-178.2	-126.8	0	118.2
483	E	28.5	Very low	31.5	Very low	116 Å²	116	150.2 Å²	150.2	54%	0.542	78%	0.777	S	S	.	*				-178.6	154.9	98.8	-159.2	145	142.9	0	0	115.7
484	K	28.2	Very low	31.5	Very low	184 Å²	184	149.3 Å²	149.3	80%	0.8	78%	0.776	S	S	*	*			trans	32	121.5	158.6	-76.2	164.5	-174.7	146.2	0	122.4
485	G	30	Very low	31.6	Very low	82 Å²	82	151.1 Å²	151.1	85%	0.845	78%	0.783	S	S	*	*			trans	-140.7	151.7	139.9	0	0	0	0	0	109.1
486	R	32.6	Very low	31.4	Very low	233 Å²	233	146.1 Å²	146.1	88%	0.879	77%	0.772	S	S	*	*			trans	-144.9	160.7	-169.8	-165.7	-175.9	-174.7	-152.8	3.4	112.1
487	L	24.7	Very low	31.4	Very low	133 Å²	133	151.6 Å²	151.6	70%	0.696	78%	0.78	S	S	*	*			trans	75.7	148.7	175	-124.6	68	0	0	0	112.6
488	I	31.9	Very low	30.3	Very low	146 Å²	146	145.4 Å²	145.4	75%	0.749	77%	0.768	S	S	*	*			cis	-133.4	119.1	15.1	-70.5	165.8	0	0	0	107.3
489	Q	27.8	Very low	30	Very low	151 Å²	151	145.8 Å²	145.8	71%	0.706	77%	0.77	S	S	*	*				53.8	104.1	82.8	-172.6	179.5	-10.4	0	0	117
490	L	28.7	Very low	29.8	Very low	179 Å²	179	143.2 Å²	143.2	94%	0.937	77%	0.765	S	S	*	*			trans	-151	140.3	141.9	-111	173	0	0	0	108.8
491	S	28.9	Very low	29.8	Very low	88 Å²	88	144.7 Å²	144.7	62%	0.615	76%	0.758	S	S	*	*			trans	-117.9	153.6	-166.4	-49.3	0	0	0	0	112.9
492	R	29.3	Very low	29.4	Very low	244 Å²	244	142.1 Å²	142.1	92%	0.921	75%	0.754	S	S	*	*			trans	-153.9	142.9	135.3	-147.4	165.4	-170.8	135	4.5	112.4
493	D	27.1	Very low	29.5	Very low	147 Å²	147	139.1 Å²	139.1	79%	0.786	75%	0.753	S	S	*	*			trans	-92.1	179.1	-170.9	-34.3	-92.7	0	0	0	111
494	A	33.1	Very low	29.7	Very low	86 Å²	86	141.5 Å²	141.5	71%	0.711	76%	0.764	S	S	*	*			cis	-153.3	-168	6.3	0	0	0	0	0	108.3
495	T	32	Very low	29.8	Very low	139 Å²	139	139.5 Å²	139.5	85%	0.853	76%	0.762	S	S	*	*			cis	-158.1	156.9	8.2	-27.9	0	0	0	0	110.2
496	G	29.1	Very low	29.8	Very low	60 Å²	60	140.7 Å²	140.7	62%	0.619	76%	0.757	S	S	*	*			trans	99.6	109.9	155.3	0	0	0	0	0	115.8
497	H	29.2	Very low	29.9	Very low	180 Å²	180	137.1 Å²	137.1	83%	0.833	76%	0.755	S	S	*	*				79.5	132.5	57.3	-73	-122.9	0	0	0	113.1
498	V	28.4	Very low	30.2	Very low	105 Å²	105	139.3 Å²	139.3	64%	0.636	76%	0.761	S	S	*	*			cis	-166.6	153.9	4.7	101.1	0	0	0	0	114.5
499	L	30.3	Very low	29.9	Very low	144 Å²	144	141 Å²	141	75%	0.754	77%	0.766	S	S	*	*			trans	60.4	157.4	160.4	-87.2	54.3	0	0	0	119.4
500	L	32.3	Very low	30.3	Very low	146 Å²	146	138.6 Å²	138.6	76%	0.764	76%	0.763	S	S	*	*			cis	-142.5	174.2	-1.2	-119.5	-167.5	0	0	0	112.5
501	T	28.7	Very low	30.6	Very low	112 Å²	112	138.9 Å²	138.9	69%	0.687	76%	0.762	S	S	*	*			trans	-64.7	173.8	174.9	52.4	0	0	0	0	114
502	D	25.9	Very low	30.9	Very low	146 Å²	146	140.9 Å²	140.9	78%	0.781	77%	0.77	S	S	*	*			cis	-157.6	-173.8	35.9	-157.1	3.3	0	0	0	115.5
503	S	32.8	Very low	31.9	Very low	101 Å²	101	135.2 Å²	135.2	71%	0.706	77%	0.765	S	S	*	*			trans	-96.7	-176.9	-169	-41.1	0	0	0	0	112.7
504	E	32	Very low	32.7	Very low	165 Å²	165	132.3 Å²	132.3	77%	0.771	76%	0.762	S	S	*	*			cis	-158.1	-170	11.2	-149.2	-145.2	138.7	0	0	111.9
505	L	32.2	Very low	33.3	Very low	143 Å²	143	136.1 Å²	136.1	75%	0.749	76%	0.762	S	S	*	*			trans	85.7	89.2	166.1	-54	-179.4	0	0	0	120.4
506	S	29.5	Very low	33.8	Very low	106 Å²	106	137.7 Å²	137.7	74%	0.741	76%	0.764	S	S	*	*			trans	15.2	146.1	132.8	-82.9	0	0	0	0	121.6
507	L	34.9	Very low	35	Very low	159 Å²	159	137.2 Å²	137.2	83%	0.832	76%	0.76	S	S	*	*			cis	-146.2	128.4	44.8	-75.9	166.3	0	0	0	116
508	Q	30.4	Very low	37	Very low	178 Å²	178	133.5 Å²	133.5	83%	0.832	75%	0.75	S	S	*	*			trans	27.4	114.6	133.7	-177.6	161.8	88.1	0	0	122.7
509	E	26.3	Very low	39.2	Very low	182 Å²	182	133.3 Å²	133.3	85%	0.85	74%	0.742	S	S	*	*				-162.5	161.4	128.8	-98.3	-102.1	100.5	0	0	109.4
510	P	35	Very low	41.8	Very low	100 Å²	100	129.5 Å²	129.5	65%	0.649	73%	0.732	S	S	*	*			trans	-95.4	152	-156.9	35.3	-36	0	0	0	117.2
511	M	34.8	Very low	44.4	Very low	185 Å²	185	124.9 Å²	124.9	91%	0.911	71%	0.706	S	S	*	*			trans	-67	136.7	177.7	-60.3	174.8	73.4	0	0	113.8
512	V	36	Very low	47.1	Very low	130 Å²	130	125.8 Å²	125.8	79%	0.788	70%	0.7	S	S	*	*			trans	-118.3	108.6	169.1	-176.8	0	0	0	0	110.6	A514	V512-A514 PolarHBondContact O-N 3.35Å
513	P	50.3	Low	50.1	Low	126 Å²	126	121.7 Å²	121.7	82%	0.818	68%	0.678	S	S	*	*			trans	-92	84.3	-173.2	34.4	-34.3	0	0	0	113.1
514	A	43.4	Very low	53	Low	86 Å²	86	124.9 Å²	124.9	71%	0.711	68%	0.675	S	S	*	*			trans	-154.1	75.6	-178.1	0	0	0	0	0	116.6	V512	V512-A514 PolarHBondContact O-N 3.35Å
515	K	45.7	Very low	55.8	Low	165 Å²	165	124.3 Å²	124.3	72%	0.717	67%	0.666	S	S	*	*	S	Bend	trans	-145.6	14.4	165.4	-137.6	172.6	-177.9	179.8	0	118.5
516	L	42.5	Very low	58.6	Low	172 Å²	172	121 Å²	121	90%	0.901	65%	0.648	S	S	*	*	S	Bend	trans	-104.9	-0.5	175.3	-128.8	78.7	0	0	0	115.2
517	G	53.6	Low	61.6	Low	51 Å²	51	123.2 Å²	123.2	53%	0.526	65%	0.645	S	S	.	*			trans	-88.4	-4.2	-169.5	0	0	0	0	0	116.9	E521	G517-E521 WeakPolarHBondContact O-CB 3.47Å; G517-E521 PolarHBondContact O-N 2.91Å
518	T	72.4	Confident	64.4	Low	102 Å²	102	122.7 Å²	122.7	63%	0.626	64%	0.636	S	S	*	*	H	α-helix	trans	-81	-43.5	-160.8	50.6	0	0	0	0	114.9	K522	T518-K522 WeakPolarHBondContact O-CG 3.43Å; T518-K522 PolarHBondContact O-N 3.29Å
519	Q	74.8	Confident	67.4	Low	100 Å²	100	116.8 Å²	116.8	47%	0.467	61%	0.607	S	S	.	*	H	α-helix	trans	-78.5	-46.2	179.3	-172.1	59.2	33.1	0	0	111.8	E521 K522 D523	Q519-E521 PolarHBondContact O-N 3.21Å; Q519-E521 VanDerWaalsContact O-N 3.14Å; Q519-K522 WeakPolarHBondContact O-CA 3.28Å; Q519-K522 WeakPolarHBondContact O-CB 3.42Å; Q519-K522 PolarHBondContact O-N 2.73Å; Q519-D523 PolarHBondContact NE2-OD1 2.91Å; Q519-D523 VanDerWaalsContact O-CG 3.3Å; Q519-D523 PolarHBondContact O-N 2.94Å
520	A	84.8	Confident	70.6	Confident	65 Å²	65	112.3 Å²	112.3	54%	0.537	59%	0.586	S	S	.	*	H	α-helix	trans	-57.2	-32.6	177.8	0	0	0	0	0	112.9	R524	A520-R524 VanDerWaalsContact O-CB 3.22Å; A520-R524 WeakPolarHBondContact O-CB 3.47Å; A520-R524 PolarHBondContact O-N 3.34Å
521	E	86.8	Confident	73.4	Confident	48 Å²	48	112.6 Å²	112.6	22%	0.224	58%	0.579	C	S	.	*	H	α-helix	trans	-72.7	-36.1	173.2	175	61.4	175.6	0	0	113.2	G517 Q519 R524 R525	G517-E521 WeakPolarHBondContact O-CB 3.47Å; G517-E521 PolarHBondContact O-N 2.91Å; Q519-E521 PolarHBondContact O-N 3.21Å; Q519-E521 VanDerWaalsContact O-N 3.14Å; E521-R524 IonicContact OE1-NH2 2.61Å; E521-R524 PolarHBondContact OE1-NH2 2.91Å; E521-R524 IonicContact OE2-CZ 3.51Å; E521-R524 IonicContact OE2-NE 2.79Å; E521-R524 PolarHBondContact OE2-NE 3.24Å; E521-R524 IonicContact OE2-NH2 2.62Å; E521-R524 PolarHBondContact OE2-NH2 3.48Å; E521-R525 WeakPolarHBondContact O-CB 3.4Å; E521-R525 VanDerWaalsContact O-CG 3.22Å; E521-R525 WeakPolarHBondContact O-CG 3.47Å; E521-R525 PolarHBondContact O-N 2.93Å; E521-R525 IonicContact OE1-CZ 2.76Å; E521-R525 IonicContact OE1-NE 3.71Å; E521-R525 PolarHBondContact OE1-NE 2.79Å; E521-R525 IonicContact OE1-NH2 3.54Å; E521-R525 PolarHBondContact OE1-NH2 3.15Å
522	K	85.6	Confident	76.2	Confident	131 Å²	131	105.9 Å²	105.9	57%	0.57	55%	0.547	S	S	*	.	H	α-helix	trans	-61.8	-48.3	170.5	-70.6	171.7	-177.1	176.7	0	110.4	T518 Q519 R524 R525 L526	T518-K522 WeakPolarHBondContact O-CG 3.43Å; T518-K522 PolarHBondContact O-N 3.29Å; Q519-K522 WeakPolarHBondContact O-CA 3.28Å; Q519-K522 WeakPolarHBondContact O-CB 3.42Å; Q519-K522 PolarHBondContact O-N 2.73Å; K522-R524 VanDerWaalsContact C-N 3.33Å; K522-R524 PolarHBondContact O-N 3.03Å; K522-R525 WeakPolarHBondContact O-CB 3.3Å; K522-R525 PolarHBondContact O-N 3.35Å; K522-R525 VanDerWaalsContact O-N 3.13Å; K522-L526 WeakPolarHBondContact O-CB 3.49Å; K522-L526 PolarHBondContact O-N 3.37Å
523	D	89.4	Confident	78.9	Confident	60 Å²	60	99.8 Å²	99.8	32%	0.321	51%	0.509	S	S	.	.	H	α-helix	trans	-63.6	-39.6	-179.5	-56.1	-23.2	0	0	0	111.3	Q519 L526 K527	Q519-D523 PolarHBondContact NE2-OD1 2.91Å; Q519-D523 VanDerWaalsContact O-CG 3.3Å; Q519-D523 PolarHBondContact O-N 2.94Å; D523-L526 PolarHBondContact O-N 3.14Å; D523-K527 WeakPolarHBondContact O-CB 3.26Å; D523-K527 VanDerWaalsContact O-CG 3.25Å; D523-K527 WeakPolarHBondContact O-CG 2.92Å; D523-K527 PolarHBondContact O-N 3.42Å
524	R	92.7	Very high	80.8	Confident	169 Å²	169	96.9 Å²	96.9	64%	0.638	49%	0.485	S	S	*	.	H	α-helix	trans	-63.3	-40.3	173.8	-171.9	173.9	73.7	144.8	3.1	111.9	A520 E521 K522 K528	A520-R524 VanDerWaalsContact O-CB 3.22Å; A520-R524 WeakPolarHBondContact O-CB 3.47Å; A520-R524 PolarHBondContact O-N 3.34Å; E521-R524 IonicContact OE1-NH2 2.61Å; E521-R524 PolarHBondContact OE1-NH2 2.91Å; E521-R524 IonicContact OE2-CZ 3.51Å; E521-R524 IonicContact OE2-NE 2.79Å; E521-R524 PolarHBondContact OE2-NE 3.24Å; E521-R524 IonicContact OE2-NH2 2.62Å; E521-R524 PolarHBondContact OE2-NH2 3.48Å; K522-R524 VanDerWaalsContact C-N 3.33Å; K522-R524 PolarHBondContact O-N 3.03Å; R524-K528 WeakPolarHBondContact O-CB 3.26Å; R524-K528 PolarHBondContact O-N 2.82Å
525	R	90.4	Very high	83.1	Confident	153 Å²	153	95.1 Å²	95.1	58%	0.577	46%	0.463	S	S	*	.	H	α-helix	trans	-67.2	-44.1	174.7	-73.8	171.3	-173.8	-163.5	5.3	111.9	E521 K522 K528 K529	E521-R525 WeakPolarHBondContact O-CB 3.4Å; E521-R525 VanDerWaalsContact O-CG 3.22Å; E521-R525 WeakPolarHBondContact O-CG 3.47Å; E521-R525 PolarHBondContact O-N 2.93Å; E521-R525 IonicContact OE1-CZ 2.76Å; E521-R525 IonicContact OE1-NE 3.71Å; E521-R525 PolarHBondContact OE1-NE 2.79Å; E521-R525 IonicContact OE1-NH2 3.54Å; E521-R525 PolarHBondContact OE1-NH2 3.15Å; K522-R525 WeakPolarHBondContact O-CB 3.3Å; K522-R525 PolarHBondContact O-N 3.35Å; K522-R525 VanDerWaalsContact O-N 3.13Å; R525-K528 WeakPolarHBondContact O-CB 3.39Å; R525-K528 PolarHBondContact O-N 3.39Å; R525-K529 WeakPolarHBondContact O-CG 3.48Å; R525-K529 PolarHBondContact O-N 3.43Å
526	L	90.9	Very high	85.2	Confident	72 Å²	72	87.4 Å²	87.4	38%	0.377	43%	0.431	S	S	.	.	H	α-helix	trans	-61.4	-49.8	177.5	-179.8	57.5	0	0	0	110.9	K522 D523 K528 K529 H530 L557	K522-L526 WeakPolarHBondContact O-CB 3.49Å; K522-L526 PolarHBondContact O-N 3.37Å; D523-L526 PolarHBondContact O-N 3.14Å; L526-K528 VanDerWaalsContact C-N 3.26Å; L526-K528 PolarHBondContact O-N 2.97Å; L526-K529 WeakPolarHBondContact O-CB 3.29Å; L526-K529 PolarHBondContact O-N 2.87Å; L526-H530 PolarHBondContact O-CD2 3.39Å; L526-H530 VanDerWaalsContact O-CD2 3.3Å; L526-H530 PolarHBondContact O-N 3.45Å; L526-L557 HydrophobicContact CD1-CD1 4.37Å; L526-L557 HydrophobicContact CD1-CD2 3.56Å
527	K	92.3	Very high	87.3	Confident	153 Å²	153	82.2 Å²	82.2	67%	0.665	40%	0.399	S	S	*	.	H	α-helix	trans	-55.8	-39.5	173.6	-73	169.2	-178.2	175.5	0	112.2	D523 H530 Q531	D523-K527 WeakPolarHBondContact O-CB 3.26Å; D523-K527 VanDerWaalsContact O-CG 3.25Å; D523-K527 WeakPolarHBondContact O-CG 2.92Å; D523-K527 PolarHBondContact O-N 3.42Å; K527-H530 PolarHBondContact O-N 3.34Å; K527-Q531 WeakPolarHBondContact O-CB 3.39Å; K527-Q531 PolarHBondContact O-N 3.29Å
528	K	94.9	Very high	88.8	Confident	148 Å²	148	89 Å²	89	64%	0.643	41%	0.409	S	S	*	.	H	α-helix	trans	-64.6	-38.6	174.2	-173.2	175.2	179.6	179.1	0	112.9	R524 R525 L526 Q531 L532	R524-K528 WeakPolarHBondContact O-CB 3.26Å; R524-K528 PolarHBondContact O-N 2.82Å; R525-K528 WeakPolarHBondContact O-CB 3.39Å; R525-K528 PolarHBondContact O-N 3.39Å; L526-K528 VanDerWaalsContact C-N 3.26Å; L526-K528 PolarHBondContact O-N 2.97Å; K528-Q531 PolarHBondContact O-N 2.62Å; K528-L532 WeakPolarHBondContact O-CG 3.26Å; K528-L532 PolarHBondContact O-N 2.97Å; K528-L532 VanDerWaalsContact O-N 3.13Å
529	K	93.8	Very high	89.5	Confident	55 Å²	55	90.3 Å²	90.3	24%	0.239	41%	0.406	C	S	.	.	H	α-helix	trans	-64.5	-46.2	175.4	-67.8	-178.4	-167.7	-177.6	0	111.6	R525 L526 Q531 L532 L533 E556 L557	R525-K529 WeakPolarHBondContact O-CG 3.48Å; R525-K529 PolarHBondContact O-N 3.43Å; L526-K529 WeakPolarHBondContact O-CB 3.29Å; L526-K529 PolarHBondContact O-N 2.87Å; K529-Q531 VanDerWaalsContact C-N 3.33Å; K529-Q531 PolarHBondContact O-N 3.16Å; K529-L532 PolarHBondContact O-N 2.89Å; K529-L533 PolarHBondContact O-N 3.43Å; K529-E556 IonicContact NZ-OE1 2.74Å; K529-E556 PolarHBondContact NZ-OE1 3.11Å; K529-E556 IonicContact NZ-OE2 3.16Å; K529-E556 PolarHBondContact NZ-OE2 3.02Å; K529-L557 HydrophobicContact CB-CD1 3.6Å; K529-L557 HydrophobicContact CB-CG 4.5Å
530	H	92.1	Very high	90.1	Very high	87 Å²	87	86.9 Å²	86.9	40%	0.403	40%	0.398	S	S	.	.	H	α-helix	trans	-59	-43.1	173.1	-75.6	-81.3	0	0	0	112.1	L526 K527 L532 L533 E534	L526-H530 PolarHBondContact O-CD2 3.39Å; L526-H530 VanDerWaalsContact O-CD2 3.3Å; L526-H530 PolarHBondContact O-N 3.45Å; K527-H530 PolarHBondContact O-N 3.34Å; H530-L532 VanDerWaalsContact C-N 3.33Å; H530-L532 PolarHBondContact O-N 3.28Å; H530-L533 PolarHBondContact O-N 3.26Å; H530-E534 PolarHBondContact O-N 2.99Å
531	Q	93.5	Very high	90.3	Very high	107 Å²	107	86.5 Å²	86.5	50%	0.5	39%	0.385	S	S	.	.	H	α-helix	trans	-60.7	-39.6	178.8	-170.3	65.8	54.4	0	0	112.5	K527 K528 K529 L533 E534 D535	K527-Q531 WeakPolarHBondContact O-CB 3.39Å; K527-Q531 PolarHBondContact O-N 3.29Å; K528-Q531 PolarHBondContact O-N 2.62Å; K529-Q531 VanDerWaalsContact C-N 3.33Å; K529-Q531 PolarHBondContact O-N 3.16Å; Q531-L533 VanDerWaalsContact C-N 3.33Å; Q531-L533 PolarHBondContact O-N 2.91Å; Q531-E534 PolarHBondContact O-N 3.44Å; Q531-D535 PolarHBondContact NE2-OD1 3.23Å; Q531-D535 WeakPolarHBondContact O-CB 3.36Å; Q531-D535 PolarHBondContact O-N 3.48Å
532	L	95.1	Very high	90.7	Very high	44 Å²	44	85.6 Å²	85.6	23%	0.23	38%	0.384	C	S	.	.	H	α-helix	trans	-60.5	-42.5	176.6	-71.7	171.1	0	0	0	112	K528 K529 H530 D535 A536 P549	K528-L532 WeakPolarHBondContact O-CG 3.26Å; K528-L532 PolarHBondContact O-N 2.97Å; K528-L532 VanDerWaalsContact O-N 3.13Å; K529-L532 PolarHBondContact O-N 2.89Å; H530-L532 VanDerWaalsContact C-N 3.33Å; H530-L532 PolarHBondContact O-N 3.28Å; L532-D535 PolarHBondContact O-N 3.41Å; L532-A536 WeakPolarHBondContact O-CB 3.4Å; L532-A536 PolarHBondContact O-N 3.15Å; L532-P549 HydrophobicContact CD1-CB 4.05Å
533	L	92.6	Very high	91.1	Very high	1 Å²	1	79.4 Å²	79.4	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-70.3	-43.3	179.8	-60	177.7	0	0	0	112.2	K529 H530 Q531 D535 A536 R537 W546 T550 W554 L557 W558	K529-L533 PolarHBondContact O-N 3.43Å; H530-L533 PolarHBondContact O-N 3.26Å; Q531-L533 VanDerWaalsContact C-N 3.33Å; Q531-L533 PolarHBondContact O-N 2.91Å; L533-D535 VanDerWaalsContact C-N 3.33Å; L533-D535 PolarHBondContact O-N 3.13Å; L533-A536 PolarHBondContact O-N 3.13Å; L533-R537 WeakPolarHBondContact O-CB 3.4Å; L533-R537 PolarHBondContact O-N 3.09Å; L533-W546 HydrophobicContact CD2-CZ3 4.24Å; L533-T550 HydrophobicContact CD2-CG2 3.92Å; L533-T550 WeakPolarHBondContact CD2-O 3.45Å; L533-W554 HydrophobicContact CD2-CB 3.67Å; L533-L557 HydrophobicContact CD1-CB 4.11Å; L533-L557 HydrophobicContact CD1-CD1 4.04Å; L533-W558 HydrophobicContact CB-CH2 4Å; L533-W558 HydrophobicContact CB-CZ2 3.62Å; L533-W558 HydrophobicContact CD1-CD2 4.09Å; L533-W558 HydrophobicContact CD1-CG 4.22Å; L533-W558 HydrophobicContact CD1-CZ2 4.18Å; L533-W558 HydrophobicContact CG-CZ2 4.44Å
534	E	90.1	Very high	91.4	Very high	65 Å²	65	78.8 Å²	78.8	30%	0.304	36%	0.36	S	S	.	.	H	α-helix	trans	-65.9	-35.2	174.8	-72	-59.3	159.7	0	0	112.5	H530 Q531 R537 R538	H530-E534 PolarHBondContact O-N 2.99Å; Q531-E534 PolarHBondContact O-N 3.44Å; E534-R537 IonicContact OE1-CZ 2.83Å; E534-R537 IonicContact OE1-NE 3.18Å; E534-R537 IonicContact OE1-NH2 2.75Å; E534-R537 PolarHBondContact OE1-NH2 3.32Å; E534-R537 IonicContact OE2-CZ 3.24Å; E534-R537 IonicContact OE2-NE 2.77Å; E534-R537 PolarHBondContact OE2-NE 2.66Å; E534-R537 VanDerWaalsContact OE2-NE 3.15Å; E534-R537 IonicContact OE2-NH2 3.27Å; E534-R537 PolarHBondContact OE2-NH2 3.47Å; E534-R538 WeakPolarHBondContact O-CB 3.32Å; E534-R538 PolarHBondContact O-N 2.88Å
535	D	90.8	Very high	91.5	Very high	49 Å²	49	77.2 Å²	77.2	26%	0.262	36%	0.36	S	S	.	.	H	α-helix	trans	-64.7	-45.9	173.6	-97.4	35.8	0	0	0	112	Q531 L532 L533 K539	Q531-D535 PolarHBondContact NE2-OD1 3.23Å; Q531-D535 WeakPolarHBondContact O-CB 3.36Å; Q531-D535 PolarHBondContact O-N 3.48Å; L532-D535 PolarHBondContact O-N 3.41Å; L533-D535 VanDerWaalsContact C-N 3.33Å; L533-D535 PolarHBondContact O-N 3.13Å; D535-K539 WeakPolarHBondContact O-CB 3.32Å; D535-K539 WeakPolarHBondContact O-CD 3.46Å; D535-K539 WeakPolarHBondContact O-CG 3.48Å; D535-K539 PolarHBondContact O-N 3.12Å; D535-K539 VanDerWaalsContact O-N 3.08Å; D535-K539 IonicContact OD2-NZ 2.68Å; D535-K539 PolarHBondContact OD2-NZ 2.91Å
536	A	90.4	Very high	91.8	Very high	4 Å²	4	70.1 Å²	70.1	3%	0.033	33%	0.333	C	S	.	.	H	α-helix	trans	-64.3	-44.6	177.7	0	0	0	0	0	111.5	L532 L533 K539 G540 M541 W546 T550	L532-A536 WeakPolarHBondContact O-CB 3.4Å; L532-A536 PolarHBondContact O-N 3.15Å; L533-A536 PolarHBondContact O-N 3.13Å; A536-K539 PolarHBondContact O-N 3.48Å; A536-G540 PolarHBondContact O-N 3.07Å; A536-M541 WeakPolarHBondContact O-CB 3.31Å; A536-M541 PolarHBondContact O-N 3.17Å; A536-M541 VanDerWaalsContact O-N 3.09Å; A536-W546 HydrophobicContact CB-CD2 4.39Å; A536-W546 HydrophobicContact CB-CZ2 4.25Å; A536-T550 HydrophobicContact CB-CG2 3.9Å
537	R	85.9	Confident	92.1	Very high	63 Å²	63	70.3 Å²	70.3	24%	0.238	34%	0.335	C	S	.	.	H	α-helix	trans	-61.9	-50.4	175.7	-175	169	72.9	158.1	2.2	112	L533 E534 K539 G540	L533-R537 WeakPolarHBondContact O-CB 3.4Å; L533-R537 PolarHBondContact O-N 3.09Å; E534-R537 IonicContact OE1-CZ 2.83Å; E534-R537 IonicContact OE1-NE 3.18Å; E534-R537 IonicContact OE1-NH2 2.75Å; E534-R537 PolarHBondContact OE1-NH2 3.32Å; E534-R537 IonicContact OE2-CZ 3.24Å; E534-R537 IonicContact OE2-NE 2.77Å; E534-R537 PolarHBondContact OE2-NE 2.66Å; E534-R537 VanDerWaalsContact OE2-NE 3.15Å; E534-R537 IonicContact OE2-NH2 3.27Å; E534-R537 PolarHBondContact OE2-NH2 3.47Å; R537-K539 VanDerWaalsContact C-N 3.26Å; R537-K539 PolarHBondContact O-N 3.42Å; R537-G540 PolarHBondContact O-N 2.83Å
538	R	86.2	Confident	92.3	Very high	193 Å²	193	63.6 Å²	63.6	73%	0.728	31%	0.309	S	S	*	.	H	α-helix	trans	-59.8	-33.6	178.7	-177.4	-172	-60.8	-104.4	-2	112.9	E534 G540	E534-R538 WeakPolarHBondContact O-CB 3.32Å; E534-R538 PolarHBondContact O-N 2.88Å; R538-G540 PolarHBondContact O-N 3.03Å
539	K	87.1	Confident	92.4	Very high	130 Å²	130	60 Å²	60	57%	0.565	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-4.2	176	-68.5	162.4	-160.8	162.9	0	113	D535 A536 R537 M541	D535-K539 WeakPolarHBondContact O-CB 3.32Å; D535-K539 WeakPolarHBondContact O-CD 3.46Å; D535-K539 WeakPolarHBondContact O-CG 3.48Å; D535-K539 PolarHBondContact O-N 3.12Å; D535-K539 VanDerWaalsContact O-N 3.08Å; D535-K539 IonicContact OD2-NZ 2.68Å; D535-K539 PolarHBondContact OD2-NZ 2.91Å; A536-K539 PolarHBondContact O-N 3.48Å; R537-K539 VanDerWaalsContact C-N 3.26Å; R537-K539 PolarHBondContact O-N 3.42Å; K539-M541 HydrophobicContact CB-CB 4.49Å; K539-M541 PolarHBondContact O-N 3.27Å
540	G	86.4	Confident	92.5	Very high	28 Å²	28	57.9 Å²	57.9	29%	0.289	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	26.5	-175	0	0	0	0	0	113.1	A536 R537 R538	A536-G540 PolarHBondContact O-N 3.07Å; R537-G540 PolarHBondContact O-N 2.83Å; R538-G540 PolarHBondContact O-N 3.03Å
541	M	89.9	Confident	92.8	Very high	57 Å²	57	53.9 Å²	53.9	28%	0.281	27%	0.274	S	S	.	.			trans	-71.5	124.1	-168.3	-174.2	-176.3	-75.1	0	0	110.8	A536 K539 Q545 W546	A536-M541 WeakPolarHBondContact O-CB 3.31Å; A536-M541 PolarHBondContact O-N 3.17Å; A536-M541 VanDerWaalsContact O-N 3.09Å; K539-M541 HydrophobicContact CB-CB 4.49Å; K539-M541 PolarHBondContact O-N 3.27Å; M541-Q545 HydrophobicContact CG-CB 3.8Å; M541-Q545 HydrophobicContact SD-CB 4.19Å; M541-W546 PolarHBondContact O-NE1 3.1Å; M541-W546 HydrophobicContact SD-CG 4.49Å
542	P	93.6	Very high	92.9	Very high	29 Å²	29	49.7 Å²	49.7	19%	0.188	26%	0.256	C	S	.	.			trans	-63.4	141.5	176.1	27.5	-34.6	0	0	0	110.7	A544 Q545 W546 T613	P542-A544 PolarHBondContact O-N 3.39Å; P542-A544 VanDerWaalsContact O-N 3.07Å; P542-Q545 HydrophobicContact CG-CB 4.26Å; P542-Q545 VanDerWaalsContact CG-CD 3.47Å; P542-Q545 HydrophobicContact CG-CG 3.88Å; P542-Q545 WeakPolarHBondContact O-CB 3.46Å; P542-Q545 PolarHBondContact O-N 3.24Å; P542-W546 VanDerWaalsContact O-CD1 3.32Å; P542-T613 WeakPolarHBondContact CA-O 3.43Å; P542-T613 WeakPolarHBondContact CB-O 3.24Å
543	F	95.1	Very high	93	Very high	1 Å²	1	47.8 Å²	47.8	0%	0.004	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-52.3	-38.1	-172.1	-176.2	-111.5	0	0	0	113.1	Q545 W546 W554 G576 M579 I606 M609 V610 T613	F543-Q545 PolarHBondContact O-N 3.43Å; F543-Q545 VanDerWaalsContact O-N 3.13Å; F543-W546 AromaticContact CD2-CD2 3.75Å; F543-W546 HydrophobicContact CD2-CD2 3.75Å; F543-W546 AromaticContact CD2-CE3 3.55Å; F543-W546 HydrophobicContact CD2-CE3 3.55Å; F543-W546 HydrophobicContact CD2-CG 4.35Å; F543-W546 HydrophobicContact CD2-CH2 4.23Å; F543-W546 HydrophobicContact CD2-CZ2 4.39Å; F543-W546 AromaticContact CD2-CZ3 3.8Å; F543-W546 HydrophobicContact CD2-CZ3 3.8Å; F543-W546 HydrophobicContact CE2-CD2 4.37Å; F543-W546 AromaticContact CE2-CE3 3.74Å; F543-W546 HydrophobicContact CE2-CE3 3.74Å; F543-W546 AromaticContact CE2-CZ3 3.92Å; F543-W546 HydrophobicContact CE2-CZ3 3.92Å; F543-W546 WeakPolarHBondContact O-CB 3.46Å; F543-W546 PolarHBondContact O-N 3.13Å; F543-W554 AromaticContact CE2-CD2 3.97Å; F543-W554 HydrophobicContact CE2-CD2 3.97Å; F543-W554 AromaticContact CE2-CE3 3.88Å; F543-W554 HydrophobicContact CE2-CE3 3.88Å; F543-W554 HydrophobicContact CE2-CH2 4.26Å; F543-W554 HydrophobicContact CE2-CZ2 4.33Å; F543-W554 HydrophobicContact CE2-CZ3 4.04Å; F543-W554 HydrophobicContact CZ-CD2 4.39Å; F543-W554 AromaticContact CZ-CE3 3.9Å; F543-W554 HydrophobicContact CZ-CE3 3.9Å; F543-W554 AromaticContact CZ-CH2 3.84Å; F543-W554 HydrophobicContact CZ-CH2 3.84Å; F543-W554 HydrophobicContact CZ-CZ2 4.32Å; F543-W554 AromaticContact CZ-CZ3 3.61Å; F543-W554 HydrophobicContact CZ-CZ3 3.61Å; F543-G576 VanDerWaalsContact O-CA 3.3Å; F543-G576 WeakPolarHBondContact O-CA 3.33Å; F543-M579 HydrophobicContact CE1-CB 3.98Å; F543-M579 HydrophobicContact CE1-CG 3.8Å; F543-M579 HydrophobicContact CZ-CB 4.13Å; F543-M579 HydrophobicContact CZ-CG 3.66Å; F543-I606 HydrophobicContact CE1-CG2 4.3Å; F543-M609 HydrophobicContact CB-CG 4.24Å; F543-M609 HydrophobicContact CD2-CB 4.15Å; F543-M609 HydrophobicContact CD2-CG 3.35Å; F543-M609 HydrophobicContact CE2-CB 4.37Å; F543-M609 HydrophobicContact CE2-CG 3.8Å; F543-M609 HydrophobicContact CG-CB 4.42Å; F543-M609 HydrophobicContact CG-CG 3.92Å; F543-V610 HydrophobicContact CB-CG2 4.26Å; F543-V610 HydrophobicContact CD1-CG2 3.65Å; F543-V610 HydrophobicContact CE1-CG2 4.43Å; F543-V610 HydrophobicContact CG-CG2 4.33Å; F543-T613 WeakPolarHBondContact CB-OG1 3.42Å; F543-T613 PolarHBondContact N-OG1 3.02Å
544	A	95.4	Very high	93.2	Very high	47 Å²	47	47.8 Å²	47.8	39%	0.388	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-58	-26	176.4	0	0	0	0	0	114.3	P542 A577	P542-A544 PolarHBondContact O-N 3.39Å; P542-A544 VanDerWaalsContact O-N 3.07Å; A544-A577 HydrophobicContact CB-CB 4.42Å; A544-A577 WeakPolarHBondContact O-CA 3.47Å; A544-A577 WeakPolarHBondContact O-CB 3.28Å; A544-A577 PolarHBondContact O-N 2.92Å
545	Q	95.5	Very high	93.5	Very high	135 Å²	135	44.8 Å²	44.8	63%	0.631	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-89.4	-4	178.8	-67.1	177.1	3.2	0	0	113.7	M541 P542 F543	M541-Q545 HydrophobicContact CG-CB 3.8Å; M541-Q545 HydrophobicContact SD-CB 4.19Å; P542-Q545 HydrophobicContact CG-CB 4.26Å; P542-Q545 VanDerWaalsContact CG-CD 3.47Å; P542-Q545 HydrophobicContact CG-CG 3.88Å; P542-Q545 WeakPolarHBondContact O-CB 3.46Å; P542-Q545 PolarHBondContact O-N 3.24Å; F543-Q545 PolarHBondContact O-N 3.43Å; F543-Q545 VanDerWaalsContact O-N 3.13Å
546	W	96.9	Very high	93.7	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.015	23%	0.234	C	C	.	.			trans	-68.2	142.2	-179.3	-67.7	17.2	0	0	0	111.3	L533 A536 M541 P542 F543 T550 V551 W554 W558 G576 M609 T613	L533-W546 HydrophobicContact CD2-CZ3 4.24Å; A536-W546 HydrophobicContact CB-CD2 4.39Å; A536-W546 HydrophobicContact CB-CZ2 4.25Å; M541-W546 PolarHBondContact O-NE1 3.1Å; M541-W546 HydrophobicContact SD-CG 4.49Å; P542-W546 VanDerWaalsContact O-CD1 3.32Å; F543-W546 AromaticContact CD2-CD2 3.75Å; F543-W546 HydrophobicContact CD2-CD2 3.75Å; F543-W546 AromaticContact CD2-CE3 3.55Å; F543-W546 HydrophobicContact CD2-CE3 3.55Å; F543-W546 HydrophobicContact CD2-CG 4.35Å; F543-W546 HydrophobicContact CD2-CH2 4.23Å; F543-W546 HydrophobicContact CD2-CZ2 4.39Å; F543-W546 AromaticContact CD2-CZ3 3.8Å; F543-W546 HydrophobicContact CD2-CZ3 3.8Å; F543-W546 HydrophobicContact CE2-CD2 4.37Å; F543-W546 AromaticContact CE2-CE3 3.74Å; F543-W546 HydrophobicContact CE2-CE3 3.74Å; F543-W546 AromaticContact CE2-CZ3 3.92Å; F543-W546 HydrophobicContact CE2-CZ3 3.92Å; F543-W546 WeakPolarHBondContact O-CB 3.46Å; F543-W546 PolarHBondContact O-N 3.13Å; W546-T550 HydrophobicContact CB-CG2 4.36Å; W546-T550 HydrophobicContact CD2-CG2 3.94Å; W546-T550 HydrophobicContact CE3-CG2 3.71Å; W546-T550 HydrophobicContact CG-CG2 4.25Å; W546-T550 HydrophobicContact CZ3-CG2 4.33Å; W546-V551 HydrophobicContact CB-CG2 3.89Å; W546-W554 HydrophobicContact CZ3-CB 3.88Å; W546-W554 AromaticContact CZ3-CD1 3.98Å; W546-W554 AromaticContact CZ3-CG 3.87Å; W546-W554 HydrophobicContact CZ3-CG 3.87Å; W546-W558 HydrophobicContact CH2-CZ3 4.14Å; W546-G576 PolarHBondContact O-N 3.44Å; W546-M609 HydrophobicContact CH2-CG 3.99Å; W546-M609 HydrophobicContact CH2-SD 3.65Å; W546-M609 HydrophobicContact CZ2-CG 4.46Å; W546-M609 HydrophobicContact CZ2-SD 4.04Å; W546-M609 HydrophobicContact CZ3-CG 4.37Å; W546-T613 HydrophobicContact CZ2-CG2 4.04Å
547	D	96.5	Very high	93.8	Very high	77 Å²	77	47.2 Å²	47.2	41%	0.412	24%	0.242	S	C	.	.	B	Isolated β-bridge	trans	-79.6	160.3	175.9	80.9	-15.2	0	0	0	112.1	T550 V551	D547-T550 PolarHBondContact O-N 3.02Å; D547-T550 WeakPolarHBondContact OD1-CB 3.49Å; D547-T550 PolarHBondContact OD1-N 2.83Å; D547-T550 PolarHBondContact OD1-OG1 3.04Å; D547-V551 WeakPolarHBondContact O-CG2 3.35Å; D547-V551 PolarHBondContact O-N 2.98Å
548	G	96.6	Very high	94.2	Very high	12 Å²	12	45.1 Å²	45.1	12%	0.124	23%	0.234	C	C	.	.	H	α-helix	trans	-50.8	-47.7	178.1	0	0	0	0	0	114	T550 V551 V552 K574	G548-T550 VanDerWaalsContact C-N 3.34Å; G548-T550 PolarHBondContact O-N 3.34Å; G548-V551 PolarHBondContact O-N 2.94Å; G548-V552 WeakPolarHBondContact O-CB 3.38Å; G548-V552 VanDerWaalsContact O-CG2 3.24Å; G548-V552 WeakPolarHBondContact O-CG2 3.49Å; G548-V552 PolarHBondContact O-N 3.47Å; G548-K574 VanDerWaalsContact CA-O 3.28Å; G548-K574 WeakPolarHBondContact CA-O 3.14Å; G548-K574 PolarHBondContact N-O 2.94Å
549	P	96.8	Very high	94.6	Very high	71 Å²	71	35.9 Å²	35.9	46%	0.461	20%	0.199	S	C	.	.	H	α-helix	trans	-54.1	-40.8	172.6	-29.9	35.8	0	0	0	115.3	L532 S553	L532-P549 HydrophobicContact CD1-CB 4.05Å; P549-S553 WeakPolarHBondContact O-CB 3.32Å; P549-S553 PolarHBondContact O-N 3.37Å; P549-S553 PolarHBondContact O-OG 3.45Å
550	T	96.6	Very high	94.9	Very high	11 Å²	11	30.4 Å²	30.4	7%	0.067	18%	0.179	C	C	.	.	H	α-helix	trans	-70.1	-45.9	177.2	-56.4	0	0	0	0	110.9	L533 A536 W546 D547 G548 V552 S553 W554	L533-T550 HydrophobicContact CD2-CG2 3.92Å; L533-T550 WeakPolarHBondContact CD2-O 3.45Å; A536-T550 HydrophobicContact CB-CG2 3.9Å; W546-T550 HydrophobicContact CB-CG2 4.36Å; W546-T550 HydrophobicContact CD2-CG2 3.94Å; W546-T550 HydrophobicContact CE3-CG2 3.71Å; W546-T550 HydrophobicContact CG-CG2 4.25Å; W546-T550 HydrophobicContact CZ3-CG2 4.33Å; D547-T550 PolarHBondContact O-N 3.02Å; D547-T550 WeakPolarHBondContact OD1-CB 3.49Å; D547-T550 PolarHBondContact OD1-N 2.83Å; D547-T550 PolarHBondContact OD1-OG1 3.04Å; G548-T550 VanDerWaalsContact C-N 3.34Å; G548-T550 PolarHBondContact O-N 3.34Å; T550-V552 VanDerWaalsContact C-N 3.35Å; T550-V552 PolarHBondContact O-N 2.92Å; T550-S553 WeakPolarHBondContact O-CB 3.21Å; T550-S553 PolarHBondContact O-N 3.16Å; T550-S553 VanDerWaalsContact O-N 3.14Å; T550-W554 WeakPolarHBondContact O-CB 3.46Å; T550-W554 PolarHBondContact O-N 2.73Å
551	V	97.2	Very high	95.4	Very high	3 Å²	3	29.4 Å²	29.4	2%	0.018	17%	0.167	C	C	.	.	H	α-helix	trans	-60.8	-41.7	176	175.8	0	0	0	0	112	W546 D547 G548 S553 W554 L555 M579	W546-V551 HydrophobicContact CB-CG2 3.89Å; D547-V551 WeakPolarHBondContact O-CG2 3.35Å; D547-V551 PolarHBondContact O-N 2.98Å; G548-V551 PolarHBondContact O-N 2.94Å; V551-S553 VanDerWaalsContact C-N 3.34Å; V551-W554 HydrophobicContact CG1-CE3 4.31Å; V551-W554 WeakPolarHBondContact O-CB 3.47Å; V551-W554 PolarHBondContact O-N 2.98Å; V551-L555 WeakPolarHBondContact O-CG 3.37Å; V551-L555 PolarHBondContact O-N 3.16Å; V551-M579 HydrophobicContact CG1-CB 4.11Å; V551-M579 HydrophobicContact CG1-CE 3.48Å; V551-M579 VanDerWaalsContact CG1-CE 3.48Å; V551-M579 HydrophobicContact CG1-CG 3.99Å
552	V	96.9	Very high	95.7	Very high	20 Å²	20	28.1 Å²	28.1	12%	0.121	16%	0.163	C	C	.	.	H	α-helix	trans	-64.2	-39.4	175.2	166.8	0	0	0	0	111.4	G548 T550 W554 E556 V566 R570	G548-V552 WeakPolarHBondContact O-CB 3.38Å; G548-V552 VanDerWaalsContact O-CG2 3.24Å; G548-V552 WeakPolarHBondContact O-CG2 3.49Å; G548-V552 PolarHBondContact O-N 3.47Å; T550-V552 VanDerWaalsContact C-N 3.35Å; T550-V552 PolarHBondContact O-N 2.92Å; V552-W554 VanDerWaalsContact C-N 3.32Å; V552-E556 PolarHBondContact O-N 3.26Å; V552-V566 HydrophobicContact CG1-CG1 3.77Å; V552-R570 HydrophobicContact CG2-CB 3.71Å; V552-R570 HydrophobicContact CG2-CG 4.03Å
553	S	96.4	Very high	95.7	Very high	4 Å²	4	30.5 Å²	30.5	3%	0.028	19%	0.185	C	C	.	.	H	α-helix	trans	-64.9	-37.2	174.9	-57.6	0	0	0	0	111.8	P549 T550 V551 E556 L557	P549-S553 WeakPolarHBondContact O-CB 3.32Å; P549-S553 PolarHBondContact O-N 3.37Å; P549-S553 PolarHBondContact O-OG 3.45Å; T550-S553 WeakPolarHBondContact O-CB 3.21Å; T550-S553 PolarHBondContact O-N 3.16Å; T550-S553 VanDerWaalsContact O-N 3.14Å; V551-S553 VanDerWaalsContact C-N 3.34Å; S553-E556 PolarHBondContact O-N 3.19Å; S553-L557 WeakPolarHBondContact O-CB 3.45Å; S553-L557 WeakPolarHBondContact O-CG 3.32Å; S553-L557 PolarHBondContact O-N 3.47Å
554	W	96.2	Very high	95.7	Very high	1 Å²	1	37.9 Å²	37.9	0%	0.004	21%	0.213	C	C	.	.	H	α-helix	trans	-67.8	-46.5	179.1	166	73.4	0	0	0	112.5	L533 F543 W546 T550 V551 V552 E556 L557 W558 V559 M579 A605 I606 M609	L533-W554 HydrophobicContact CD2-CB 3.67Å; F543-W554 AromaticContact CE2-CD2 3.97Å; F543-W554 HydrophobicContact CE2-CD2 3.97Å; F543-W554 AromaticContact CE2-CE3 3.88Å; F543-W554 HydrophobicContact CE2-CE3 3.88Å; F543-W554 HydrophobicContact CE2-CH2 4.26Å; F543-W554 HydrophobicContact CE2-CZ2 4.33Å; F543-W554 HydrophobicContact CE2-CZ3 4.04Å; F543-W554 HydrophobicContact CZ-CD2 4.39Å; F543-W554 AromaticContact CZ-CE3 3.9Å; F543-W554 HydrophobicContact CZ-CE3 3.9Å; F543-W554 AromaticContact CZ-CH2 3.84Å; F543-W554 HydrophobicContact CZ-CH2 3.84Å; F543-W554 HydrophobicContact CZ-CZ2 4.32Å; F543-W554 AromaticContact CZ-CZ3 3.61Å; F543-W554 HydrophobicContact CZ-CZ3 3.61Å; W546-W554 HydrophobicContact CZ3-CB 3.88Å; W546-W554 AromaticContact CZ3-CD1 3.98Å; W546-W554 AromaticContact CZ3-CG 3.87Å; W546-W554 HydrophobicContact CZ3-CG 3.87Å; T550-W554 WeakPolarHBondContact O-CB 3.46Å; T550-W554 PolarHBondContact O-N 2.73Å; V551-W554 HydrophobicContact CG1-CE3 4.31Å; V551-W554 WeakPolarHBondContact O-CB 3.47Å; V551-W554 PolarHBondContact O-N 2.98Å; V552-W554 VanDerWaalsContact C-N 3.32Å; W554-E556 VanDerWaalsContact C-N 3.26Å; W554-E556 PolarHBondContact O-N 3.33Å; W554-L557 PolarHBondContact O-N 2.9Å; W554-W558 AromaticContact CD1-CE3 3.62Å; W554-W558 PolarHBondContact O-N 3.32Å; W554-V559 HydrophobicContact CD2-CG2 3.76Å; W554-V559 HydrophobicContact CE3-CG2 4.08Å; W554-V559 HydrophobicContact CG-CG2 4.4Å; W554-V559 HydrophobicContact CH2-CG2 3.77Å; W554-V559 HydrophobicContact CZ2-CG2 3.4Å; W554-V559 VanDerWaalsContact CZ2-CG2 3.4Å; W554-V559 HydrophobicContact CZ3-CG2 4.08Å; W554-V559 PolarHBondContact O-N 3.31Å; W554-V559 VanDerWaalsContact O-N 3.08Å; W554-M579 HydrophobicContact CZ3-CG 4.2Å; W554-A605 HydrophobicContact CH2-CB 4.09Å; W554-A605 HydrophobicContact CZ2-CB 3.87Å; W554-A605 WeakPolarHBondContact CZ2-O 3.24Å; W554-I606 HydrophobicContact CH2-CG1 3.92Å; W554-I606 HydrophobicContact CZ3-CG1 4.45Å; W554-M609 HydrophobicContact CZ2-CB 4Å; W554-M609 HydrophobicContact CZ2-CG 4.44Å
555	L	96.6	Very high	95.8	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-55.1	-44.2	174.8	-72.2	173.1	0	0	0	111.6	V551 G560 M561 V566 C569 M579 L602	V551-L555 WeakPolarHBondContact O-CG 3.37Å; V551-L555 PolarHBondContact O-N 3.16Å; L555-G560 PolarHBondContact O-N 2.94Å; L555-M561 HydrophobicContact CB-CB 4.4Å; L555-M561 HydrophobicContact CB-CG 4.35Å; L555-M561 HydrophobicContact CD2-CG 4.12Å; L555-M561 WeakPolarHBondContact O-CB 3.48Å; L555-M561 PolarHBondContact O-N 2.78Å; L555-V566 HydrophobicContact CB-CG2 4.19Å; L555-C569 HydrophobicContact CD1-CB 3.33Å; L555-M579 HydrophobicContact CD1-CE 3.76Å; L555-M579 HydrophobicContact CD2-CE 4.17Å; L555-M579 HydrophobicContact CG-CE 4.24Å; L555-L602 HydrophobicContact CD2-CD1 3.61Å
556	E	95.2	Very high	95.8	Very high	65 Å²	65	30 Å²	30	30%	0.304	17%	0.168	S	C	.	.	H	α-helix	trans	-73.2	-46.1	-177.1	-165.6	178.2	128.7	0	0	112.3	K529 V552 S553 W554 V566	K529-E556 IonicContact NZ-OE1 2.74Å; K529-E556 PolarHBondContact NZ-OE1 3.11Å; K529-E556 IonicContact NZ-OE2 3.16Å; K529-E556 PolarHBondContact NZ-OE2 3.02Å; V552-E556 PolarHBondContact O-N 3.26Å; S553-E556 PolarHBondContact O-N 3.19Å; W554-E556 VanDerWaalsContact C-N 3.26Å; W554-E556 PolarHBondContact O-N 3.33Å; E556-V566 HydrophobicContact CB-CG1 4.35Å; E556-V566 HydrophobicContact CB-CG2 4.12Å
557	L	92.7	Very high	95.8	Very high	40 Å²	40	32.5 Å²	32.5	21%	0.209	19%	0.19	C	C	.	.	H	α-helix	trans	-95.8	-34.2	-168.4	-59.3	-178.8	0	0	0	115.3	L526 K529 L533 S553 W554	L526-L557 HydrophobicContact CD1-CD1 4.37Å; L526-L557 HydrophobicContact CD1-CD2 3.56Å; K529-L557 HydrophobicContact CB-CD1 3.6Å; K529-L557 HydrophobicContact CB-CG 4.5Å; L533-L557 HydrophobicContact CD1-CB 4.11Å; L533-L557 HydrophobicContact CD1-CD1 4.04Å; S553-L557 WeakPolarHBondContact O-CB 3.45Å; S553-L557 WeakPolarHBondContact O-CG 3.32Å; S553-L557 PolarHBondContact O-N 3.47Å; W554-L557 PolarHBondContact O-N 2.9Å
558	W	93.8	Very high	95.7	Very high	18 Å²	18	30.1 Å²	30.1	7%	0.068	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-31.7	-174.1	-69.5	-0.3	0	0	0	112.9	L533 W546 W554 M609 Y648 G649	L533-W558 HydrophobicContact CB-CH2 4Å; L533-W558 HydrophobicContact CB-CZ2 3.62Å; L533-W558 HydrophobicContact CD1-CD2 4.09Å; L533-W558 HydrophobicContact CD1-CG 4.22Å; L533-W558 HydrophobicContact CD1-CZ2 4.18Å; L533-W558 HydrophobicContact CG-CZ2 4.44Å; W546-W558 HydrophobicContact CH2-CZ3 4.14Å; W554-W558 AromaticContact CD1-CE3 3.62Å; W554-W558 PolarHBondContact O-N 3.32Å; W558-M609 HydrophobicContact CE3-CE 3.78Å; W558-M609 HydrophobicContact CZ3-CE 3.9Å; W558-M609 HydrophobicContact CZ3-SD 4.5Å; W558-Y648 AromaticContact CD2-CD1 3.88Å; W558-Y648 HydrophobicContact CD2-CD1 3.88Å; W558-Y648 AromaticContact CE2-CD1 3.8Å; W558-Y648 AromaticContact CE3-CD1 3.78Å; W558-Y648 HydrophobicContact CE3-CD1 3.78Å; W558-Y648 HydrophobicContact CE3-CE1 4.11Å; W558-Y648 AromaticContact CH2-CD1 3.75Å; W558-Y648 HydrophobicContact CH2-CD1 3.75Å; W558-Y648 AromaticContact CH2-CE1 3.6Å; W558-Y648 HydrophobicContact CH2-CE1 3.6Å; W558-Y648 AromaticContact CZ2-CD1 3.74Å; W558-Y648 HydrophobicContact CZ2-CD1 3.74Å; W558-Y648 HydrophobicContact CZ2-CE1 4.03Å; W558-Y648 AromaticContact CZ3-CD1 3.74Å; W558-Y648 HydrophobicContact CZ3-CD1 3.74Å; W558-Y648 AromaticContact CZ3-CE1 3.61Å; W558-Y648 HydrophobicContact CZ3-CE1 3.61Å; W558-G649 WeakPolarHBondContact O-CA 3.38Å
559	V	95.1	Very high	95.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	-84.8	-26.8	171.9	-168.4	0	0	0	0	111.3	W554 M561 K601 A605	W554-V559 HydrophobicContact CD2-CG2 3.76Å; W554-V559 HydrophobicContact CE3-CG2 4.08Å; W554-V559 HydrophobicContact CG-CG2 4.4Å; W554-V559 HydrophobicContact CH2-CG2 3.77Å; W554-V559 HydrophobicContact CZ2-CG2 3.4Å; W554-V559 VanDerWaalsContact CZ2-CG2 3.4Å; W554-V559 HydrophobicContact CZ3-CG2 4.08Å; W554-V559 PolarHBondContact O-N 3.31Å; W554-V559 VanDerWaalsContact O-N 3.08Å; V559-M561 HydrophobicContact CB-CG 4.02Å; V559-M561 HydrophobicContact CG1-CG 3.72Å; V559-M561 HydrophobicContact CG1-SD 3.94Å; V559-K601 HydrophobicContact CG1-CG 4.44Å; V559-K601 WeakPolarHBondContact O-CE 3Å; V559-K601 PolarHBondContact O-NZ 2.77Å; V559-A605 HydrophobicContact CB-CB 4.48Å; V559-A605 HydrophobicContact CG1-CB 3.79Å; V559-A605 HydrophobicContact CG2-CB 3.88Å
560	G	94.6	Very high	95.6	Very high	14 Å²	14	34.4 Å²	34.4	14%	0.144	18%	0.184	C	C	.	.			trans	66.2	44	-176.2	0	0	0	0	0	111.9	L555 H653	L555-G560 PolarHBondContact O-N 2.94Å; G560-H653 PolarHBondContact O-CE1 2.99Å; G560-H653 PolarHBondContact O-ND1 3.19Å
561	M	96.1	Very high	95.5	Very high	7 Å²	7	36.7 Å²	36.7	3%	0.034	20%	0.204	C	C	.	.			trans	-79.2	133.9	175.8	-66.6	-62.8	-74.2	0	0	110.6	L555 V559 Y565 V566 K601	L555-M561 HydrophobicContact CB-CB 4.4Å; L555-M561 HydrophobicContact CB-CG 4.35Å; L555-M561 HydrophobicContact CD2-CG 4.12Å; L555-M561 WeakPolarHBondContact O-CB 3.48Å; L555-M561 PolarHBondContact O-N 2.78Å; V559-M561 HydrophobicContact CB-CG 4.02Å; V559-M561 HydrophobicContact CG1-CG 3.72Å; V559-M561 HydrophobicContact CG1-SD 3.94Å; M561-Y565 HydrophobicContact CE-CD2 3.63Å; M561-Y565 HydrophobicContact CE-CE2 4.41Å; M561-Y565 HydrophobicContact CE-CG 3.93Å; M561-V566 HydrophobicContact CB-CG2 3.86Å; M561-V566 VanDerWaalsContact O-CG2 3.3Å; M561-V566 WeakPolarHBondContact O-CG2 3.26Å; M561-K601 HydrophobicContact SD-CD 3.72Å; M561-K601 HydrophobicContact SD-CG 4.42Å
562	P	95.7	Very high	95.4	Very high	31 Å²	31	40.3 Å²	40.3	20%	0.201	22%	0.224	C	C	.	.			trans	-54.6	146.4	173.4	-28.9	35.3	0	0	0	113.6	W564 Y565 V566 L677	P562-W564 HydrophobicContact CB-CD2 4.37Å; P562-W564 HydrophobicContact CB-CG 4.34Å; P562-W564 HydrophobicContact CB-CZ2 4.27Å; P562-W564 HydrophobicContact CG-CZ2 4.41Å; P562-W564 PolarHBondContact O-N 3.06Å; P562-Y565 PolarHBondContact O-N 3.26Å; P562-V566 PolarHBondContact O-N 3.39Å; P562-L677 HydrophobicContact CG-CD1 3.89Å; P562-L677 HydrophobicContact CG-CD2 3.64Å; P562-L677 HydrophobicContact CG-CG 4.42Å
563	A	94.9	Very high	95.3	Very high	78 Å²	78	39.8 Å²	39.8	65%	0.645	22%	0.22	S	C	*	.	H	α-helix	trans	-55.2	-28.5	-172.4	0	0	0	0	0	114.7	V566 A567	A563-V566 PolarHBondContact O-N 2.92Å; A563-A567 WeakPolarHBondContact O-CB 3.47Å; A563-A567 PolarHBondContact O-N 3.49Å
564	W	93.7	Very high	95.3	Very high	156 Å²	156	45.4 Å²	45.4	59%	0.591	24%	0.244	S	C	*	.	H	α-helix	trans	-72.5	-39.5	176.6	49.5	-88.5	0	0	0	112.8	P562 A567 A568	P562-W564 HydrophobicContact CB-CD2 4.37Å; P562-W564 HydrophobicContact CB-CG 4.34Å; P562-W564 HydrophobicContact CB-CZ2 4.27Å; P562-W564 HydrophobicContact CG-CZ2 4.41Å; P562-W564 PolarHBondContact O-N 3.06Å; W564-A567 PolarHBondContact O-N 3.43Å; W564-A568 PolarHBondContact O-N 2.88Å
565	Y	97.1	Very high	95.3	Very high	10 Å²	10	46.9 Å²	46.9	4%	0.039	26%	0.255	C	S	.	.	H	α-helix	trans	-68.4	-38.3	168.1	-78.1	-42.5	0	0	0	112.1	M561 P562 A567 A568 C569 I593 H598 L677	M561-Y565 HydrophobicContact CE-CD2 3.63Å; M561-Y565 HydrophobicContact CE-CE2 4.41Å; M561-Y565 HydrophobicContact CE-CG 3.93Å; P562-Y565 PolarHBondContact O-N 3.26Å; Y565-A567 PolarHBondContact O-N 3.43Å; Y565-A568 PolarHBondContact O-N 3.32Å; Y565-C569 WeakPolarHBondContact O-CB 3.33Å; Y565-C569 PolarHBondContact O-N 2.8Å; Y565-C569 PolarHBondContact O-SG 3.49Å; Y565-C569 VanDerWaalsContact O-SG 3.39Å; Y565-I593 HydrophobicContact CD1-CD1 3.84Å; Y565-I593 HydrophobicContact CD1-CG1 3.84Å; Y565-I593 HydrophobicContact CE1-CB 4.04Å; Y565-I593 HydrophobicContact CE1-CD1 3.92Å; Y565-I593 HydrophobicContact CE1-CG1 3.57Å; Y565-I593 HydrophobicContact CE1-CG2 3.94Å; Y565-I593 HydrophobicContact CG-CD1 4.35Å; Y565-H598 HydrophobicContact CE2-CB 4.05Å; Y565-H598 AromaticContact CE2-CG 3.91Å; Y565-H598 AromaticContact CE2-ND1 3.35Å; Y565-H598 VanDerWaalsContact CE2-ND1 3.35Å; Y565-H598 WeakPolarHBondContact CE2-ND1 3.39Å; Y565-H598 AromaticContact CZ-ND1 3.53Å; Y565-H598 PolarHBondContact OH-ND1 3.04Å; Y565-L677 HydrophobicContact CD2-CD1 4.24Å; Y565-L677 HydrophobicContact CE2-CD1 4.09Å
566	V	96.8	Very high	95.3	Very high	7 Å²	7	46.9 Å²	46.9	4%	0.042	26%	0.255	C	S	.	.	H	α-helix	trans	-60.4	-37.2	174.7	178.2	0	0	0	0	110.8	V552 L555 E556 M561 P562 A563 R570	V552-V566 HydrophobicContact CG1-CG1 3.77Å; L555-V566 HydrophobicContact CB-CG2 4.19Å; E556-V566 HydrophobicContact CB-CG1 4.35Å; E556-V566 HydrophobicContact CB-CG2 4.12Å; M561-V566 HydrophobicContact CB-CG2 3.86Å; M561-V566 VanDerWaalsContact O-CG2 3.3Å; M561-V566 WeakPolarHBondContact O-CG2 3.26Å; P562-V566 PolarHBondContact O-N 3.39Å; A563-V566 PolarHBondContact O-N 2.92Å; V566-R570 VanDerWaalsContact O-CB 3.24Å; V566-R570 WeakPolarHBondContact O-CB 3.28Å; V566-R570 PolarHBondContact O-N 3.04Å
567	A	96	Very high	95.3	Very high	57 Å²	57	45.9 Å²	45.9	47%	0.471	26%	0.257	S	S	.	.	H	α-helix	trans	-66.7	-45.2	173.6	0	0	0	0	0	112.8	A563 W564 Y565 R570 A571	A563-A567 WeakPolarHBondContact O-CB 3.47Å; A563-A567 PolarHBondContact O-N 3.49Å; W564-A567 PolarHBondContact O-N 3.43Å; Y565-A567 PolarHBondContact O-N 3.43Å; A567-R570 PolarHBondContact O-N 2.83Å; A567-A571 PolarHBondContact O-N 3.24Å
568	A	94.8	Very high	95.5	Very high	27 Å²	27	47.5 Å²	47.5	22%	0.223	27%	0.265	C	S	.	.	H	α-helix	trans	-61.7	-48	176	0	0	0	0	0	112	W564 Y565 R570 A571 N572 I591	W564-A568 PolarHBondContact O-N 2.88Å; Y565-A568 PolarHBondContact O-N 3.32Å; A568-R570 VanDerWaalsContact C-N 3.3Å; A568-R570 PolarHBondContact O-N 3.31Å; A568-A571 WeakPolarHBondContact O-CB 3.43Å; A568-A571 PolarHBondContact O-N 2.8Å; A568-A571 VanDerWaalsContact O-N 3.08Å; A568-N572 PolarHBondContact O-N 2.61Å; A568-N572 VanDerWaalsContact O-N 3.15Å; A568-I591 HydrophobicContact CB-CG2 4.05Å
569	C	95.6	Very high	95.6	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.007	26%	0.262	C	S	.	.	H	α-helix	trans	-58.5	-40.5	173.6	-69.7	0	0	0	0	111.9	L555 Y565 A571 N572 V573 M579	L555-C569 HydrophobicContact CD1-CB 3.33Å; Y565-C569 WeakPolarHBondContact O-CB 3.33Å; Y565-C569 PolarHBondContact O-N 2.8Å; Y565-C569 PolarHBondContact O-SG 3.49Å; Y565-C569 VanDerWaalsContact O-SG 3.39Å; C569-A571 VanDerWaalsContact C-N 3.32Å; C569-A571 PolarHBondContact O-N 3.29Å; C569-N572 PolarHBondContact O-N 2.91Å; C569-V573 WeakPolarHBondContact O-CA 3.42Å; C569-V573 VanDerWaalsContact O-CB 3.26Å; C569-V573 WeakPolarHBondContact O-CB 3.39Å; C569-V573 PolarHBondContact O-N 3.31Å; C569-M579 HydrophobicContact CB-CE 4.35Å
570	R	95.9	Very high	95.6	Very high	172 Å²	172	48.9 Å²	48.9	65%	0.649	28%	0.278	S	S	*	.	H	α-helix	trans	-66.5	-31.7	175.4	-179.3	174.6	173.3	-108.5	-4.8	113.1	V552 V566 A567 A568 K574	V552-R570 HydrophobicContact CG2-CB 3.71Å; V552-R570 HydrophobicContact CG2-CG 4.03Å; V566-R570 VanDerWaalsContact O-CB 3.24Å; V566-R570 WeakPolarHBondContact O-CB 3.28Å; V566-R570 PolarHBondContact O-N 3.04Å; A567-R570 PolarHBondContact O-N 2.83Å; A568-R570 VanDerWaalsContact C-N 3.3Å; A568-R570 PolarHBondContact O-N 3.31Å; R570-K574 PolarHBondContact O-NZ 3.38Å
571	A	94.9	Very high	95.6	Very high	58 Å²	58	51.9 Å²	51.9	48%	0.479	30%	0.301	S	S	.	.	H	α-helix	trans	-67.5	-40.3	177	0	0	0	0	0	111.6	A567 A568 C569 K574	A567-A571 PolarHBondContact O-N 3.24Å; A568-A571 WeakPolarHBondContact O-CB 3.43Å; A568-A571 PolarHBondContact O-N 2.8Å; A568-A571 VanDerWaalsContact O-N 3.08Å; C569-A571 VanDerWaalsContact C-N 3.32Å; C569-A571 PolarHBondContact O-N 3.29Å; A571-K574 VanDerWaalsContact O-CE 3.24Å; A571-K574 WeakPolarHBondContact O-CE 3.38Å; A571-K574 PolarHBondContact O-NZ 2.88Å
572	N	94	Very high	95.6	Very high	80 Å²	80	52.4 Å²	52.4	43%	0.428	30%	0.304	S	S	.	.	H	α-helix	trans	-109	-35.9	-168.2	-57.8	-23.2	0	0	0	113.3	A568 C569 E590	A568-N572 PolarHBondContact O-N 2.61Å; A568-N572 VanDerWaalsContact O-N 3.15Å; C569-N572 PolarHBondContact O-N 2.91Å; N572-E590 PolarHBondContact ND2-O 3.22Å
573	V	95.7	Very high	95.5	Very high	8 Å²	8	53 Å²	53	5%	0.048	31%	0.309	C	S	.	.			trans	-94.9	127.6	-178.4	-169.4	0	0	0	0	111.2	C569 S575 I578 M579 L582 I591	C569-V573 WeakPolarHBondContact O-CA 3.42Å; C569-V573 VanDerWaalsContact O-CB 3.26Å; C569-V573 WeakPolarHBondContact O-CB 3.39Å; C569-V573 PolarHBondContact O-N 3.31Å; V573-S575 WeakPolarHBondContact CG1-O 3.44Å; V573-I578 HydrophobicContact CG1-CB 4.01Å; V573-I578 HydrophobicContact CG1-CG2 3.91Å; V573-M579 HydrophobicContact CB-CE 4.18Å; V573-M579 HydrophobicContact CG1-CB 3.89Å; V573-M579 HydrophobicContact CG1-CE 3.95Å; V573-M579 HydrophobicContact CG2-CE 4.08Å; V573-L582 HydrophobicContact CG2-CD1 4.12Å; V573-I591 HydrophobicContact CG2-CD1 3.95Å
574	K	95.4	Very high	95.5	Very high	122 Å²	122	51.5 Å²	51.5	53%	0.53	29%	0.29	S	S	.	.			trans	-113.8	-13.7	-174.3	-52.3	-58.4	167.7	-170.9	0	115.3	G548 R570 A571 I578	G548-K574 VanDerWaalsContact CA-O 3.28Å; G548-K574 WeakPolarHBondContact CA-O 3.14Å; G548-K574 PolarHBondContact N-O 2.94Å; R570-K574 PolarHBondContact O-NZ 3.38Å; A571-K574 VanDerWaalsContact O-CE 3.24Å; A571-K574 WeakPolarHBondContact O-CE 3.38Å; A571-K574 PolarHBondContact O-NZ 2.88Å; K574-I578 HydrophobicContact CB-CD1 4.13Å
575	S	97.2	Very high	95.6	Very high	33 Å²	33	47.2 Å²	47.2	23%	0.231	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-153.3	163.9	178.9	63	0	0	0	0	111	V573 A577 I578 M579	V573-S575 WeakPolarHBondContact CG1-O 3.44Å; S575-A577 VanDerWaalsContact C-N 3.26Å; S575-A577 PolarHBondContact O-N 3.34Å; S575-I578 PolarHBondContact O-N 3.2Å; S575-I578 PolarHBondContact OG-N 3.37Å; S575-M579 PolarHBondContact O-N 3.03Å; S575-M579 VanDerWaalsContact O-N 3.11Å
576	G	96.3	Very high	95.5	Very high	0 Å²	0	50 Å²	50	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.9	-27.9	174.1	0	0	0	0	0	113	F543 W546 M579 S580	F543-G576 VanDerWaalsContact O-CA 3.3Å; F543-G576 WeakPolarHBondContact O-CA 3.33Å; W546-G576 PolarHBondContact O-N 3.44Å; G576-M579 PolarHBondContact O-N 3.41Å; G576-S580 VanDerWaalsContact O-CB 3.29Å; G576-S580 WeakPolarHBondContact O-CB 3.32Å; G576-S580 PolarHBondContact O-N 3.26Å; G576-S580 PolarHBondContact O-OG 3.03Å
577	A	96.1	Very high	95.5	Very high	44 Å²	44	49.7 Å²	49.7	36%	0.364	29%	0.293	S	S	.	.	H	α-helix	trans	-59	-50.4	172.6	0	0	0	0	0	111.2	A544 S575 S580 A581	A544-A577 HydrophobicContact CB-CB 4.42Å; A544-A577 WeakPolarHBondContact O-CA 3.47Å; A544-A577 WeakPolarHBondContact O-CB 3.28Å; A544-A577 PolarHBondContact O-N 2.92Å; S575-A577 VanDerWaalsContact C-N 3.26Å; S575-A577 PolarHBondContact O-N 3.34Å; A577-S580 PolarHBondContact O-N 3.35Å; A577-S580 PolarHBondContact O-OG 2.92Å; A577-A581 PolarHBondContact O-N 3.47Å
578	I	95.9	Very high	95.5	Very high	74 Å²	74	51.2 Å²	51.2	38%	0.379	29%	0.29	S	S	.	.	H	α-helix	trans	-59.7	-50.9	175	-61.7	166.1	0	0	0	109.1	V573 K574 S575 S580 A581 L582	V573-I578 HydrophobicContact CG1-CB 4.01Å; V573-I578 HydrophobicContact CG1-CG2 3.91Å; K574-I578 HydrophobicContact CB-CD1 4.13Å; S575-I578 PolarHBondContact O-N 3.2Å; S575-I578 PolarHBondContact OG-N 3.37Å; I578-S580 PolarHBondContact O-N 2.83Å; I578-A581 PolarHBondContact O-N 3.49Å; I578-L582 WeakPolarHBondContact O-CG 3.46Å; I578-L582 PolarHBondContact O-N 3.37Å
579	M	96.8	Very high	95.5	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-54.6	-39	179.1	-171	59.7	81.2	0	0	112.9	F543 V551 W554 L555 C569 V573 S575 G576 A581 L582 L602 I606	F543-M579 HydrophobicContact CE1-CB 3.98Å; F543-M579 HydrophobicContact CE1-CG 3.8Å; F543-M579 HydrophobicContact CZ-CB 4.13Å; F543-M579 HydrophobicContact CZ-CG 3.66Å; V551-M579 HydrophobicContact CG1-CB 4.11Å; V551-M579 HydrophobicContact CG1-CE 3.48Å; V551-M579 VanDerWaalsContact CG1-CE 3.48Å; V551-M579 HydrophobicContact CG1-CG 3.99Å; W554-M579 HydrophobicContact CZ3-CG 4.2Å; L555-M579 HydrophobicContact CD1-CE 3.76Å; L555-M579 HydrophobicContact CD2-CE 4.17Å; L555-M579 HydrophobicContact CG-CE 4.24Å; C569-M579 HydrophobicContact CB-CE 4.35Å; V573-M579 HydrophobicContact CB-CE 4.18Å; V573-M579 HydrophobicContact CG1-CB 3.89Å; V573-M579 HydrophobicContact CG1-CE 3.95Å; V573-M579 HydrophobicContact CG2-CE 4.08Å; S575-M579 PolarHBondContact O-N 3.03Å; S575-M579 VanDerWaalsContact O-N 3.11Å; G576-M579 PolarHBondContact O-N 3.41Å; M579-A581 VanDerWaalsContact C-N 3.33Å; M579-A581 PolarHBondContact O-N 2.99Å; M579-L582 HydrophobicContact SD-CD1 3.7Å; M579-L602 HydrophobicContact SD-CD1 4.22Å; M579-I606 HydrophobicContact CG-CD1 4.17Å; M579-I606 HydrophobicContact CG-CG1 4.06Å; M579-I606 WeakPolarHBondContact O-CD1 3.39Å; M579-I606 HydrophobicContact SD-CD1 3.92Å; M579-I606 HydrophobicContact SD-CG1 4.32Å
580	S	95.2	Very high	95.3	Very high	46 Å²	46	64.3 Å²	64.3	32%	0.322	34%	0.339	S	S	.	.	H	α-helix	trans	-74.1	-18.8	-178.9	68.1	0	0	0	0	114.9	G576 A577 I578	G576-S580 VanDerWaalsContact O-CB 3.29Å; G576-S580 WeakPolarHBondContact O-CB 3.32Å; G576-S580 PolarHBondContact O-N 3.26Å; G576-S580 PolarHBondContact O-OG 3.03Å; A577-S580 PolarHBondContact O-N 3.35Å; A577-S580 PolarHBondContact O-OG 2.92Å; I578-S580 PolarHBondContact O-N 2.83Å
581	A	94.6	Very high	95.2	Very high	77 Å²	77	56.5 Å²	56.5	64%	0.636	31%	0.31	S	S	*	.	H	α-helix	trans	-97.1	-12.9	-176.5	0	0	0	0	0	113.9	A577 I578 M579 S583	A577-A581 PolarHBondContact O-N 3.47Å; I578-A581 PolarHBondContact O-N 3.49Å; M579-A581 VanDerWaalsContact C-N 3.33Å; M579-A581 PolarHBondContact O-N 2.99Å; A581-S583 PolarHBondContact O-N 3.1Å
582	L	94.3	Very high	95.1	Very high	19 Å²	19	56 Å²	56	10%	0.099	31%	0.31	C	S	.	.			trans	-59.2	119.7	-173.3	-73.4	168.8	0	0	0	113.9	V573 I578 M579 E586 I587 I591	V573-L582 HydrophobicContact CG2-CD1 4.12Å; I578-L582 WeakPolarHBondContact O-CG 3.46Å; I578-L582 PolarHBondContact O-N 3.37Å; M579-L582 HydrophobicContact SD-CD1 3.7Å; L582-E586 HydrophobicContact CD2-CB 3.93Å; L582-I587 HydrophobicContact CB-CD1 4.11Å; L582-I587 HydrophobicContact CB-CG1 3.83Å; L582-I587 HydrophobicContact CD1-CG1 4.26Å; L582-I591 HydrophobicContact CD1-CD1 3.65Å; L582-I591 HydrophobicContact CD2-CD1 4.42Å
583	S	95	Very high	95.2	Very high	44 Å²	44	52.2 Å²	52.2	31%	0.308	29%	0.29	S	S	.	.			trans	-73.4	162.1	167	75.4	0	0	0	0	112.2	A581 T585 E586 I587	A581-S583 PolarHBondContact O-N 3.1Å; S583-T585 PolarHBondContact O-N 2.99Å; S583-T585 VanDerWaalsContact O-N 3.11Å; S583-T585 PolarHBondContact OG-N 2.68Å; S583-T585 PolarHBondContact OG-OG1 3.49Å; S583-E586 WeakPolarHBondContact CA-OE2 3.42Å; S583-E586 WeakPolarHBondContact CB-OE2 3.5Å; S583-E586 PolarHBondContact N-OE2 3.29Å; S583-E586 PolarHBondContact O-N 3.02Å; S583-E586 PolarHBondContact OG-N 2.94Å; S583-E586 PolarHBondContact OG-OE2 3.01Å; S583-I587 VanDerWaalsContact O-CG1 3.29Å; S583-I587 WeakPolarHBondContact O-CG1 3.06Å; S583-I587 PolarHBondContact O-N 3.07Å
584	D	94.6	Very high	95.2	Very high	45 Å²	45	56.3 Å²	56.3	24%	0.241	32%	0.319	C	S	.	.	H	α-helix	trans	-55.9	-29.9	173.1	-161.2	80	0	0	0	112.3	Q588 R599 R603	D584-Q588 WeakPolarHBondContact O-CB 3.42Å; D584-Q588 PolarHBondContact O-N 2.97Å; D584-R599 WeakPolarHBondContact O-CD 3.41Å; D584-R599 PolarHBondContact O-NE 3.39Å; D584-R599 WeakPolarHBondContact OD1-CB 3.31Å; D584-R599 IonicContact OD1-NE 2.84Å; D584-R599 PolarHBondContact OD1-NE 2.93Å; D584-R599 IonicContact OD2-CZ 2.78Å; D584-R599 VanDerWaalsContact OD2-CZ 3.24Å; D584-R599 IonicContact OD2-NE 2.77Å; D584-R599 PolarHBondContact OD2-NE 3.14Å; D584-R599 IonicContact OD2-NH2 3.16Å; D584-R599 PolarHBondContact OD2-NH2 3.22Å; D584-R603 IonicContact OD1-CZ 3.49Å; D584-R603 IonicContact OD1-NE 3.24Å; D584-R603 PolarHBondContact OD1-NE 2.86Å; D584-R603 IonicContact OD1-NH2 2.88Å; D584-R603 PolarHBondContact OD1-NH2 2.55Å
585	T	95.5	Very high	95.2	Very high	66 Å²	66	52.2 Å²	52.2	41%	0.405	30%	0.303	S	S	.	.	H	α-helix	trans	-80.8	-27.7	-178.2	82.6	0	0	0	0	113.8	S583 R589	S583-T585 PolarHBondContact O-N 2.99Å; S583-T585 VanDerWaalsContact O-N 3.11Å; S583-T585 PolarHBondContact OG-N 2.68Å; S583-T585 PolarHBondContact OG-OG1 3.49Å; T585-R589 VanDerWaalsContact O-CB 3.26Å; T585-R589 WeakPolarHBondContact O-CB 3.44Å; T585-R589 WeakPolarHBondContact O-CG 3.31Å; T585-R589 PolarHBondContact O-N 3.42Å; T585-R589 PolarHBondContact O-NE 2.87Å; T585-R589 PolarHBondContact OG1-NH2 2.77Å
586	E	95.8	Very high	95.2	Very high	69 Å²	69	52.6 Å²	52.6	32%	0.322	31%	0.308	S	S	.	.	H	α-helix	trans	-78.6	-40	172	-70.3	146.7	134.9	0	0	109.8	L582 S583 Q588 R589 E590 I591	L582-E586 HydrophobicContact CD2-CB 3.93Å; S583-E586 WeakPolarHBondContact CA-OE2 3.42Å; S583-E586 WeakPolarHBondContact CB-OE2 3.5Å; S583-E586 PolarHBondContact N-OE2 3.29Å; S583-E586 PolarHBondContact O-N 3.02Å; S583-E586 PolarHBondContact OG-N 2.94Å; S583-E586 PolarHBondContact OG-OE2 3.01Å; E586-Q588 PolarHBondContact O-N 2.98Å; E586-R589 PolarHBondContact O-N 3.03Å; E586-E590 HydrophobicContact CB-CG 4.28Å; E586-E590 WeakPolarHBondContact O-CA 3.32Å; E586-E590 VanDerWaalsContact O-CB 3.31Å; E586-E590 WeakPolarHBondContact O-CB 3.42Å; E586-E590 PolarHBondContact O-N 2.77Å; E586-I591 PolarHBondContact O-N 3.1Å
587	I	95.6	Very high	95.2	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-59	-38	171.1	-61.1	168.4	0	0	0	110.7	L582 S583 G592 I593 R599 L602 R603	L582-I587 HydrophobicContact CB-CD1 4.11Å; L582-I587 HydrophobicContact CB-CG1 3.83Å; L582-I587 HydrophobicContact CD1-CG1 4.26Å; S583-I587 VanDerWaalsContact O-CG1 3.29Å; S583-I587 WeakPolarHBondContact O-CG1 3.06Å; S583-I587 PolarHBondContact O-N 3.07Å; I587-G592 PolarHBondContact O-N 3.36Å; I587-I593 HydrophobicContact CG2-CB 3.93Å; I587-I593 HydrophobicContact CG2-CD1 3.79Å; I587-I593 HydrophobicContact CG2-CG1 3.94Å; I587-I593 WeakPolarHBondContact O-CB 3.37Å; I587-I593 PolarHBondContact O-N 3.34Å; I587-R599 HydrophobicContact CB-CG 4.44Å; I587-R599 HydrophobicContact CG2-CB 4.14Å; I587-R599 HydrophobicContact CG2-CG 3.65Å; I587-L602 HydrophobicContact CD1-CD2 4.28Å; I587-L602 HydrophobicContact CG1-CD2 4.34Å; I587-L602 HydrophobicContact CG2-CD2 3.92Å; I587-R603 HydrophobicContact CD1-CG 3.64Å
588	Q	96.3	Very high	95.3	Very high	90 Å²	90	51.1 Å²	51.1	42%	0.421	29%	0.294	S	S	.	.	H	α-helix	trans	-72.9	-47.5	174.9	-172.3	171.7	-21.5	0	0	113.2	D584 E586 G592	D584-Q588 WeakPolarHBondContact O-CB 3.42Å; D584-Q588 PolarHBondContact O-N 2.97Å; E586-Q588 PolarHBondContact O-N 2.98Å; Q588-G592 CarbonylContact O-C 3.57Å; Q588-G592 VanDerWaalsContact O-CA 3.26Å; Q588-G592 WeakPolarHBondContact O-CA 3.41Å; Q588-G592 PolarHBondContact O-N 3.1Å
589	R	94.4	Very high	95.4	Very high	192 Å²	192	48.5 Å²	48.5	73%	0.725	28%	0.279	S	S	*	.	H	α-helix	trans	-88.8	-42.8	-170.4	-69.6	-178.4	-74.6	-179.9	-3.7	114.3	T585 E586	T585-R589 VanDerWaalsContact O-CB 3.26Å; T585-R589 WeakPolarHBondContact O-CB 3.44Å; T585-R589 WeakPolarHBondContact O-CG 3.31Å; T585-R589 PolarHBondContact O-N 3.42Å; T585-R589 PolarHBondContact O-NE 2.87Å; T585-R589 PolarHBondContact OG1-NH2 2.77Å; E586-R589 PolarHBondContact O-N 3.03Å
590	E	91.9	Very high	95.4	Very high	111 Å²	111	49.5 Å²	49.5	52%	0.519	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-46.2	-176.9	-53.8	-170.4	158.3	0	0	111.3	N572 E586	N572-E590 PolarHBondContact ND2-O 3.22Å; E586-E590 HydrophobicContact CB-CG 4.28Å; E586-E590 WeakPolarHBondContact O-CA 3.32Å; E586-E590 VanDerWaalsContact O-CB 3.31Å; E586-E590 WeakPolarHBondContact O-CB 3.42Å; E586-E590 PolarHBondContact O-N 2.77Å
591	I	92.9	Very high	95.5	Very high	8 Å²	8	47.3 Å²	47.3	4%	0.041	27%	0.269	C	S	.	.	S	Bend	trans	-84.6	-15.3	179.6	-50.7	-178.9	0	0	0	111.5	A568 V573 L582 E586 I593	A568-I591 HydrophobicContact CB-CG2 4.05Å; V573-I591 HydrophobicContact CG2-CD1 3.95Å; L582-I591 HydrophobicContact CD1-CD1 3.65Å; L582-I591 HydrophobicContact CD2-CD1 4.42Å; E586-I591 PolarHBondContact O-N 3.1Å; I591-I593 HydrophobicContact CB-CG1 4.08Å; I591-I593 HydrophobicContact CG2-CD1 3.86Å; I591-I593 HydrophobicContact CG2-CG1 3.73Å
592	G	93.3	Very high	95.7	Very high	48 Å²	48	43.7 Å²	43.7	50%	0.495	24%	0.239	S	C	.	.			trans	78.2	19.6	177	0	0	0	0	0	114.6	I587 Q588 S594	I587-G592 PolarHBondContact O-N 3.36Å; Q588-G592 CarbonylContact O-C 3.57Å; Q588-G592 VanDerWaalsContact O-CA 3.26Å; Q588-G592 WeakPolarHBondContact O-CA 3.41Å; Q588-G592 PolarHBondContact O-N 3.1Å; G592-S594 PolarHBondContact O-N 2.98Å
593	I	96	Very high	95.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.249	C	C	.	.			trans	-82.3	86.3	-176.4	-48	-160.8	0	0	0	110.4	Y565 I587 I591 H598 R599 L602	Y565-I593 HydrophobicContact CD1-CD1 3.84Å; Y565-I593 HydrophobicContact CD1-CG1 3.84Å; Y565-I593 HydrophobicContact CE1-CB 4.04Å; Y565-I593 HydrophobicContact CE1-CD1 3.92Å; Y565-I593 HydrophobicContact CE1-CG1 3.57Å; Y565-I593 HydrophobicContact CE1-CG2 3.94Å; Y565-I593 HydrophobicContact CG-CD1 4.35Å; I587-I593 HydrophobicContact CG2-CB 3.93Å; I587-I593 HydrophobicContact CG2-CD1 3.79Å; I587-I593 HydrophobicContact CG2-CG1 3.94Å; I587-I593 WeakPolarHBondContact O-CB 3.37Å; I587-I593 PolarHBondContact O-N 3.34Å; I591-I593 HydrophobicContact CB-CG1 4.08Å; I591-I593 HydrophobicContact CG2-CD1 3.86Å; I591-I593 HydrophobicContact CG2-CG1 3.73Å; I593-H598 HydrophobicContact CG2-CB 3.46Å; I593-H598 VanDerWaalsContact CG2-CB 3.46Å; I593-R599 HydrophobicContact CB-CG 3.85Å; I593-R599 HydrophobicContact CG2-CG 3.56Å; I593-R599 VanDerWaalsContact O-CD 3.25Å; I593-R599 WeakPolarHBondContact O-CD 3.33Å; I593-R599 WeakPolarHBondContact O-CG 3.44Å; I593-R599 PolarHBondContact O-NH1 3.2Å; I593-L602 HydrophobicContact CD1-CD2 4.02Å
594	S	95.3	Very high	95.8	Very high	93 Å²	93	45.6 Å²	45.6	65%	0.65	24%	0.239	S	C	*	.			trans	-65.1	-42.1	-179.1	56.9	0	0	0	0	114.2	G592 A596 R599	G592-S594 PolarHBondContact O-N 2.98Å; S594-A596 PolarHBondContact O-N 3.06Å; S594-R599 PolarHBondContact O-NH1 2.87Å
595	N	96.6	Very high	95.9	Very high	36 Å²	36	43.4 Å²	43.4	19%	0.193	23%	0.228	C	C	.	.	S	Bend	trans	-70	121.8	-179.8	-175.9	-16.4	0	0	0	111.5	L597 H598 R599	N595-L597 VanDerWaalsContact C-N 3.31Å; N595-L597 PolarHBondContact O-N 3.29Å; N595-L597 PolarHBondContact OD1-N 2.89Å; N595-H598 HydrophobicContact CB-CB 4.3Å; N595-H598 PolarHBondContact ND2-CE1 3.34Å; N595-H598 PolarHBondContact ND2-NE2 2.8Å; N595-H598 PolarHBondContact O-N 3.49Å; N595-H598 VanDerWaalsContact O-N 3.15Å; N595-R599 PolarHBondContact O-N 2.93Å
596	A	96.5	Very high	95.8	Very high	42 Å²	42	40.9 Å²	40.9	35%	0.347	21%	0.211	S	C	.	.	H	α-helix	trans	-60.7	-33.7	-179.3	0	0	0	0	0	113.7	S594 H598 R599 L600	S594-A596 PolarHBondContact O-N 3.06Å; A596-H598 VanDerWaalsContact C-N 3.35Å; A596-R599 PolarHBondContact O-N 3.3Å; A596-L600 WeakPolarHBondContact O-CB 3.5Å; A596-L600 PolarHBondContact O-N 3.46Å
597	L	97.8	Very high	95.7	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-70.8	-31.5	177.5	-69.2	-179.9	0	0	0	112.1	N595 R599 L600 K601 C676 M682 L686 D690 H694 L695	N595-L597 VanDerWaalsContact C-N 3.31Å; N595-L597 PolarHBondContact O-N 3.29Å; N595-L597 PolarHBondContact OD1-N 2.89Å; L597-R599 VanDerWaalsContact C-N 3.35Å; L597-L600 HydrophobicContact CD2-CD2 4.04Å; L597-L600 PolarHBondContact O-N 3.32Å; L597-K601 PolarHBondContact O-N 3.24Å; L597-C676 HydrophobicContact CB-CB 4.24Å; L597-C676 HydrophobicContact CD1-CB 3.71Å; L597-M682 HydrophobicContact CB-CE 4.01Å; L597-M682 HydrophobicContact CD2-CE 4.38Å; L597-M682 WeakPolarHBondContact O-CE 3.45Å; L597-L686 HydrophobicContact CD2-CD2 3.89Å; L597-D690 HydrophobicContact CD2-CB 4.17Å; L597-H694 HydrophobicContact CD1-CB 3.75Å; L597-L695 HydrophobicContact CD1-CD2 4.24Å; L597-L695 HydrophobicContact CD1-CG 4.31Å
598	H	98	Very high	95.5	Very high	11 Å²	11	45.1 Å²	45.1	5%	0.051	23%	0.231	C	C	.	.	H	α-helix	trans	-70.5	-34.2	174.6	-59.5	174.6	0	0	0	111.4	Y565 I593 N595 A596 K601 L602 E675 C676	Y565-H598 HydrophobicContact CE2-CB 4.05Å; Y565-H598 AromaticContact CE2-CG 3.91Å; Y565-H598 AromaticContact CE2-ND1 3.35Å; Y565-H598 VanDerWaalsContact CE2-ND1 3.35Å; Y565-H598 WeakPolarHBondContact CE2-ND1 3.39Å; Y565-H598 AromaticContact CZ-ND1 3.53Å; Y565-H598 PolarHBondContact OH-ND1 3.04Å; I593-H598 HydrophobicContact CG2-CB 3.46Å; I593-H598 VanDerWaalsContact CG2-CB 3.46Å; N595-H598 HydrophobicContact CB-CB 4.3Å; N595-H598 PolarHBondContact ND2-CE1 3.34Å; N595-H598 PolarHBondContact ND2-NE2 2.8Å; N595-H598 PolarHBondContact O-N 3.49Å; N595-H598 VanDerWaalsContact O-N 3.15Å; A596-H598 VanDerWaalsContact C-N 3.35Å; H598-K601 WeakPolarHBondContact O-CB 3.47Å; H598-L602 PolarHBondContact O-N 3.17Å; H598-E675 PolarHBondContact CE1-O 3.43Å; H598-E675 PolarHBondContact NE2-O 3.24Å; H598-C676 PolarHBondContact CD2-O 2.91Å; H598-C676 VanDerWaalsContact NE2-CA 3.33Å; H598-C676 WeakPolarHBondContact NE2-CA 3.45Å
599	R	97.5	Very high	95.3	Very high	19 Å²	19	41 Å²	41	7%	0.072	21%	0.212	C	C	.	.	H	α-helix	trans	-69.5	-40	171	-57.9	-155.1	-63.4	-84.6	7.9	112.4	D584 I587 I593 S594 N595 A596 L597 L602 R603	D584-R599 WeakPolarHBondContact O-CD 3.41Å; D584-R599 PolarHBondContact O-NE 3.39Å; D584-R599 WeakPolarHBondContact OD1-CB 3.31Å; D584-R599 IonicContact OD1-NE 2.84Å; D584-R599 PolarHBondContact OD1-NE 2.93Å; D584-R599 IonicContact OD2-CZ 2.78Å; D584-R599 VanDerWaalsContact OD2-CZ 3.24Å; D584-R599 IonicContact OD2-NE 2.77Å; D584-R599 PolarHBondContact OD2-NE 3.14Å; D584-R599 IonicContact OD2-NH2 3.16Å; D584-R599 PolarHBondContact OD2-NH2 3.22Å; I587-R599 HydrophobicContact CB-CG 4.44Å; I587-R599 HydrophobicContact CG2-CB 4.14Å; I587-R599 HydrophobicContact CG2-CG 3.65Å; I593-R599 HydrophobicContact CB-CG 3.85Å; I593-R599 HydrophobicContact CG2-CG 3.56Å; I593-R599 VanDerWaalsContact O-CD 3.25Å; I593-R599 WeakPolarHBondContact O-CD 3.33Å; I593-R599 WeakPolarHBondContact O-CG 3.44Å; I593-R599 PolarHBondContact O-NH1 3.2Å; S594-R599 PolarHBondContact O-NH1 2.87Å; N595-R599 PolarHBondContact O-N 2.93Å; A596-R599 PolarHBondContact O-N 3.3Å; L597-R599 VanDerWaalsContact C-N 3.35Å; R599-L602 PolarHBondContact O-N 2.92Å; R599-R603 WeakPolarHBondContact O-CB 3.32Å; R599-R603 WeakPolarHBondContact O-CG 3.2Å; R599-R603 PolarHBondContact O-N 2.78Å
600	L	97.4	Very high	95.2	Very high	21 Å²	21	34.8 Å²	34.8	11%	0.11	20%	0.195	C	C	.	.	H	α-helix	trans	-59	-47.6	173.9	-179.2	63.2	0	0	0	111.2	A596 L597 L602 R603 L604 H685	A596-L600 WeakPolarHBondContact O-CB 3.5Å; A596-L600 PolarHBondContact O-N 3.46Å; L597-L600 HydrophobicContact CD2-CD2 4.04Å; L597-L600 PolarHBondContact O-N 3.32Å; L600-L602 PolarHBondContact O-N 2.97Å; L600-R603 PolarHBondContact O-N 2.87Å; L600-L604 HydrophobicContact CD1-CD1 3.87Å; L600-L604 HydrophobicContact CD1-CG 4.01Å; L600-L604 HydrophobicContact CG-CD1 3.9Å; L600-L604 HydrophobicContact CG-CG 4.4Å; L600-L604 WeakPolarHBondContact O-CB 3.5Å; L600-L604 WeakPolarHBondContact O-CG 3.35Å; L600-L604 PolarHBondContact O-N 3.32Å; L600-H685 HydrophobicContact CD1-CB 4.29Å; L600-H685 HydrophobicContact CD2-CB 4.13Å
601	K	97.2	Very high	95	Very high	1 Å²	1	33 Å²	33	0%	0.004	20%	0.195	C	C	.	.	H	α-helix	trans	-51	-54.3	174.1	-172.1	-177.6	-177.8	65.7	0	112	V559 M561 L597 H598 L604 A605 L677 D679 M682	V559-K601 HydrophobicContact CG1-CG 4.44Å; V559-K601 WeakPolarHBondContact O-CE 3Å; V559-K601 PolarHBondContact O-NZ 2.77Å; M561-K601 HydrophobicContact SD-CD 3.72Å; M561-K601 HydrophobicContact SD-CG 4.42Å; L597-K601 PolarHBondContact O-N 3.24Å; H598-K601 WeakPolarHBondContact O-CB 3.47Å; K601-L604 PolarHBondContact O-N 2.72Å; K601-A605 WeakPolarHBondContact O-CB 3.37Å; K601-A605 PolarHBondContact O-N 3.22Å; K601-L677 HydrophobicContact CD-CB 3.64Å; K601-L677 HydrophobicContact CD-CD1 4.4Å; K601-L677 WeakPolarHBondContact CD-O 3.4Å; K601-L677 WeakPolarHBondContact CE-O 3.26Å; K601-L677 PolarHBondContact NZ-O 2.68Å; K601-D679 IonicContact NZ-OD2 2.63Å; K601-D679 PolarHBondContact NZ-OD2 2.87Å; K601-M682 HydrophobicContact CB-CE 4.19Å; K601-M682 HydrophobicContact CB-CG 4.37Å; K601-M682 HydrophobicContact CB-SD 3.45Å; K601-M682 WeakPolarHBondContact CB-SD 3.37Å; K601-M682 HydrophobicContact CD-SD 4.31Å; K601-M682 HydrophobicContact CG-SD 3.72Å
602	L	97.1	Very high	94.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-46.8	-177	-178.5	55.9	0	0	0	111.2	L555 M579 I587 I593 H598 R599 L600 L604 A605 I606	L555-L602 HydrophobicContact CD2-CD1 3.61Å; M579-L602 HydrophobicContact SD-CD1 4.22Å; I587-L602 HydrophobicContact CD1-CD2 4.28Å; I587-L602 HydrophobicContact CG1-CD2 4.34Å; I587-L602 HydrophobicContact CG2-CD2 3.92Å; I593-L602 HydrophobicContact CD1-CD2 4.02Å; H598-L602 PolarHBondContact O-N 3.17Å; R599-L602 PolarHBondContact O-N 2.92Å; L600-L602 PolarHBondContact O-N 2.97Å; L602-L604 PolarHBondContact O-N 3.29Å; L602-A605 PolarHBondContact O-N 3.05Å; L602-I606 HydrophobicContact CD1-CD1 3.92Å; L602-I606 HydrophobicContact CD1-CG1 4.2Å; L602-I606 HydrophobicContact CG-CD1 3.78Å; L602-I606 WeakPolarHBondContact O-CD1 3.49Å; L602-I606 WeakPolarHBondContact O-CG1 3.46Å; L602-I606 PolarHBondContact O-N 3.35Å
603	R	96.8	Very high	94.4	Very high	86 Å²	86	31.8 Å²	31.8	33%	0.325	18%	0.178	S	C	.	.	H	α-helix	trans	-61.9	-42.2	178.2	-75.7	-169.5	-76.4	93.8	-5.1	113.2	D584 I587 R599 L600 I606 Q607	D584-R603 IonicContact OD1-CZ 3.49Å; D584-R603 IonicContact OD1-NE 3.24Å; D584-R603 PolarHBondContact OD1-NE 2.86Å; D584-R603 IonicContact OD1-NH2 2.88Å; D584-R603 PolarHBondContact OD1-NH2 2.55Å; I587-R603 HydrophobicContact CD1-CG 3.64Å; R599-R603 WeakPolarHBondContact O-CB 3.32Å; R599-R603 WeakPolarHBondContact O-CG 3.2Å; R599-R603 PolarHBondContact O-N 2.78Å; L600-R603 PolarHBondContact O-N 2.87Å; R603-I606 PolarHBondContact O-N 2.96Å; R603-Q607 WeakPolarHBondContact O-CB 3.42Å; R603-Q607 PolarHBondContact O-N 3.14Å
604	L	95.6	Very high	93.8	Very high	17 Å²	17	33.7 Å²	33.7	9%	0.089	19%	0.191	C	C	.	.	H	α-helix	trans	-66.3	-41.8	177.4	-69.2	175	0	0	0	111.7	L600 K601 L602 Q607 E608 M682 H685	L600-L604 HydrophobicContact CD1-CD1 3.87Å; L600-L604 HydrophobicContact CD1-CG 4.01Å; L600-L604 HydrophobicContact CG-CD1 3.9Å; L600-L604 HydrophobicContact CG-CG 4.4Å; L600-L604 WeakPolarHBondContact O-CB 3.5Å; L600-L604 WeakPolarHBondContact O-CG 3.35Å; L600-L604 PolarHBondContact O-N 3.32Å; K601-L604 PolarHBondContact O-N 2.72Å; L602-L604 PolarHBondContact O-N 3.29Å; L604-Q607 PolarHBondContact O-N 3.29Å; L604-E608 WeakPolarHBondContact O-CB 3.37Å; L604-E608 PolarHBondContact O-N 3.43Å; L604-M682 HydrophobicContact CD1-CB 4.45Å; L604-M682 HydrophobicContact CD1-CG 4.07Å; L604-H685 HydrophobicContact CD1-CB 4.11Å
605	A	95.5	Very high	92.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.5	-40.1	175.8	0	0	0	0	0	112.3	W554 V559 K601 L602 M609	W554-A605 HydrophobicContact CH2-CB 4.09Å; W554-A605 HydrophobicContact CZ2-CB 3.87Å; W554-A605 WeakPolarHBondContact CZ2-O 3.24Å; V559-A605 HydrophobicContact CB-CB 4.48Å; V559-A605 HydrophobicContact CG1-CB 3.79Å; V559-A605 HydrophobicContact CG2-CB 3.88Å; K601-A605 WeakPolarHBondContact O-CB 3.37Å; K601-A605 PolarHBondContact O-N 3.22Å; L602-A605 PolarHBondContact O-N 3.05Å; A605-M609 WeakPolarHBondContact O-CB 3.49Å; A605-M609 PolarHBondContact O-N 3.39Å
606	I	95.1	Very high	91.4	Very high	12 Å²	12	37.5 Å²	37.5	6%	0.062	22%	0.218	C	C	.	.	H	α-helix	trans	-61.1	-51.5	172.8	-68.4	161.1	0	0	0	110.2	F543 W554 M579 L602 R603 E608 M609 V610	F543-I606 HydrophobicContact CE1-CG2 4.3Å; W554-I606 HydrophobicContact CH2-CG1 3.92Å; W554-I606 HydrophobicContact CZ3-CG1 4.45Å; M579-I606 HydrophobicContact CG-CD1 4.17Å; M579-I606 HydrophobicContact CG-CG1 4.06Å; M579-I606 WeakPolarHBondContact O-CD1 3.39Å; M579-I606 HydrophobicContact SD-CD1 3.92Å; M579-I606 HydrophobicContact SD-CG1 4.32Å; L602-I606 HydrophobicContact CD1-CD1 3.92Å; L602-I606 HydrophobicContact CD1-CG1 4.2Å; L602-I606 HydrophobicContact CG-CD1 3.78Å; L602-I606 WeakPolarHBondContact O-CD1 3.49Å; L602-I606 WeakPolarHBondContact O-CG1 3.46Å; L602-I606 PolarHBondContact O-N 3.35Å; R603-I606 PolarHBondContact O-N 2.96Å; I606-E608 VanDerWaalsContact C-N 3.33Å; I606-E608 PolarHBondContact O-N 3.39Å; I606-M609 PolarHBondContact O-N 3Å; I606-V610 HydrophobicContact CG2-CG2 4.18Å; I606-V610 WeakPolarHBondContact O-CB 3.46Å; I606-V610 VanDerWaalsContact O-CG2 3.3Å; I606-V610 WeakPolarHBondContact O-CG2 3.23Å; I606-V610 PolarHBondContact O-N 2.91Å
607	Q	92.9	Very high	89.8	Confident	124 Å²	124	36 Å²	36	58%	0.579	21%	0.206	S	C	*	.	H	α-helix	trans	-59.4	-43.2	-178.6	-178.3	-179.8	-10.2	0	0	112	R603 L604 S611	R603-Q607 WeakPolarHBondContact O-CB 3.42Å; R603-Q607 PolarHBondContact O-N 3.14Å; L604-Q607 PolarHBondContact O-N 3.29Å; Q607-S611 WeakPolarHBondContact O-CB 3.36Å; Q607-S611 PolarHBondContact O-N 3.44Å; Q607-S611 VanDerWaalsContact O-N 3.08Å; Q607-S611 PolarHBondContact O-OG 3.34Å
608	E	91.4	Very high	87.7	Confident	35 Å²	35	38.8 Å²	38.8	16%	0.164	22%	0.224	C	C	.	.	H	α-helix	trans	-60.8	-51	174	-178.8	-176.8	-133.4	0	0	111.4	L604 I606 S611 L612 L646 A647 R681	L604-E608 WeakPolarHBondContact O-CB 3.37Å; L604-E608 PolarHBondContact O-N 3.43Å; I606-E608 VanDerWaalsContact C-N 3.33Å; I606-E608 PolarHBondContact O-N 3.39Å; E608-S611 WeakPolarHBondContact O-CB 3.31Å; E608-S611 PolarHBondContact O-N 2.92Å; E608-L612 HydrophobicContact CG-CD1 4.49Å; E608-L612 WeakPolarHBondContact O-CB 3.33Å; E608-L612 PolarHBondContact O-N 3.39Å; E608-L646 WeakPolarHBondContact OE1-CB 3.38Å; E608-A647 HydrophobicContact CG-CB 4.05Å; E608-A647 PolarHBondContact OE1-N 3.38Å; E608-A647 VanDerWaalsContact OE2-CA 3.25Å; E608-A647 WeakPolarHBondContact OE2-CA 3.39Å; E608-R681 WeakPolarHBondContact OE2-CD 3.45Å; E608-R681 IonicContact OE2-CZ 2.66Å; E608-R681 IonicContact OE2-NE 3.85Å; E608-R681 IonicContact OE2-NH1 3.2Å; E608-R681 PolarHBondContact OE2-NH1 2.86Å
609	M	91.5	Very high	85.3	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.015	25%	0.251	C	S	.	.	H	α-helix	trans	-69	-36.1	-175.9	-168.5	52.4	56.2	0	0	113.1	F543 W546 W554 W558 A605 I606 L612 T613 A647	F543-M609 HydrophobicContact CB-CG 4.24Å; F543-M609 HydrophobicContact CD2-CB 4.15Å; F543-M609 HydrophobicContact CD2-CG 3.35Å; F543-M609 HydrophobicContact CE2-CB 4.37Å; F543-M609 HydrophobicContact CE2-CG 3.8Å; F543-M609 HydrophobicContact CG-CB 4.42Å; F543-M609 HydrophobicContact CG-CG 3.92Å; W546-M609 HydrophobicContact CH2-CG 3.99Å; W546-M609 HydrophobicContact CH2-SD 3.65Å; W546-M609 HydrophobicContact CZ2-CG 4.46Å; W546-M609 HydrophobicContact CZ2-SD 4.04Å; W546-M609 HydrophobicContact CZ3-CG 4.37Å; W554-M609 HydrophobicContact CZ2-CB 4Å; W554-M609 HydrophobicContact CZ2-CG 4.44Å; W558-M609 HydrophobicContact CE3-CE 3.78Å; W558-M609 HydrophobicContact CZ3-CE 3.9Å; W558-M609 HydrophobicContact CZ3-SD 4.5Å; A605-M609 WeakPolarHBondContact O-CB 3.49Å; A605-M609 PolarHBondContact O-N 3.39Å; I606-M609 PolarHBondContact O-N 3Å; M609-L612 HydrophobicContact CE-CD1 4.1Å; M609-L612 HydrophobicContact SD-CD1 4.49Å; M609-T613 HydrophobicContact CG-CG2 4.39Å; M609-T613 WeakPolarHBondContact O-CB 3.27Å; M609-T613 WeakPolarHBondContact O-CG2 3.3Å; M609-T613 PolarHBondContact O-N 3.36Å; M609-T613 PolarHBondContact O-OG1 3.47Å; M609-T613 HydrophobicContact SD-CG2 3.64Å; M609-A647 HydrophobicContact CE-CB 4.06Å
610	V	92.2	Very high	83	Confident	61 Å²	61	44.9 Å²	44.9	37%	0.37	27%	0.266	S	S	.	.	H	α-helix	trans	-63.1	-41.9	171.1	169.7	0	0	0	0	111	F543 I606 S614	F543-V610 HydrophobicContact CB-CG2 4.26Å; F543-V610 HydrophobicContact CD1-CG2 3.65Å; F543-V610 HydrophobicContact CE1-CG2 4.43Å; F543-V610 HydrophobicContact CG-CG2 4.33Å; I606-V610 HydrophobicContact CG2-CG2 4.18Å; I606-V610 WeakPolarHBondContact O-CB 3.46Å; I606-V610 VanDerWaalsContact O-CG2 3.3Å; I606-V610 WeakPolarHBondContact O-CG2 3.23Å; I606-V610 PolarHBondContact O-N 2.91Å; V610-S614 PolarHBondContact O-N 3.45Å
611	S	89.3	Confident	80.6	Confident	74 Å²	74	45.1 Å²	45.1	52%	0.517	27%	0.269	S	S	.	.	H	α-helix	trans	-66.3	-44.4	177.8	-56.5	0	0	0	0	111.7	Q607 E608 S614	Q607-S611 WeakPolarHBondContact O-CB 3.36Å; Q607-S611 PolarHBondContact O-N 3.44Å; Q607-S611 VanDerWaalsContact O-N 3.08Å; Q607-S611 PolarHBondContact O-OG 3.34Å; E608-S611 WeakPolarHBondContact O-CB 3.31Å; E608-S611 PolarHBondContact O-N 2.92Å; S611-S614 WeakPolarHBondContact O-CB 3.42Å
612	L	85.4	Confident	78.4	Confident	12 Å²	12	48.4 Å²	48.4	6%	0.063	28%	0.282	C	S	.	.	H	α-helix	trans	-61.2	-43.5	179.6	-108.8	175.1	0	0	0	113.9	E608 M609 A617 T644 A647	E608-L612 HydrophobicContact CG-CD1 4.49Å; E608-L612 WeakPolarHBondContact O-CB 3.33Å; E608-L612 PolarHBondContact O-N 3.39Å; M609-L612 HydrophobicContact CE-CD1 4.1Å; M609-L612 HydrophobicContact SD-CD1 4.49Å; L612-A617 WeakPolarHBondContact O-CB 3.35Å; L612-T644 HydrophobicContact CD1-CG2 3.72Å; L612-T644 HydrophobicContact CD2-CG2 3.59Å; L612-T644 HydrophobicContact CG-CG2 3.5Å; L612-A647 HydrophobicContact CD1-CB 3.24Å
613	T	88.3	Confident	75.8	Confident	19 Å²	19	52 Å²	52	12%	0.117	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	3.2	-172.7	62.5	0	0	0	0	112.6	P542 F543 W546 M609	P542-T613 WeakPolarHBondContact CA-O 3.43Å; P542-T613 WeakPolarHBondContact CB-O 3.24Å; F543-T613 WeakPolarHBondContact CB-OG1 3.42Å; F543-T613 PolarHBondContact N-OG1 3.02Å; W546-T613 HydrophobicContact CZ2-CG2 4.04Å; M609-T613 HydrophobicContact CG-CG2 4.39Å; M609-T613 WeakPolarHBondContact O-CB 3.27Å; M609-T613 WeakPolarHBondContact O-CG2 3.3Å; M609-T613 PolarHBondContact O-N 3.36Å; M609-T613 PolarHBondContact O-OG1 3.47Å; M609-T613 HydrophobicContact SD-CG2 3.64Å
614	S	83.4	Confident	73.1	Confident	40 Å²	40	53 Å²	53	28%	0.28	32%	0.324	S	S	.	.			trans	-55.6	137.7	174	179	0	0	0	0	111.3	V610 S611 S616 A617	V610-S614 PolarHBondContact O-N 3.45Å; S611-S614 WeakPolarHBondContact O-CB 3.42Å; S614-S616 PolarHBondContact O-N 2.79Å; S614-S616 PolarHBondContact OG-N 2.82Å; S614-A617 WeakPolarHBondContact O-CB 3.49Å; S614-A617 PolarHBondContact O-N 3.14Å
615	P	74.1	Confident	70.4	Confident	95 Å²	95	56.6 Å²	56.6	62%	0.617	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-27.2	173.9	-27.4	36	0	0	0	113.9	R622	P615-R622 PolarHBondContact O-NH2 3.44Å
616	S	67.3	Low	67.8	Low	113 Å²	113	59.8 Å²	59.8	79%	0.79	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-5.8	179.1	-50.8	0	0	0	0	114.8	S614	S614-S616 PolarHBondContact O-N 2.79Å; S614-S616 PolarHBondContact OG-N 2.82Å
617	A	61.5	Low	65.1	Low	12 Å²	12	67 Å²	67	10%	0.099	42%	0.423	C	S	.	.	S	Bend	trans	-68.4	145.7	177.5	0	0	0	0	0	111.2	L612 S614 R622	L612-A617 WeakPolarHBondContact O-CB 3.35Å; S614-A617 WeakPolarHBondContact O-CB 3.49Å; S614-A617 PolarHBondContact O-N 3.14Å; A617-R622 PolarHBondContact O-NE 3.42Å; A617-R622 PolarHBondContact O-NH2 3.09Å
618	P	55.1	Low	62.5	Low	59 Å²	59	66 Å²	66	38%	0.383	43%	0.425	S	S	.	.			trans	-53	144.6	176.7	-28	36.3	0	0	0	112.8	T620 S621	P618-T620 WeakPolarHBondContact CB-OG1 3.41Å; P618-T620 PolarHBondContact O-N 2.93Å; P618-S621 WeakPolarHBondContact O-CB 2.87Å; P618-S621 PolarHBondContact O-N 3.1Å; P618-S621 VanDerWaalsContact O-N 3.07Å
619	P	47	Very low	60.3	Low	96 Å²	96	76.8 Å²	76.8	62%	0.623	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-56.8	-34.2	176.6	-26.4	35.4	0	0	0	113	S621 R622 T623	P619-S621 VanDerWaalsContact C-N 3.27Å; P619-S621 PolarHBondContact O-N 3.49Å; P619-R622 PolarHBondContact O-N 3.03Å; P619-T623 PolarHBondContact O-N 3Å
620	T	49.1	Very low	58	Low	62 Å²	62	79.8 Å²	79.8	38%	0.38	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-59.1	-31.8	176.2	47.2	0	0	0	0	113.5	P618 R622 L638	P618-T620 WeakPolarHBondContact CB-OG1 3.41Å; P618-T620 PolarHBondContact O-N 2.93Å; T620-R622 PolarHBondContact O-N 3.03Å; T620-L638 HydrophobicContact CG2-CD2 4.05Å
621	S	47.3	Very low	55.9	Low	26 Å²	26	80.7 Å²	80.7	18%	0.182	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-70.9	-16.5	175	-53	0	0	0	0	113.4	P618 P619	P618-S621 WeakPolarHBondContact O-CB 2.87Å; P618-S621 PolarHBondContact O-N 3.1Å; P618-S621 VanDerWaalsContact O-N 3.07Å; P619-S621 VanDerWaalsContact C-N 3.27Å; P619-S621 PolarHBondContact O-N 3.49Å
622	R	51.8	Low	53.7	Low	70 Å²	70	84 Å²	84	26%	0.264	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-16.1	-172.7	-62.4	-172.1	-108.8	-174.2	-3.8	113.9	P615 A617 P619 T620	P615-R622 PolarHBondContact O-NH2 3.44Å; A617-R622 PolarHBondContact O-NE 3.42Å; A617-R622 PolarHBondContact O-NH2 3.09Å; P619-R622 PolarHBondContact O-N 3.03Å; T620-R622 PolarHBondContact O-N 3.03Å
623	T	42.5	Very low	51.6	Low	75 Å²	75	91.4 Å²	91.4	46%	0.46	53%	0.529	S	S	.	.			trans	-136.8	111.4	-178.7	53.4	0	0	0	0	113.3	P619 S625	P619-T623 PolarHBondContact O-N 3Å; T623-S625 VanDerWaalsContact C-N 3.25Å; T623-S625 PolarHBondContact O-N 3.41Å
624	S	39.4	Very low	49.5	Very low	108 Å²	108	94.8 Å²	94.8	76%	0.755	54%	0.544	S	S	*	.	S	Bend	trans	-73.7	-11.9	171	176.9	0	0	0	0	113.9	G626	S624-G626 PolarHBondContact O-N 3.4Å
625	S	37.7	Very low	47.5	Very low	92 Å²	92	98.4 Å²	98.4	64%	0.643	56%	0.558	S	S	*	*	S	Bend	trans	-86.2	106.5	175.6	53.3	0	0	0	0	109.7	T623 N627	T623-S625 VanDerWaalsContact C-N 3.25Å; T623-S625 PolarHBondContact O-N 3.41Å; S625-N627 PolarHBondContact O-N 3.22Å
626	G	41.5	Very low	46.1	Very low	68 Å²	68	100.9 Å²	100.9	70%	0.701	56%	0.561	S	S	*	*			trans	-62.5	132.4	178.3	0	0	0	0	0	112.6	S624	S624-G626 PolarHBondContact O-N 3.4Å
627	N	39.4	Very low	44.5	Very low	164 Å²	164	100 Å²	100	88%	0.877	55%	0.552	S	S	*	*			trans	179	71.1	151.2	-94.1	-11.2	0	0	0	109.1	S625	S625-N627 PolarHBondContact O-N 3.22Å
628	V	38.5	Very low	43.5	Very low	103 Å²	103	102.2 Å²	102.2	62%	0.624	56%	0.561	S	S	*	*			trans	-130.7	126.2	166.4	-178.4	0	0	0	0	107	V630	V628-V630 HydrophobicContact CB-CG2 4.35Å; V628-V630 HydrophobicContact CG1-CG2 3.91Å; V628-V630 PolarHBondContact O-N 2.91Å; V628-V630 VanDerWaalsContact O-N 3.15Å
629	W	43.7	Very low	42.6	Very low	261 Å²	261	102.6 Å²	102.6	99%	0.989	57%	0.569	S	S	*	*			trans	-78.3	95.9	173.6	-64.1	95.8	0	0	0	108.5
630	V	43.4	Very low	42.1	Very low	65 Å²	65	103.7 Å²	103.7	39%	0.394	57%	0.574	S	S	.	*			trans	-93.7	142.2	175.3	177.3	0	0	0	0	108.5	V628 E634	V628-V630 HydrophobicContact CB-CG2 4.35Å; V628-V630 HydrophobicContact CG1-CG2 3.91Å; V628-V630 PolarHBondContact O-N 2.91Å; V628-V630 VanDerWaalsContact O-N 3.15Å; V630-E634 HydrophobicContact CG1-CB 3.44Å; V630-E634 VanDerWaalsContact CG1-CB 3.44Å; V630-E634 HydrophobicContact CG1-CG 4.42Å
631	T	47.9	Very low	41.4	Very low	81 Å²	81	104.2 Å²	104.2	50%	0.497	58%	0.581	S	S	.	*			trans	-76.4	159.5	-177.1	66.3	0	0	0	0	112.2	E633 E634 M635	T631-E633 PolarHBondContact O-N 2.79Å; T631-E633 VanDerWaalsContact O-N 3.16Å; T631-E634 WeakPolarHBondContact CB-OE2 3.41Å; T631-E634 PolarHBondContact N-OE2 3.17Å; T631-E634 PolarHBondContact O-N 3.39Å; T631-E634 WeakPolarHBondContact OG1-CG 3.48Å; T631-E634 PolarHBondContact OG1-OE2 3.35Å; T631-M635 PolarHBondContact O-N 2.71Å; T631-M635 VanDerWaalsContact O-N 3.12Å
632	H	43.4	Very low	40.9	Very low	144 Å²	144	107.6 Å²	107.6	67%	0.667	60%	0.6	S	S	*	*	H	α-helix	trans	-64.8	-21	-174.4	-158.8	-55	0	0	0	113.4
633	E	42.1	Very low	40.7	Very low	166 Å²	166	111.3 Å²	111.3	78%	0.776	62%	0.618	S	S	*	*	H	α-helix	trans	-84.7	-32.5	178.6	-167.9	166.5	-159.1	0	0	112	T631 T637	T631-E633 PolarHBondContact O-N 2.79Å; T631-E633 VanDerWaalsContact O-N 3.16Å; E633-T637 PolarHBondContact O-OG1 3.04Å
634	E	43.5	Very low	41.1	Very low	90 Å²	90	109.9 Å²	109.9	42%	0.421	61%	0.609	S	S	.	*	H	α-helix	trans	-73.2	-28.4	171.3	-68.3	169	116.3	0	0	112.2	V630 T631 E636 T637 L638	V630-E634 HydrophobicContact CG1-CB 3.44Å; V630-E634 VanDerWaalsContact CG1-CB 3.44Å; V630-E634 HydrophobicContact CG1-CG 4.42Å; T631-E634 WeakPolarHBondContact CB-OE2 3.41Å; T631-E634 PolarHBondContact N-OE2 3.17Å; T631-E634 PolarHBondContact O-N 3.39Å; T631-E634 WeakPolarHBondContact OG1-CG 3.48Å; T631-E634 PolarHBondContact OG1-OE2 3.35Å; E634-E636 PolarHBondContact O-N 3.36Å; E634-T637 WeakPolarHBondContact CA-OG1 3.24Å; E634-T637 PolarHBondContact O-N 3.03Å; E634-T637 PolarHBondContact O-OG1 3.32Å; E634-T637 VanDerWaalsContact O-OG1 3.12Å; E634-L638 HydrophobicContact CB-CD1 4.27Å; E634-L638 WeakPolarHBondContact O-CB 3.44Å; E634-L638 WeakPolarHBondContact O-CD1 3.26Å; E634-L638 PolarHBondContact O-N 3.49Å
635	M	42.4	Very low	42	Very low	117 Å²	117	106.5 Å²	106.5	58%	0.576	58%	0.584	S	S	*	*	H	α-helix	trans	-64.7	-39.9	-176.8	-166.9	176.2	73	0	0	113	T631 A639	T631-M635 PolarHBondContact O-N 2.71Å; T631-M635 VanDerWaalsContact O-N 3.12Å; M635-A639 PolarHBondContact O-N 3.45Å
636	E	42.6	Very low	43.7	Very low	147 Å²	147	103.1 Å²	103.1	69%	0.687	56%	0.559	S	S	*	*	H	α-helix	trans	-74.5	-29.8	178.5	-64.4	-167.4	146.5	0	0	112.4	E634	E634-E636 PolarHBondContact O-N 3.36Å
637	T	34	Very low	45	Very low	95 Å²	95	99.9 Å²	99.9	58%	0.583	53%	0.526	S	S	*	.	H	α-helix	trans	-79.9	-33.2	176.4	47.6	0	0	0	0	112.7	E633 E634 A639 T640	E633-T637 PolarHBondContact O-OG1 3.04Å; E634-T637 WeakPolarHBondContact CA-OG1 3.24Å; E634-T637 PolarHBondContact O-N 3.03Å; E634-T637 PolarHBondContact O-OG1 3.32Å; E634-T637 VanDerWaalsContact O-OG1 3.12Å; T637-A639 VanDerWaalsContact C-N 3.3Å; T637-A639 PolarHBondContact O-N 2.88Å; T637-T640 PolarHBondContact O-OG1 3.48Å
638	L	40.9	Very low	46.8	Very low	57 Å²	57	94.5 Å²	94.5	30%	0.298	49%	0.493	S	S	.	.	H	α-helix	trans	-70.5	-20.9	171.9	-93.5	83.5	0	0	0	113.9	T620 E634 T640 S641	T620-L638 HydrophobicContact CG2-CD2 4.05Å; E634-L638 HydrophobicContact CB-CD1 4.27Å; E634-L638 WeakPolarHBondContact O-CB 3.44Å; E634-L638 WeakPolarHBondContact O-CD1 3.26Å; E634-L638 PolarHBondContact O-N 3.49Å; L638-T640 PolarHBondContact O-N 3.04Å; L638-S641 PolarHBondContact O-N 3.47Å
639	A	36.9	Very low	48.7	Very low	67 Å²	67	90.3 Å²	90.3	55%	0.554	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-15.5	-178.7	0	0	0	0	0	114.5	M635 T637	M635-A639 PolarHBondContact O-N 3.45Å; T637-A639 VanDerWaalsContact C-N 3.3Å; T637-A639 PolarHBondContact O-N 2.88Å
640	T	35.9	Very low	50.6	Low	119 Å²	119	80.7 Å²	80.7	73%	0.73	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	1	174.1	56.4	0	0	0	0	114.4	T637 L638	T637-T640 PolarHBondContact O-OG1 3.48Å; L638-T640 PolarHBondContact O-N 3.04Å
641	S	33.8	Very low	52.8	Low	74 Å²	74	77.9 Å²	77.9	52%	0.517	42%	0.422	S	S	.	.			trans	-128.7	34.5	-169.5	-159.4	0	0	0	0	114.2	L638	L638-S641 PolarHBondContact O-N 3.47Å
642	T	37	Very low	55.1	Low	97 Å²	97	75.3 Å²	75.3	60%	0.595	41%	0.405	S	S	*	.			trans	-118	35.5	178.1	47.2	0	0	0	0	113.8	T644	T642-T644 PolarHBondContact O-N 3Å
643	K	48.9	Very low	57.6	Low	147 Å²	147	69.5 Å²	69.5	64%	0.639	38%	0.378	S	S	*	.			trans	-68.1	114.8	167.5	-72.2	179.6	179.3	174.6	0	110.5
644	T	51	Low	60.2	Low	45 Å²	45	66.2 Å²	66.2	28%	0.276	36%	0.363	S	S	.	.			trans	177.9	73.6	140.4	40.9	0	0	0	0	111.6	L612 T642 Y648	L612-T644 HydrophobicContact CD1-CG2 3.72Å; L612-T644 HydrophobicContact CD2-CG2 3.59Å; L612-T644 HydrophobicContact CG-CG2 3.5Å; T642-T644 PolarHBondContact O-N 3Å; T644-Y648 WeakPolarHBondContact O-CE2 3.38Å
645	T	58.3	Low	62.7	Low	37 Å²	37	62.5 Å²	62.5	23%	0.227	35%	0.345	C	S	.	.	S	Bend	trans	-85.2	-42.6	164.4	44.5	0	0	0	0	111.3	A647 Y648 Y718	T645-A647 VanDerWaalsContact C-N 3.29Å; T645-A647 PolarHBondContact O-N 2.9Å; T645-Y648 PolarHBondContact O-N 3.01Å; T645-Y718 PolarHBondContact OG1-O 2.87Å
646	L	73.5	Confident	65.4	Low	21 Å²	21	56.9 Å²	56.9	11%	0.11	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-60	-31.3	-171	-62.4	-175	0	0	0	115.1	E608 Y648 G649 M651 A680 R681 Y718	E608-L646 WeakPolarHBondContact OE1-CB 3.38Å; L646-Y648 PolarHBondContact O-N 2.8Å; L646-Y648 VanDerWaalsContact O-N 3.1Å; L646-G649 PolarHBondContact O-N 3.33Å; L646-M651 HydrophobicContact CD2-CB 3.81Å; L646-M651 HydrophobicContact CD2-CE 4.42Å; L646-M651 HydrophobicContact CD2-CG 4.16Å; L646-M651 HydrophobicContact CD2-SD 3.5Å; L646-M651 VanDerWaalsContact CD2-SD 3.5Å; L646-A680 HydrophobicContact CD1-CB 4.39Å; L646-A680 HydrophobicContact CD2-CB 3.62Å; L646-R681 HydrophobicContact CB-CG 3.73Å; L646-R681 HydrophobicContact CD1-CG 3.64Å; L646-R681 HydrophobicContact CG-CG 4.27Å; L646-R681 PolarHBondContact O-NH1 3.34Å; L646-Y718 HydrophobicContact CD1-CD1 3.97Å; L646-Y718 HydrophobicContact CD1-CD2 4.4Å; L646-Y718 HydrophobicContact CD1-CG 3.89Å; L646-Y718 HydrophobicContact CD2-CD1 4.28Å; L646-Y718 HydrophobicContact CD2-CG 4.38Å; L646-Y718 HydrophobicContact CG-CG 4.39Å
647	A	68.2	Low	68	Low	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-62.2	-17.9	-175.8	0	0	0	0	0	115.6	E608 M609 L612 T645	E608-A647 HydrophobicContact CG-CB 4.05Å; E608-A647 PolarHBondContact OE1-N 3.38Å; E608-A647 VanDerWaalsContact OE2-CA 3.25Å; E608-A647 WeakPolarHBondContact OE2-CA 3.39Å; M609-A647 HydrophobicContact CE-CB 4.06Å; L612-A647 HydrophobicContact CD1-CB 3.24Å; T645-A647 VanDerWaalsContact C-N 3.29Å; T645-A647 PolarHBondContact O-N 2.9Å
648	Y	77.3	Confident	71	Confident	51 Å²	51	48.3 Å²	48.3	20%	0.2	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-104.4	-5	-172.6	-58.7	-71	0	0	0	114.1	W558 T644 T645 L646	W558-Y648 AromaticContact CD2-CD1 3.88Å; W558-Y648 HydrophobicContact CD2-CD1 3.88Å; W558-Y648 AromaticContact CE2-CD1 3.8Å; W558-Y648 AromaticContact CE3-CD1 3.78Å; W558-Y648 HydrophobicContact CE3-CD1 3.78Å; W558-Y648 HydrophobicContact CE3-CE1 4.11Å; W558-Y648 AromaticContact CH2-CD1 3.75Å; W558-Y648 HydrophobicContact CH2-CD1 3.75Å; W558-Y648 AromaticContact CH2-CE1 3.6Å; W558-Y648 HydrophobicContact CH2-CE1 3.6Å; W558-Y648 AromaticContact CZ2-CD1 3.74Å; W558-Y648 HydrophobicContact CZ2-CD1 3.74Å; W558-Y648 HydrophobicContact CZ2-CE1 4.03Å; W558-Y648 AromaticContact CZ3-CD1 3.74Å; W558-Y648 HydrophobicContact CZ3-CD1 3.74Å; W558-Y648 AromaticContact CZ3-CE1 3.61Å; W558-Y648 HydrophobicContact CZ3-CE1 3.61Å; T644-Y648 WeakPolarHBondContact O-CE2 3.38Å; T645-Y648 PolarHBondContact O-N 3.01Å; L646-Y648 PolarHBondContact O-N 2.8Å; L646-Y648 VanDerWaalsContact O-N 3.1Å
649	G	78.1	Confident	73.7	Confident	15 Å²	15	51.1 Å²	51.1	16%	0.155	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	103.1	-4.8	174.3	0	0	0	0	0	116.2	W558 L646 M651 N652	W558-G649 WeakPolarHBondContact O-CA 3.38Å; L646-G649 PolarHBondContact O-N 3.33Å; G649-M651 PolarHBondContact O-N 3Å; G649-N652 WeakPolarHBondContact O-CB 3.29Å; G649-N652 PolarHBondContact O-N 3.07Å
650	D	82.6	Confident	76.6	Confident	60 Å²	60	48 Å²	48	32%	0.321	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-30.9	-176	-71.5	24.2	0	0	0	114.5	R720	D650-R720 WeakPolarHBondContact O-CD 3.3Å; D650-R720 PolarHBondContact O-NH1 2.61Å
651	M	91.5	Very high	79.6	Confident	5 Å²	5	42.4 Å²	42.4	3%	0.025	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.4	51.4	179	-60.7	167	76.4	0	0	111	L646 G649 W655 A680 L713 Y718 R720	L646-M651 HydrophobicContact CD2-CB 3.81Å; L646-M651 HydrophobicContact CD2-CE 4.42Å; L646-M651 HydrophobicContact CD2-CG 4.16Å; L646-M651 HydrophobicContact CD2-SD 3.5Å; L646-M651 VanDerWaalsContact CD2-SD 3.5Å; G649-M651 PolarHBondContact O-N 3Å; M651-W655 HydrophobicContact CB-CD2 4.41Å; M651-W655 HydrophobicContact CB-CE3 3.72Å; M651-W655 HydrophobicContact CB-CZ3 4.02Å; M651-W655 HydrophobicContact CE-CE3 4.28Å; M651-W655 HydrophobicContact CE-CH2 3.57Å; M651-W655 HydrophobicContact CE-CZ3 3.36Å; M651-W655 HydrophobicContact CG-CD2 4.33Å; M651-W655 HydrophobicContact CG-CE3 3.88Å; M651-W655 HydrophobicContact CG-CH2 4.34Å; M651-W655 HydrophobicContact CG-CZ3 3.89Å; M651-W655 HydrophobicContact SD-CZ3 4.46Å; M651-A680 HydrophobicContact CB-CB 3.69Å; M651-A680 HydrophobicContact CE-CB 4.03Å; M651-A680 PolarHBondContact O-N 3.22Å; M651-A680 HydrophobicContact SD-CB 4.5Å; M651-L713 HydrophobicContact CE-CD1 3.83Å; M651-L713 HydrophobicContact CE-CD2 3.79Å; M651-L713 HydrophobicContact CE-CG 4.35Å; M651-Y718 HydrophobicContact CE-CD1 4.06Å; M651-R720 HydrophobicContact CG-CB 3.78Å; M651-R720 HydrophobicContact CG-CG 4.33Å; M651-R720 HydrophobicContact SD-CB 3.97Å
652	N	94.8	Very high	82.6	Confident	28 Å²	28	40.6 Å²	40.6	15%	0.15	21%	0.21	C	C	.	.			trans	-66.6	-177.4	177.2	78.8	-1.9	0	0	0	113	G649 E654 W655 I656	G649-N652 WeakPolarHBondContact O-CB 3.29Å; G649-N652 PolarHBondContact O-N 3.07Å; N652-E654 VanDerWaalsContact C-N 3.28Å; N652-E654 PolarHBondContact ND2-OE2 3.02Å; N652-E654 PolarHBondContact O-N 2.86Å; N652-E654 WeakPolarHBondContact OD1-CA 3.39Å; N652-E654 WeakPolarHBondContact OD1-CB 3.42Å; N652-E654 PolarHBondContact OD1-N 3.39Å; N652-W655 PolarHBondContact O-N 3.39Å; N652-W655 PolarHBondContact OD1-N 2.84Å; N652-I656 WeakPolarHBondContact O-CG1 3.21Å; N652-I656 PolarHBondContact O-N 3.46Å
653	H	96.8	Very high	85.6	Confident	22 Å²	22	36.4 Å²	36.4	10%	0.102	19%	0.185	C	C	.	.	H	α-helix	trans	-68.9	-23.8	-178.5	72.3	-82.1	0	0	0	114.2	G560 G657 L677 V678	G560-H653 PolarHBondContact O-CE1 2.99Å; G560-H653 PolarHBondContact O-ND1 3.19Å; H653-G657 PolarHBondContact O-N 3.08Å; H653-L677 WeakPolarHBondContact CB-O 3.15Å; H653-V678 VanDerWaalsContact CA-O 3.28Å; H653-V678 WeakPolarHBondContact CA-O 3.25Å; H653-V678 WeakPolarHBondContact CB-O 3.45Å
654	E	96.1	Very high	87.9	Confident	96 Å²	96	29.6 Å²	29.6	45%	0.449	16%	0.155	S	C	.	.	H	α-helix	trans	-73.8	-43.9	173.8	-56.4	171.5	112.6	0	0	110.4	N652 G657 N658	N652-E654 VanDerWaalsContact C-N 3.28Å; N652-E654 PolarHBondContact ND2-OE2 3.02Å; N652-E654 PolarHBondContact O-N 2.86Å; N652-E654 WeakPolarHBondContact OD1-CA 3.39Å; N652-E654 WeakPolarHBondContact OD1-CB 3.42Å; N652-E654 PolarHBondContact OD1-N 3.39Å; E654-G657 PolarHBondContact O-N 3.12Å; E654-N658 WeakPolarHBondContact O-CB 3.46Å; E654-N658 PolarHBondContact O-N 2.86Å; E654-N658 PolarHBondContact O-ND2 3.21Å
655	W	96.4	Very high	90.2	Very high	12 Å²	12	27.5 Å²	27.5	5%	0.045	14%	0.142	C	C	.	.	H	α-helix	trans	-63.5	-41.8	173.9	-178	78.6	0	0	0	111.9	M651 N652 E659 W660 L713 R720 L723	M651-W655 HydrophobicContact CB-CD2 4.41Å; M651-W655 HydrophobicContact CB-CE3 3.72Å; M651-W655 HydrophobicContact CB-CZ3 4.02Å; M651-W655 HydrophobicContact CE-CE3 4.28Å; M651-W655 HydrophobicContact CE-CH2 3.57Å; M651-W655 HydrophobicContact CE-CZ3 3.36Å; M651-W655 HydrophobicContact CG-CD2 4.33Å; M651-W655 HydrophobicContact CG-CE3 3.88Å; M651-W655 HydrophobicContact CG-CH2 4.34Å; M651-W655 HydrophobicContact CG-CZ3 3.89Å; M651-W655 HydrophobicContact SD-CZ3 4.46Å; N652-W655 PolarHBondContact O-N 3.39Å; N652-W655 PolarHBondContact OD1-N 2.84Å; W655-E659 HydrophobicContact CG-CB 4.33Å; W655-E659 HydrophobicContact CG-CG 4.42Å; W655-E659 WeakPolarHBondContact O-CB 3.35Å; W655-E659 PolarHBondContact O-N 3.25Å; W655-W660 HydrophobicContact CD2-CB 4.33Å; W655-W660 HydrophobicContact CE3-CB 3.96Å; W655-W660 HydrophobicContact CH2-CB 3.74Å; W655-W660 AromaticContact CH2-CD1 3.57Å; W655-W660 AromaticContact CH2-CG 3.81Å; W655-W660 HydrophobicContact CH2-CG 3.81Å; W655-W660 HydrophobicContact CZ2-CB 4.12Å; W655-W660 HydrophobicContact CZ3-CB 3.64Å; W655-W660 AromaticContact CZ3-CD1 3.97Å; W655-W660 AromaticContact CZ3-CG 3.8Å; W655-W660 HydrophobicContact CZ3-CG 3.8Å; W655-W660 PolarHBondContact O-N 2.98Å; W655-L713 HydrophobicContact CH2-CD2 4.23Å; W655-R720 HydrophobicContact CZ2-CG 4.13Å; W655-R720 VanDerWaalsContact NE1-CZ 3.33Å; W655-L723 HydrophobicContact CH2-CD2 3.96Å; W655-L723 HydrophobicContact CZ2-CD2 4.03Å
656	I	97.9	Very high	92.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.131	C	C	.	.	I	π-helix	trans	-59	-48	174.2	-71.9	-64.2	0	0	0	111.2	N652 W660 L661 F673 V678 A680 L683	N652-I656 WeakPolarHBondContact O-CG1 3.21Å; N652-I656 PolarHBondContact O-N 3.46Å; I656-W660 HydrophobicContact CD1-CB 4.33Å; I656-W660 HydrophobicContact CD1-CD2 3.94Å; I656-W660 HydrophobicContact CD1-CE3 3.61Å; I656-W660 HydrophobicContact CD1-CG 4.28Å; I656-W660 HydrophobicContact CD1-CZ3 4.16Å; I656-W660 HydrophobicContact CG2-CE3 4.17Å; I656-L661 WeakPolarHBondContact O-CB 3.03Å; I656-L661 PolarHBondContact O-N 3.41Å; I656-F673 HydrophobicContact CG2-CD1 3.82Å; I656-V678 WeakPolarHBondContact CB-O 3.44Å; I656-V678 WeakPolarHBondContact CG2-O 3.46Å; I656-A680 HydrophobicContact CD1-CB 4.17Å; I656-L683 HydrophobicContact CD1-CD1 3.91Å
657	G	97.5	Very high	93.3	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	I	π-helix	trans	-74.2	-41.9	-178.4	0	0	0	0	0	115	H653 E654 P662 R670	H653-G657 PolarHBondContact O-N 3.08Å; E654-G657 PolarHBondContact O-N 3.12Å; G657-P662 WeakPolarHBondContact O-CD 3.35Å; G657-R670 WeakPolarHBondContact O-CD 3.46Å; G657-R670 WeakPolarHBondContact O-CG 3.25Å
658	N	97.4	Very high	94.7	Very high	62 Å²	62	29.4 Å²	29.4	33%	0.332	15%	0.152	S	C	.	.	I	π-helix	trans	-88.2	-37.9	-171.1	-61.7	-27	0	0	0	113.6	E654 P662 R670	E654-N658 WeakPolarHBondContact O-CB 3.46Å; E654-N658 PolarHBondContact O-N 2.86Å; E654-N658 PolarHBondContact O-ND2 3.21Å; N658-P662 WeakPolarHBondContact O-CG 3.23Å; N658-R670 VanDerWaalsContact OD1-CZ 3.24Å; N658-R670 PolarHBondContact OD1-NE 3.42Å; N658-R670 PolarHBondContact OD1-NH2 2.73Å
659	E	97.2	Very high	95.7	Very high	115 Å²	115	28.1 Å²	28.1	54%	0.537	15%	0.147	S	C	.	.	I	π-helix	trans	-110.3	-57.7	-170.2	-55.4	-62.3	151.3	0	0	110.8	W655 S663	W655-E659 HydrophobicContact CG-CB 4.33Å; W655-E659 HydrophobicContact CG-CG 4.42Å; W655-E659 WeakPolarHBondContact O-CB 3.35Å; W655-E659 PolarHBondContact O-N 3.25Å; E659-S663 VanDerWaalsContact O-CB 3.28Å; E659-S663 WeakPolarHBondContact O-CB 3.42Å; E659-S663 PolarHBondContact O-N 3.14Å; E659-S663 VanDerWaalsContact O-N 3.09Å; E659-S663 PolarHBondContact O-OG 3.37Å
660	W	98.2	Very high	96.6	Very high	3 Å²	3	32.3 Å²	32.3	1%	0.011	16%	0.158	C	C	.	.	I	π-helix	trans	-71.8	-49.6	-168.2	-179.6	75.2	0	0	0	112.5	W655 I656 S663 L664 L683 L706 I710 L713	W655-W660 HydrophobicContact CD2-CB 4.33Å; W655-W660 HydrophobicContact CE3-CB 3.96Å; W655-W660 HydrophobicContact CH2-CB 3.74Å; W655-W660 AromaticContact CH2-CD1 3.57Å; W655-W660 AromaticContact CH2-CG 3.81Å; W655-W660 HydrophobicContact CH2-CG 3.81Å; W655-W660 HydrophobicContact CZ2-CB 4.12Å; W655-W660 HydrophobicContact CZ3-CB 3.64Å; W655-W660 AromaticContact CZ3-CD1 3.97Å; W655-W660 AromaticContact CZ3-CG 3.8Å; W655-W660 HydrophobicContact CZ3-CG 3.8Å; W655-W660 PolarHBondContact O-N 2.98Å; I656-W660 HydrophobicContact CD1-CB 4.33Å; I656-W660 HydrophobicContact CD1-CD2 3.94Å; I656-W660 HydrophobicContact CD1-CE3 3.61Å; I656-W660 HydrophobicContact CD1-CG 4.28Å; I656-W660 HydrophobicContact CD1-CZ3 4.16Å; I656-W660 HydrophobicContact CG2-CE3 4.17Å; W660-S663 CarbonylContact O-C 3.59Å; W660-S663 WeakPolarHBondContact O-CA 3.3Å; W660-S663 WeakPolarHBondContact O-CB 3.15Å; W660-S663 PolarHBondContact O-N 3.28Å; W660-S663 PolarHBondContact O-OG 3.07Å; W660-L664 HydrophobicContact CD2-CD1 4.28Å; W660-L664 HydrophobicContact CE3-CD1 4.29Å; W660-L664 HydrophobicContact CH2-CD1 3.8Å; W660-L664 HydrophobicContact CZ2-CD1 3.76Å; W660-L664 HydrophobicContact CZ3-CD1 4.06Å; W660-L664 PolarHBondContact O-N 3.31Å; W660-L664 VanDerWaalsContact O-N 3.15Å; W660-L683 HydrophobicContact CH2-CD1 3.64Å; W660-L683 HydrophobicContact CH2-CD2 3.98Å; W660-L683 HydrophobicContact CH2-CG 4.47Å; W660-L683 HydrophobicContact CZ2-CD1 4.09Å; W660-L683 HydrophobicContact CZ3-CD1 3.94Å; W660-L683 HydrophobicContact CZ3-CD2 3.83Å; W660-L706 HydrophobicContact CH2-CD1 3.69Å; W660-L706 HydrophobicContact CZ3-CD1 3.71Å; W660-I710 HydrophobicContact CH2-CG1 3.91Å; W660-I710 HydrophobicContact CZ2-CG1 4.3Å; W660-L713 HydrophobicContact CD2-CD1 4.37Å; W660-L713 HydrophobicContact CZ2-CD1 3.63Å; W660-L713 HydrophobicContact CZ2-CG 4.08Å
661	L	98.3	Very high	97.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.3	-41.2	-176.5	-170.5	71.8	0	0	0	112.9	I656 S663 L664 L666 F673 L706	I656-L661 WeakPolarHBondContact O-CB 3.03Å; I656-L661 PolarHBondContact O-N 3.41Å; L661-S663 VanDerWaalsContact C-N 3.33Å; L661-S663 PolarHBondContact O-N 3.36Å; L661-L664 PolarHBondContact O-N 3.19Å; L661-L666 HydrophobicContact CD1-CB 3.74Å; L661-L666 HydrophobicContact CD1-CD1 4.11Å; L661-L666 HydrophobicContact CG-CB 3.97Å; L661-L666 WeakPolarHBondContact CG-O 3.35Å; L661-L666 PolarHBondContact O-N 3.06Å; L661-L666 VanDerWaalsContact O-N 3.08Å; L661-F673 HydrophobicContact CD1-CE1 4.45Å; L661-F673 HydrophobicContact CD1-CE2 4.5Å; L661-F673 HydrophobicContact CD1-CZ 4.3Å; L661-F673 HydrophobicContact CD2-CB 4.17Å; L661-F673 HydrophobicContact CD2-CD1 4.28Å; L661-F673 HydrophobicContact CD2-CD2 3.81Å; L661-F673 HydrophobicContact CD2-CE2 4.23Å; L661-F673 HydrophobicContact CD2-CG 3.83Å; L661-L706 HydrophobicContact CD1-CD1 3.93Å
662	P	98.4	Very high	97.7	Very high	37 Å²	37	35.9 Å²	35.9	24%	0.24	18%	0.177	C	C	.	.	H	α-helix	trans	-59.5	-39.8	166.2	-28.2	39.5	0	0	0	112.8	G657 N658 L664 G665 P667	G657-P662 WeakPolarHBondContact O-CD 3.35Å; N658-P662 WeakPolarHBondContact O-CG 3.23Å; P662-L664 PolarHBondContact O-N 3.21Å; P662-L664 VanDerWaalsContact O-N 3.13Å; P662-G665 WeakPolarHBondContact O-CA 3.48Å; P662-G665 PolarHBondContact O-N 2.85Å; P662-P667 HydrophobicContact CB-CB 4.18Å; P662-P667 HydrophobicContact CG-CB 4.13Å
663	S	98.3	Very high	97.9	Very high	9 Å²	9	34.5 Å²	34.5	6%	0.063	17%	0.17	C	C	.	.	H	α-helix	trans	-65.1	-16.1	177.6	83.1	0	0	0	0	114.7	E659 W660 L661 R727 T741 N742	E659-S663 VanDerWaalsContact O-CB 3.28Å; E659-S663 WeakPolarHBondContact O-CB 3.42Å; E659-S663 PolarHBondContact O-N 3.14Å; E659-S663 VanDerWaalsContact O-N 3.09Å; E659-S663 PolarHBondContact O-OG 3.37Å; W660-S663 CarbonylContact O-C 3.59Å; W660-S663 WeakPolarHBondContact O-CA 3.3Å; W660-S663 WeakPolarHBondContact O-CB 3.15Å; W660-S663 PolarHBondContact O-N 3.28Å; W660-S663 PolarHBondContact O-OG 3.07Å; L661-S663 VanDerWaalsContact C-N 3.33Å; L661-S663 PolarHBondContact O-N 3.36Å; S663-R727 PolarHBondContact OG-NH1 2.99Å; S663-R727 PolarHBondContact OG-NH2 3.47Å; S663-T741 CarbonylContact O-C 3.09Å; S663-T741 VanDerWaalsContact O-CA 3.28Å; S663-T741 WeakPolarHBondContact O-CA 3.5Å; S663-N742 PolarHBondContact O-N 3.48Å
664	L	98.6	Very high	97.9	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.021	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-6	169.3	-58.3	-174.3	0	0	0	113.5	W660 L661 P662 L666 L706 G765 H767	W660-L664 HydrophobicContact CD2-CD1 4.28Å; W660-L664 HydrophobicContact CE3-CD1 4.29Å; W660-L664 HydrophobicContact CH2-CD1 3.8Å; W660-L664 HydrophobicContact CZ2-CD1 3.76Å; W660-L664 HydrophobicContact CZ3-CD1 4.06Å; W660-L664 PolarHBondContact O-N 3.31Å; W660-L664 VanDerWaalsContact O-N 3.15Å; L661-L664 PolarHBondContact O-N 3.19Å; P662-L664 PolarHBondContact O-N 3.21Å; P662-L664 VanDerWaalsContact O-N 3.13Å; L664-L666 HydrophobicContact CB-CD1 4.2Å; L664-L666 HydrophobicContact CB-CG 4.25Å; L664-L666 HydrophobicContact CD1-CD1 4.38Å; L664-L706 HydrophobicContact CD1-CD1 4.11Å; L664-G765 CarbonylContact O-C 3.56Å; L664-G765 VanDerWaalsContact O-CA 3.26Å; L664-G765 WeakPolarHBondContact O-CA 3.46Å; L664-G765 VanDerWaalsContact O-O 3.11Å; L664-H767 PolarHBondContact O-ND1 3.28Å
665	G	98.2	Very high	98	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	25	-170.5	0	0	0	0	0	113.2	P662 N742 E763 S764 G765	P662-G665 WeakPolarHBondContact O-CA 3.48Å; P662-G665 PolarHBondContact O-N 2.85Å; G665-N742 VanDerWaalsContact CA-CG 3.5Å; G665-E763 CarbonylContact O-C 3.6Å; G665-E763 WeakPolarHBondContact O-CA 3.31Å; G665-S764 PolarHBondContact O-N 2.68Å; G665-G765 WeakPolarHBondContact O-CA 3.46Å; G665-G765 PolarHBondContact O-N 2.66Å
666	L	98.5	Very high	98	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.			trans	-118.9	34.2	-175.4	-64.7	177.8	0	0	0	115.2	L661 L664 Q668 Y669 M697 H702 L706 G765	L661-L666 HydrophobicContact CD1-CB 3.74Å; L661-L666 HydrophobicContact CD1-CD1 4.11Å; L661-L666 HydrophobicContact CG-CB 3.97Å; L661-L666 WeakPolarHBondContact CG-O 3.35Å; L661-L666 PolarHBondContact O-N 3.06Å; L661-L666 VanDerWaalsContact O-N 3.08Å; L664-L666 HydrophobicContact CB-CD1 4.2Å; L664-L666 HydrophobicContact CB-CG 4.25Å; L664-L666 HydrophobicContact CD1-CD1 4.38Å; L666-Q668 PolarHBondContact O-N 3.27Å; L666-Q668 VanDerWaalsContact O-N 3.16Å; L666-Q668 PolarHBondContact O-OE1 3.48Å; L666-Y669 HydrophobicContact CB-CD2 4.22Å; L666-Y669 HydrophobicContact CD2-CD2 4.22Å; L666-Y669 HydrophobicContact CD2-CE2 4.14Å; L666-Y669 PolarHBondContact O-N 3.31Å; L666-M697 HydrophobicContact CD1-CE 4.13Å; L666-H702 HydrophobicContact CD2-CB 3.79Å; L666-L706 HydrophobicContact CD1-CB 4.25Å; L666-L706 HydrophobicContact CD1-CD1 4.47Å; L666-G765 VanDerWaalsContact CD2-CA 3.49Å
667	P	98.1	Very high	98	Very high	48 Å²	48	37.4 Å²	37.4	31%	0.312	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-62.5	-25.7	-172.2	30.5	-37.5	0	0	0	114	P662 Y669 R670 E763	P662-P667 HydrophobicContact CB-CB 4.18Å; P662-P667 HydrophobicContact CG-CB 4.13Å; P667-Y669 PolarHBondContact O-N 3.19Å; P667-Y669 VanDerWaalsContact O-N 3.12Å; P667-R670 WeakPolarHBondContact O-CB 3.41Å; P667-R670 PolarHBondContact O-N 3.11Å; P667-E763 HydrophobicContact CG-CG 4.07Å
668	Q	97.9	Very high	98.1	Very high	50 Å²	50	37.4 Å²	37.4	23%	0.234	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-63.3	-17.7	179.4	74.8	-81.1	44.9	0	0	113.8	L666 E763	L666-Q668 PolarHBondContact O-N 3.27Å; L666-Q668 VanDerWaalsContact O-N 3.16Å; L666-Q668 PolarHBondContact O-OE1 3.48Å; Q668-E763 PolarHBondContact NE2-O 2.85Å
669	Y	98.6	Very high	98	Very high	25 Å²	25	34.5 Å²	34.5	10%	0.098	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-93	-4.3	175.9	-61.4	-68.4	0	0	0	113.8	L666 P667 S671 Y672 F673 L695 M697 H702	L666-Y669 HydrophobicContact CB-CD2 4.22Å; L666-Y669 HydrophobicContact CD2-CD2 4.22Å; L666-Y669 HydrophobicContact CD2-CE2 4.14Å; L666-Y669 PolarHBondContact O-N 3.31Å; P667-Y669 PolarHBondContact O-N 3.19Å; P667-Y669 VanDerWaalsContact O-N 3.12Å; Y669-S671 PolarHBondContact O-N 3.27Å; Y669-Y672 HydrophobicContact CD1-CD2 4.45Å; Y669-Y672 PolarHBondContact O-N 3.15Å; Y669-F673 WeakPolarHBondContact O-CD2 3.48Å; Y669-F673 PolarHBondContact O-N 2.77Å; Y669-L695 WeakPolarHBondContact CD1-O 3.39Å; Y669-M697 HydrophobicContact CD1-CB 4.26Å; Y669-M697 HydrophobicContact CD1-CE 4.5Å; Y669-M697 HydrophobicContact CD2-CE 3.68Å; Y669-M697 HydrophobicContact CE1-CB 4.01Å; Y669-M697 HydrophobicContact CE1-CG 4.22Å; Y669-M697 HydrophobicContact CE2-CE 4.05Å; Y669-M697 HydrophobicContact CE2-CG 4.17Å; Y669-M697 HydrophobicContact CG-CE 3.92Å; Y669-H702 HydrophobicContact CE2-CB 3.98Å; Y669-H702 AromaticContact CE2-CG 3.96Å; Y669-H702 AromaticContact CE2-ND1 3.53Å; Y669-H702 AromaticContact CZ-ND1 3.7Å; Y669-H702 PolarHBondContact OH-ND1 2.79Å
670	R	98.3	Very high	98	Very high	102 Å²	102	29.1 Å²	29.1	39%	0.385	14%	0.144	S	C	.	.	H	α-helix	trans	-52.6	-46.7	-175	169.5	175	175.4	-81.4	-3.2	113.6	G657 N658 P667 Y672 F673 M674	G657-R670 WeakPolarHBondContact O-CD 3.46Å; G657-R670 WeakPolarHBondContact O-CG 3.25Å; N658-R670 VanDerWaalsContact OD1-CZ 3.24Å; N658-R670 PolarHBondContact OD1-NE 3.42Å; N658-R670 PolarHBondContact OD1-NH2 2.73Å; P667-R670 WeakPolarHBondContact O-CB 3.41Å; P667-R670 PolarHBondContact O-N 3.11Å; R670-Y672 PolarHBondContact O-N 3.35Å; R670-F673 PolarHBondContact O-N 2.97Å; R670-M674 HydrophobicContact CG-CG 4.36Å; R670-M674 HydrophobicContact CG-SD 3.93Å; R670-M674 PolarHBondContact NH2-SD 3.08Å; R670-M674 VanDerWaalsContact NH2-SD 3.36Å; R670-M674 WeakPolarHBondContact O-CG 3.39Å; R670-M674 PolarHBondContact O-N 3.46Å
671	S	98	Very high	97.8	Very high	60 Å²	60	30.1 Å²	30.1	42%	0.42	15%	0.148	S	C	.	.	H	α-helix	trans	-56.2	-52	-177.9	46.6	0	0	0	0	111.4	Y669 F673 M674 E675	Y669-S671 PolarHBondContact O-N 3.27Å; S671-F673 PolarHBondContact O-N 3.25Å; S671-M674 PolarHBondContact O-N 2.86Å; S671-E675 VanDerWaalsContact O-CB 3.29Å; S671-E675 WeakPolarHBondContact O-CB 3.49Å; S671-E675 PolarHBondContact O-N 2.92Å
672	Y	98.4	Very high	97.8	Very high	80 Å²	80	30.1 Å²	30.1	31%	0.314	15%	0.148	S	C	.	.	H	α-helix	trans	-66.5	-36.1	-178.5	-46.2	-65.7	0	0	0	112.8	Y669 R670 C676 L695 K696	Y669-Y672 HydrophobicContact CD1-CD2 4.45Å; Y669-Y672 PolarHBondContact O-N 3.15Å; R670-Y672 PolarHBondContact O-N 3.35Å; Y672-C676 VanDerWaalsContact O-CB 3.22Å; Y672-C676 WeakPolarHBondContact O-CB 3.24Å; Y672-C676 PolarHBondContact O-N 2.8Å; Y672-C676 PolarHBondContact O-SG 3.02Å; Y672-C676 VanDerWaalsContact O-SG 3.37Å; Y672-L695 WeakPolarHBondContact O-CD2 3.33Å; Y672-K696 HydrophobicContact CD1-CG 3.72Å; Y672-K696 HydrophobicContact CD2-CB 3.92Å; Y672-K696 HydrophobicContact CD2-CG 3.89Å; Y672-K696 HydrophobicContact CE1-CG 3.63Å; Y672-K696 HydrophobicContact CE2-CB 3.8Å; Y672-K696 HydrophobicContact CE2-CG 3.8Å; Y672-K696 HydrophobicContact CG-CB 4.33Å; Y672-K696 HydrophobicContact CG-CG 3.85Å
673	F	98.5	Very high	97.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-66	-41.4	174.9	-88.3	-111.6	0	0	0	112.1	I656 L661 Y669 R670 S671 L677 V678 L683 L686 L695 M697 L706	I656-F673 HydrophobicContact CG2-CD1 3.82Å; L661-F673 HydrophobicContact CD1-CE1 4.45Å; L661-F673 HydrophobicContact CD1-CE2 4.5Å; L661-F673 HydrophobicContact CD1-CZ 4.3Å; L661-F673 HydrophobicContact CD2-CB 4.17Å; L661-F673 HydrophobicContact CD2-CD1 4.28Å; L661-F673 HydrophobicContact CD2-CD2 3.81Å; L661-F673 HydrophobicContact CD2-CE2 4.23Å; L661-F673 HydrophobicContact CD2-CG 3.83Å; Y669-F673 WeakPolarHBondContact O-CD2 3.48Å; Y669-F673 PolarHBondContact O-N 2.77Å; R670-F673 PolarHBondContact O-N 2.97Å; S671-F673 PolarHBondContact O-N 3.25Å; F673-L677 PolarHBondContact O-N 3.04Å; F673-V678 HydrophobicContact CB-CB 4.46Å; F673-V678 HydrophobicContact CD1-CB 3.83Å; F673-V678 HydrophobicContact CD1-CG1 3.75Å; F673-V678 HydrophobicContact CD1-CG2 4.21Å; F673-V678 HydrophobicContact CE1-CG1 4.02Å; F673-V678 HydrophobicContact CG-CB 4.43Å; F673-V678 HydrophobicContact CG-CG2 4.5Å; F673-V678 PolarHBondContact O-N 3.2Å; F673-L683 HydrophobicContact CE1-CD2 4.33Å; F673-L686 HydrophobicContact CE1-CD1 4.48Å; F673-L695 HydrophobicContact CD2-CB 4.27Å; F673-L695 HydrophobicContact CD2-CD1 4.42Å; F673-L695 HydrophobicContact CD2-CD2 4.02Å; F673-L695 HydrophobicContact CD2-CG 4.46Å; F673-L695 HydrophobicContact CE1-CD1 4.36Å; F673-L695 HydrophobicContact CE2-CB 3.93Å; F673-L695 HydrophobicContact CE2-CD1 3.99Å; F673-L695 HydrophobicContact CE2-CD2 4.35Å; F673-L695 HydrophobicContact CE2-CG 4.31Å; F673-L695 HydrophobicContact CG-CD2 4.33Å; F673-L695 HydrophobicContact CZ-CD1 3.96Å; F673-M697 HydrophobicContact CE2-CE 4.2Å; F673-M697 HydrophobicContact CZ-CE 4.37Å; F673-L706 HydrophobicContact CE1-CD1 4.37Å; F673-L706 HydrophobicContact CZ-CD1 4.13Å; F673-L706 HydrophobicContact CZ-CD2 3.93Å
674	M	97.9	Very high	97.3	Very high	45 Å²	45	32.3 Å²	32.3	22%	0.222	16%	0.157	C	C	.	.	H	α-helix	trans	-70.6	-44.3	175.6	-69.4	-174.5	75.2	0	0	112.2	R670 S671 C676 L677	R670-M674 HydrophobicContact CG-CG 4.36Å; R670-M674 HydrophobicContact CG-SD 3.93Å; R670-M674 PolarHBondContact NH2-SD 3.08Å; R670-M674 VanDerWaalsContact NH2-SD 3.36Å; R670-M674 WeakPolarHBondContact O-CG 3.39Å; R670-M674 PolarHBondContact O-N 3.46Å; S671-M674 PolarHBondContact O-N 2.86Å; M674-C676 VanDerWaalsContact C-N 3.29Å; M674-C676 PolarHBondContact O-N 2.9Å; M674-L677 WeakPolarHBondContact O-CA 3.38Å; M674-L677 PolarHBondContact O-N 2.78Å
675	E	96.8	Very high	97.1	Very high	133 Å²	133	36.7 Å²	36.7	62%	0.621	18%	0.177	S	C	*	.	H	α-helix	trans	-58.3	-41.8	176.8	-172.6	-169.9	162.1	0	0	111.3	H598 S671 L677	H598-E675 PolarHBondContact CE1-O 3.43Å; H598-E675 PolarHBondContact NE2-O 3.24Å; S671-E675 VanDerWaalsContact O-CB 3.29Å; S671-E675 WeakPolarHBondContact O-CB 3.49Å; S671-E675 PolarHBondContact O-N 2.92Å; E675-L677 VanDerWaalsContact C-N 3.26Å; E675-L677 PolarHBondContact O-N 3.18Å
676	C	98.1	Very high	97.1	Very high	5 Å²	5	37.8 Å²	37.8	3%	0.034	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	7.7	175.8	-66.1	0	0	0	0	114.3	L597 H598 Y672 M674 V678 L695	L597-C676 HydrophobicContact CB-CB 4.24Å; L597-C676 HydrophobicContact CD1-CB 3.71Å; H598-C676 PolarHBondContact CD2-O 2.91Å; H598-C676 VanDerWaalsContact NE2-CA 3.33Å; H598-C676 WeakPolarHBondContact NE2-CA 3.45Å; Y672-C676 VanDerWaalsContact O-CB 3.22Å; Y672-C676 WeakPolarHBondContact O-CB 3.24Å; Y672-C676 PolarHBondContact O-N 2.8Å; Y672-C676 PolarHBondContact O-SG 3.02Å; Y672-C676 VanDerWaalsContact O-SG 3.37Å; M674-C676 VanDerWaalsContact C-N 3.29Å; M674-C676 PolarHBondContact O-N 2.9Å; C676-V678 HydrophobicContact CB-CG2 3.9Å; C676-V678 PolarHBondContact O-N 3.48Å; C676-V678 VanDerWaalsContact O-N 3.14Å; C676-L695 HydrophobicContact CB-CD2 3.8Å
677	L	97.8	Very high	97	Very high	8 Å²	8	41.2 Å²	41.2	4%	0.042	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	29.7	178.1	-54.7	173.6	0	0	0	115	P562 Y565 K601 H653 F673 M674 E675 D679	P562-L677 HydrophobicContact CG-CD1 3.89Å; P562-L677 HydrophobicContact CG-CD2 3.64Å; P562-L677 HydrophobicContact CG-CG 4.42Å; Y565-L677 HydrophobicContact CD2-CD1 4.24Å; Y565-L677 HydrophobicContact CE2-CD1 4.09Å; K601-L677 HydrophobicContact CD-CB 3.64Å; K601-L677 HydrophobicContact CD-CD1 4.4Å; K601-L677 WeakPolarHBondContact CD-O 3.4Å; K601-L677 WeakPolarHBondContact CE-O 3.26Å; K601-L677 PolarHBondContact NZ-O 2.68Å; H653-L677 WeakPolarHBondContact CB-O 3.15Å; F673-L677 PolarHBondContact O-N 3.04Å; M674-L677 WeakPolarHBondContact O-CA 3.38Å; M674-L677 PolarHBondContact O-N 2.78Å; E675-L677 VanDerWaalsContact C-N 3.26Å; E675-L677 PolarHBondContact O-N 3.18Å; L677-D679 PolarHBondContact O-N 3.08Å; L677-D679 VanDerWaalsContact O-N 3.14Å
678	V	98.2	Very high	96.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.217	C	C	.	.			trans	-65.3	109.8	-172.5	-177.7	0	0	0	0	111.2	H653 I656 F673 C676 M682 L683 L686 L695	H653-V678 VanDerWaalsContact CA-O 3.28Å; H653-V678 WeakPolarHBondContact CA-O 3.25Å; H653-V678 WeakPolarHBondContact CB-O 3.45Å; I656-V678 WeakPolarHBondContact CB-O 3.44Å; I656-V678 WeakPolarHBondContact CG2-O 3.46Å; F673-V678 HydrophobicContact CB-CB 4.46Å; F673-V678 HydrophobicContact CD1-CB 3.83Å; F673-V678 HydrophobicContact CD1-CG1 3.75Å; F673-V678 HydrophobicContact CD1-CG2 4.21Å; F673-V678 HydrophobicContact CE1-CG1 4.02Å; F673-V678 HydrophobicContact CG-CB 4.43Å; F673-V678 HydrophobicContact CG-CG2 4.5Å; F673-V678 PolarHBondContact O-N 3.2Å; C676-V678 HydrophobicContact CB-CG2 3.9Å; C676-V678 PolarHBondContact O-N 3.48Å; C676-V678 VanDerWaalsContact O-N 3.14Å; V678-M682 HydrophobicContact CG1-CB 4.31Å; V678-M682 HydrophobicContact CG2-CE 4.21Å; V678-L683 HydrophobicContact CG1-CD2 4.08Å; V678-L686 HydrophobicContact CG1-CD1 4.1Å; V678-L695 HydrophobicContact CG2-CD1 4.26Å; V678-L695 HydrophobicContact CG2-CD2 3.84Å
679	D	96.9	Very high	96.7	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	24%	0.236	C	C	.	.			trans	-102.3	172.7	171.1	71.8	43.5	0	0	0	112.8	K601 L677 R681 M682	K601-D679 IonicContact NZ-OD2 2.63Å; K601-D679 PolarHBondContact NZ-OD2 2.87Å; L677-D679 PolarHBondContact O-N 3.08Å; L677-D679 VanDerWaalsContact O-N 3.14Å; D679-R681 PolarHBondContact O-N 3.4Å; D679-R681 VanDerWaalsContact O-N 3.1Å; D679-R681 VanDerWaalsContact OD1-CB 3.24Å; D679-R681 WeakPolarHBondContact OD1-CB 3.34Å; D679-R681 PolarHBondContact OD1-N 2.99Å; D679-R681 IonicContact OD1-NE 2.71Å; D679-R681 PolarHBondContact OD1-NE 3.5Å; D679-R681 IonicContact OD1-NH2 2.64Å; D679-R681 IonicContact OD2-CZ 3.35Å; D679-R681 IonicContact OD2-NE 3.78Å; D679-R681 PolarHBondContact OD2-NE 3.3Å; D679-R681 IonicContact OD2-NH2 3.16Å; D679-R681 PolarHBondContact OD2-NH2 3.17Å; D679-M682 WeakPolarHBondContact O-CB 3.47Å; D679-M682 PolarHBondContact O-N 2.88Å; D679-M682 PolarHBondContact OD1-N 3Å
680	A	95.6	Very high	96.7	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.008	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-22.9	-174.9	0	0	0	0	0	114.9	L646 M651 I656 L683 Y718	L646-A680 HydrophobicContact CD1-CB 4.39Å; L646-A680 HydrophobicContact CD2-CB 3.62Å; M651-A680 HydrophobicContact CB-CB 3.69Å; M651-A680 HydrophobicContact CE-CB 4.03Å; M651-A680 PolarHBondContact O-N 3.22Å; M651-A680 HydrophobicContact SD-CB 4.5Å; I656-A680 HydrophobicContact CD1-CB 4.17Å; A680-L683 HydrophobicContact CB-CD1 4.37Å; A680-Y718 HydrophobicContact CB-CD1 4.12Å; A680-Y718 HydrophobicContact CB-CE1 4.39Å; A680-Y718 WeakPolarHBondContact O-CE1 3.49Å
681	R	94.6	Very high	96.7	Very high	24 Å²	24	45.9 Å²	45.9	9%	0.091	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-36.8	176.2	-57.7	169.1	-73	-142.6	-11.8	111.1	E608 L646 D679 L683 H685	E608-R681 WeakPolarHBondContact OE2-CD 3.45Å; E608-R681 IonicContact OE2-CZ 2.66Å; E608-R681 IonicContact OE2-NE 3.85Å; E608-R681 IonicContact OE2-NH1 3.2Å; E608-R681 PolarHBondContact OE2-NH1 2.86Å; L646-R681 HydrophobicContact CB-CG 3.73Å; L646-R681 HydrophobicContact CD1-CG 3.64Å; L646-R681 HydrophobicContact CG-CG 4.27Å; L646-R681 PolarHBondContact O-NH1 3.34Å; D679-R681 PolarHBondContact O-N 3.4Å; D679-R681 VanDerWaalsContact O-N 3.1Å; D679-R681 VanDerWaalsContact OD1-CB 3.24Å; D679-R681 WeakPolarHBondContact OD1-CB 3.34Å; D679-R681 PolarHBondContact OD1-N 2.99Å; D679-R681 IonicContact OD1-NE 2.71Å; D679-R681 PolarHBondContact OD1-NE 3.5Å; D679-R681 IonicContact OD1-NH2 2.64Å; D679-R681 IonicContact OD2-CZ 3.35Å; D679-R681 IonicContact OD2-NE 3.78Å; D679-R681 PolarHBondContact OD2-NE 3.3Å; D679-R681 IonicContact OD2-NH2 3.16Å; D679-R681 PolarHBondContact OD2-NH2 3.17Å; R681-L683 VanDerWaalsContact C-N 3.28Å; R681-L683 PolarHBondContact O-N 3.39Å; R681-H685 PolarHBondContact O-CD2 3.16Å
682	M	97.3	Very high	96.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-68.5	-28	-180	-64.6	169.7	63.9	0	0	112.7	L597 K601 L604 V678 D679 D684 H685 L686	L597-M682 HydrophobicContact CB-CE 4.01Å; L597-M682 HydrophobicContact CD2-CE 4.38Å; L597-M682 WeakPolarHBondContact O-CE 3.45Å; K601-M682 HydrophobicContact CB-CE 4.19Å; K601-M682 HydrophobicContact CB-CG 4.37Å; K601-M682 HydrophobicContact CB-SD 3.45Å; K601-M682 WeakPolarHBondContact CB-SD 3.37Å; K601-M682 HydrophobicContact CD-SD 4.31Å; K601-M682 HydrophobicContact CG-SD 3.72Å; L604-M682 HydrophobicContact CD1-CB 4.45Å; L604-M682 HydrophobicContact CD1-CG 4.07Å; V678-M682 HydrophobicContact CG1-CB 4.31Å; V678-M682 HydrophobicContact CG2-CE 4.21Å; D679-M682 WeakPolarHBondContact O-CB 3.47Å; D679-M682 PolarHBondContact O-N 2.88Å; D679-M682 PolarHBondContact OD1-N 3Å; M682-D684 VanDerWaalsContact C-N 3.29Å; M682-D684 PolarHBondContact O-N 3.12Å; M682-D684 VanDerWaalsContact O-N 3.16Å; M682-H685 CarbonylContact O-C 3.57Å; M682-H685 WeakPolarHBondContact O-CA 3.34Å; M682-H685 PolarHBondContact O-N 2.84Å; M682-L686 PolarHBondContact O-N 2.87Å; M682-L686 VanDerWaalsContact O-N 3.15Å
683	L	95.9	Very high	96.5	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.021	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-51.7	-41.1	-172.2	-68.7	176.6	0	0	0	114.2	I656 W660 F673 V678 A680 R681 H685 L686 I710 L713	I656-L683 HydrophobicContact CD1-CD1 3.91Å; W660-L683 HydrophobicContact CH2-CD1 3.64Å; W660-L683 HydrophobicContact CH2-CD2 3.98Å; W660-L683 HydrophobicContact CH2-CG 4.47Å; W660-L683 HydrophobicContact CZ2-CD1 4.09Å; W660-L683 HydrophobicContact CZ3-CD1 3.94Å; W660-L683 HydrophobicContact CZ3-CD2 3.83Å; F673-L683 HydrophobicContact CE1-CD2 4.33Å; V678-L683 HydrophobicContact CG1-CD2 4.08Å; A680-L683 HydrophobicContact CB-CD1 4.37Å; R681-L683 VanDerWaalsContact C-N 3.28Å; R681-L683 PolarHBondContact O-N 3.39Å; L683-H685 VanDerWaalsContact C-N 3.26Å; L683-H685 PolarHBondContact O-N 3.35Å; L683-L686 HydrophobicContact CD2-CD1 4.26Å; L683-I710 HydrophobicContact CB-CD1 3.97Å; L683-I710 HydrophobicContact CB-CG1 4Å; L683-I710 HydrophobicContact CD1-CG1 4.2Å; L683-I710 HydrophobicContact CD2-CD1 4.45Å; L683-I710 HydrophobicContact CG-CG1 4.48Å; L683-L713 HydrophobicContact CD1-CD1 3.81Å
684	D	91.4	Very high	96.3	Very high	89 Å²	89	50.8 Å²	50.8	48%	0.476	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-80.4	-6.9	-179.5	-154.9	27.2	0	0	0	114	M682 K714	M682-D684 VanDerWaalsContact C-N 3.29Å; M682-D684 PolarHBondContact O-N 3.12Å; M682-D684 VanDerWaalsContact O-N 3.16Å; D684-K714 VanDerWaalsContact CG-CE 3.4Å; D684-K714 VanDerWaalsContact OD1-CE 3.31Å; D684-K714 WeakPolarHBondContact OD1-CE 3.19Å; D684-K714 IonicContact OD1-NZ 2.74Å; D684-K714 PolarHBondContact OD1-NZ 3.14Å; D684-K714 VanDerWaalsContact OD2-CE 3.26Å; D684-K714 WeakPolarHBondContact OD2-CE 3.1Å; D684-K714 IonicContact OD2-NZ 3.46Å; D684-K714 PolarHBondContact OD2-NZ 2.73Å
685	H	95.1	Very high	96.3	Very high	96 Å²	96	48.6 Å²	48.6	44%	0.444	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-108.1	-5.2	179.5	-63.3	-94.8	0	0	0	112.8	L600 L604 R681 M682 L683 T687	L600-H685 HydrophobicContact CD1-CB 4.29Å; L600-H685 HydrophobicContact CD2-CB 4.13Å; L604-H685 HydrophobicContact CD1-CB 4.11Å; R681-H685 PolarHBondContact O-CD2 3.16Å; M682-H685 CarbonylContact O-C 3.57Å; M682-H685 WeakPolarHBondContact O-CA 3.34Å; M682-H685 PolarHBondContact O-N 2.84Å; L683-H685 VanDerWaalsContact C-N 3.26Å; L683-H685 PolarHBondContact O-N 3.35Å; H685-T687 PolarHBondContact O-N 2.77Å
686	L	96.4	Very high	96.4	Very high	22 Å²	22	47.1 Å²	47.1	12%	0.115	22%	0.224	C	C	.	.			trans	-68.1	119.6	175.4	-65.1	179.1	0	0	0	110.7	L597 F673 V678 M682 L683 L691 L695	L597-L686 HydrophobicContact CD2-CD2 3.89Å; F673-L686 HydrophobicContact CE1-CD1 4.48Å; V678-L686 HydrophobicContact CG1-CD1 4.1Å; M682-L686 PolarHBondContact O-N 2.87Å; M682-L686 VanDerWaalsContact O-N 3.15Å; L683-L686 HydrophobicContact CD2-CD1 4.26Å; L686-L691 HydrophobicContact CB-CD2 4.45Å; L686-L691 HydrophobicContact CB-CG 4.42Å; L686-L691 HydrophobicContact CD1-CD2 4.15Å; L686-L695 HydrophobicContact CD1-CD1 3.78Å; L686-L695 HydrophobicContact CD2-CD1 4.04Å
687	T	96.2	Very high	96.4	Very high	72 Å²	72	46.9 Å²	46.9	44%	0.442	22%	0.222	S	C	.	.			trans	-82.8	164.7	176.4	76.6	0	0	0	0	111.9	H685 K689 D690 L691	H685-T687 PolarHBondContact O-N 2.77Å; T687-K689 PolarHBondContact O-N 3.47Å; T687-K689 VanDerWaalsContact O-N 3.14Å; T687-K689 PolarHBondContact OG1-N 2.86Å; T687-D690 WeakPolarHBondContact CA-OD2 3.28Å; T687-D690 WeakPolarHBondContact CB-OD2 3.24Å; T687-D690 WeakPolarHBondContact CG2-OD2 3.3Å; T687-D690 PolarHBondContact N-OD2 2.81Å; T687-D690 PolarHBondContact O-N 3.34Å; T687-D690 VanDerWaalsContact O-N 3.08Å; T687-D690 VanDerWaalsContact OG1-CG 3.26Å; T687-D690 PolarHBondContact OG1-N 2.94Å; T687-D690 PolarHBondContact OG1-OD2 3.15Å; T687-L691 WeakPolarHBondContact O-CG 3.44Å; T687-L691 PolarHBondContact O-N 3.08Å
688	K	95.6	Very high	96.3	Very high	135 Å²	135	51.6 Å²	51.6	59%	0.587	25%	0.251	S	S	*	.	H	α-helix	trans	-57.3	-23.7	169.5	-175.3	178.9	174.9	-174.9	0	113.1	R692	K688-R692 WeakPolarHBondContact O-CD 3.46Å; K688-R692 WeakPolarHBondContact O-CG 3.33Å
689	K	96.1	Very high	96.2	Very high	145 Å²	145	55 Å²	55	63%	0.63	27%	0.269	S	S	*	.	H	α-helix	trans	-74.1	-48.5	173.2	-174.8	177.8	178.2	177.6	0	110.2	T687 L691 R692 V693	T687-K689 PolarHBondContact O-N 3.47Å; T687-K689 VanDerWaalsContact O-N 3.14Å; T687-K689 PolarHBondContact OG1-N 2.86Å; K689-L691 PolarHBondContact O-N 3.29Å; K689-R692 PolarHBondContact O-N 3.19Å; K689-R692 VanDerWaalsContact O-N 3.13Å; K689-V693 HydrophobicContact CG-CG2 3.96Å; K689-V693 WeakPolarHBondContact O-CB 3.24Å; K689-V693 WeakPolarHBondContact O-CG2 3.35Å; K689-V693 PolarHBondContact O-N 3.25Å
690	D	97.3	Very high	96.1	Very high	24 Å²	24	58.7 Å²	58.7	13%	0.128	30%	0.295	C	S	.	.	H	α-helix	trans	-62.1	-45.4	-177.7	-50.7	-51.6	0	0	0	111.8	L597 T687 R692 H694 L695	L597-D690 HydrophobicContact CD2-CB 4.17Å; T687-D690 WeakPolarHBondContact CA-OD2 3.28Å; T687-D690 WeakPolarHBondContact CB-OD2 3.24Å; T687-D690 WeakPolarHBondContact CG2-OD2 3.3Å; T687-D690 PolarHBondContact N-OD2 2.81Å; T687-D690 PolarHBondContact O-N 3.34Å; T687-D690 VanDerWaalsContact O-N 3.08Å; T687-D690 VanDerWaalsContact OG1-CG 3.26Å; T687-D690 PolarHBondContact OG1-N 2.94Å; T687-D690 PolarHBondContact OG1-OD2 3.15Å; D690-R692 PolarHBondContact O-N 3.47Å; D690-H694 PolarHBondContact O-N 3.38Å; D690-H694 IonicContact OD1-CD2 2.77Å; D690-L695 PolarHBondContact O-N 2.8Å
691	L	97.8	Very high	96.2	Very high	20 Å²	20	61.1 Å²	61.1	11%	0.105	31%	0.306	C	S	.	.	H	α-helix	trans	-55.3	-38.3	175.6	-70.6	169.8	0	0	0	112.3	L686 T687 K689 L695 K696 M697 R703 L706	L686-L691 HydrophobicContact CB-CD2 4.45Å; L686-L691 HydrophobicContact CB-CG 4.42Å; L686-L691 HydrophobicContact CD1-CD2 4.15Å; T687-L691 WeakPolarHBondContact O-CG 3.44Å; T687-L691 PolarHBondContact O-N 3.08Å; K689-L691 PolarHBondContact O-N 3.29Å; L691-L695 HydrophobicContact CD2-CD1 4.13Å; L691-L695 CarbonylContact O-C 3.58Å; L691-K696 PolarHBondContact O-N 2.94Å; L691-M697 HydrophobicContact CD2-SD 4.45Å; L691-M697 WeakPolarHBondContact O-CA 3.36Å; L691-M697 VanDerWaalsContact O-CB 3.28Å; L691-M697 WeakPolarHBondContact O-CB 3.34Å; L691-M697 PolarHBondContact O-N 3.2Å; L691-R703 HydrophobicContact CB-CG 4.35Å; L691-R703 HydrophobicContact CD1-CG 4.22Å; L691-L706 HydrophobicContact CD2-CD2 3.41Å; L691-L706 VanDerWaalsContact CD2-CD2 3.41Å
692	R	96.6	Very high	96.4	Very high	108 Å²	108	61 Å²	61	41%	0.408	31%	0.306	S	S	.	.	H	α-helix	trans	-83.2	-51.3	-179	-75.5	176.1	167.5	-157	-9.2	113.4	K688 K689 D690 K696 R703	K688-R692 WeakPolarHBondContact O-CD 3.46Å; K688-R692 WeakPolarHBondContact O-CG 3.33Å; K689-R692 PolarHBondContact O-N 3.19Å; K689-R692 VanDerWaalsContact O-N 3.13Å; D690-R692 PolarHBondContact O-N 3.47Å; R692-K696 WeakPolarHBondContact O-CA 3.47Å; R692-R703 VanDerWaalsContact CG-NH1 3.27Å
693	V	95.2	Very high	96.4	Very high	70 Å²	70	62.5 Å²	62.5	42%	0.424	31%	0.312	S	S	.	.	H	α-helix	trans	-83.3	-46.2	-166.5	177.8	0	0	0	0	111.2	K689 K696	K689-V693 HydrophobicContact CG-CG2 3.96Å; K689-V693 WeakPolarHBondContact O-CB 3.24Å; K689-V693 WeakPolarHBondContact O-CG2 3.35Å; K689-V693 PolarHBondContact O-N 3.25Å; V693-K696 PolarHBondContact O-NZ 3.43Å
694	H	95.6	Very high	96.5	Very high	64 Å²	64	64.8 Å²	64.8	30%	0.296	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-49.2	-176.4	-59.9	-55.4	0	0	0	110.9	L597 D690 K696	L597-H694 HydrophobicContact CD1-CB 3.75Å; D690-H694 PolarHBondContact O-N 3.38Å; D690-H694 IonicContact OD1-CD2 2.77Å; H694-K696 PolarHBondContact O-N 3.1Å
695	L	97.9	Very high	96.8	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.303	C	S	.	.	S	Bend	trans	-92.4	7.5	-174.6	-53.6	173.3	0	0	0	114.4	L597 Y669 Y672 F673 C676 V678 L686 D690 L691 M697	L597-L695 HydrophobicContact CD1-CD2 4.24Å; L597-L695 HydrophobicContact CD1-CG 4.31Å; Y669-L695 WeakPolarHBondContact CD1-O 3.39Å; Y672-L695 WeakPolarHBondContact O-CD2 3.33Å; F673-L695 HydrophobicContact CD2-CB 4.27Å; F673-L695 HydrophobicContact CD2-CD1 4.42Å; F673-L695 HydrophobicContact CD2-CD2 4.02Å; F673-L695 HydrophobicContact CD2-CG 4.46Å; F673-L695 HydrophobicContact CE1-CD1 4.36Å; F673-L695 HydrophobicContact CE2-CB 3.93Å; F673-L695 HydrophobicContact CE2-CD1 3.99Å; F673-L695 HydrophobicContact CE2-CD2 4.35Å; F673-L695 HydrophobicContact CE2-CG 4.31Å; F673-L695 HydrophobicContact CG-CD2 4.33Å; F673-L695 HydrophobicContact CZ-CD1 3.96Å; C676-L695 HydrophobicContact CB-CD2 3.8Å; V678-L695 HydrophobicContact CG2-CD1 4.26Å; V678-L695 HydrophobicContact CG2-CD2 3.84Å; L686-L695 HydrophobicContact CD1-CD1 3.78Å; L686-L695 HydrophobicContact CD2-CD1 4.04Å; D690-L695 PolarHBondContact O-N 2.8Å; L691-L695 HydrophobicContact CD2-CD1 4.13Å; L691-L695 CarbonylContact O-C 3.58Å; L695-M697 PolarHBondContact O-N 2.99Å
696	K	97.9	Very high	96.9	Very high	102 Å²	102	56.1 Å²	56.1	44%	0.443	28%	0.283	S	S	.	.			trans	54	12.9	174.1	-49.7	-53.2	-179.4	-172.3	0	116.9	Y672 L691 R692 V693 H694 V698	Y672-K696 HydrophobicContact CD1-CG 3.72Å; Y672-K696 HydrophobicContact CD2-CB 3.92Å; Y672-K696 HydrophobicContact CD2-CG 3.89Å; Y672-K696 HydrophobicContact CE1-CG 3.63Å; Y672-K696 HydrophobicContact CE2-CB 3.8Å; Y672-K696 HydrophobicContact CE2-CG 3.8Å; Y672-K696 HydrophobicContact CG-CB 4.33Å; Y672-K696 HydrophobicContact CG-CG 3.85Å; L691-K696 PolarHBondContact O-N 2.94Å; R692-K696 WeakPolarHBondContact O-CA 3.47Å; V693-K696 PolarHBondContact O-NZ 3.43Å; H694-K696 PolarHBondContact O-N 3.1Å; K696-V698 VanDerWaalsContact C-N 3.26Å; K696-V698 PolarHBondContact O-N 3.2Å
697	M	97.8	Very high	97	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.294	C	S	.	.			trans	-78.6	73.6	179.1	-162.3	179.6	-80.7	0	0	110.4	L666 Y669 F673 L691 L695 H702 R703 L706	L666-M697 HydrophobicContact CD1-CE 4.13Å; Y669-M697 HydrophobicContact CD1-CB 4.26Å; Y669-M697 HydrophobicContact CD1-CE 4.5Å; Y669-M697 HydrophobicContact CD2-CE 3.68Å; Y669-M697 HydrophobicContact CE1-CB 4.01Å; Y669-M697 HydrophobicContact CE1-CG 4.22Å; Y669-M697 HydrophobicContact CE2-CE 4.05Å; Y669-M697 HydrophobicContact CE2-CG 4.17Å; Y669-M697 HydrophobicContact CG-CE 3.92Å; F673-M697 HydrophobicContact CE2-CE 4.2Å; F673-M697 HydrophobicContact CZ-CE 4.37Å; L691-M697 HydrophobicContact CD2-SD 4.45Å; L691-M697 WeakPolarHBondContact O-CA 3.36Å; L691-M697 VanDerWaalsContact O-CB 3.28Å; L691-M697 WeakPolarHBondContact O-CB 3.34Å; L691-M697 PolarHBondContact O-N 3.2Å; L695-M697 PolarHBondContact O-N 2.99Å; M697-H702 HydrophobicContact CG-CB 3.83Å; M697-H702 VanDerWaalsContact SD-C 3.51Å; M697-H702 HydrophobicContact SD-CB 4.1Å; M697-R703 HydrophobicContact CB-CG 4.33Å; M697-R703 HydrophobicContact CG-CG 3.78Å; M697-R703 PolarHBondContact O-NH1 2.89Å; M697-R703 HydrophobicContact SD-CB 4.28Å; M697-R703 HydrophobicContact SD-CG 3.69Å; M697-L706 HydrophobicContact CE-CB 4.35Å; M697-L706 HydrophobicContact CE-CD2 4.14Å; M697-L706 HydrophobicContact SD-CB 4.21Å; M697-L706 HydrophobicContact SD-CD2 4.1Å
698	V	96.4	Very high	97.1	Very high	107 Å²	107	56.7 Å²	56.7	65%	0.648	28%	0.279	S	S	*	.			trans	-70.4	-34.2	179.9	178.4	0	0	0	0	111.8	K696 R703	K696-V698 VanDerWaalsContact C-N 3.26Å; K696-V698 PolarHBondContact O-N 3.2Å; V698-R703 VanDerWaalsContact O-CZ 3.26Å; V698-R703 PolarHBondContact O-NH1 2.92Å; V698-R703 PolarHBondContact O-NH2 3.39Å
699	D	96.5	Very high	97.2	Very high	72 Å²	72	50.3 Å²	50.3	39%	0.385	25%	0.251	S	S	.	.			trans	-61	143.8	177.7	-155.8	-49.8	0	0	0	112.5	F701 H702 R703	D699-F701 WeakPolarHBondContact OD1-CB 3.37Å; D699-F701 PolarHBondContact OD1-N 3.34Å; D699-H702 HydrophobicContact CB-CB 4.14Å; D699-R703 VanDerWaalsContact C-NH2 3.31Å; D699-R703 WeakPolarHBondContact O-CG 3.47Å; D699-R703 PolarHBondContact O-NE 3.09Å; D699-R703 PolarHBondContact O-NH1 3.25Å; D699-R703 PolarHBondContact O-NH2 2.67Å; D699-R703 VanDerWaalsContact O-NH2 3.11Å
700	S	95.8	Very high	97.2	Very high	78 Å²	78	43.7 Å²	43.7	55%	0.545	22%	0.223	S	C	.	.	H	α-helix	trans	-73.7	-43	171.9	-33.3	0	0	0	0	112	R703 T704	S700-R703 VanDerWaalsContact CA-NH2 3.29Å; S700-R703 PolarHBondContact O-N 2.96Å; S700-T704 PolarHBondContact O-N 3.49Å; S700-T704 PolarHBondContact O-OG1 3.07Å
701	F	96.9	Very high	97.1	Very high	52 Å²	52	44.6 Å²	44.6	23%	0.228	23%	0.227	C	C	.	.	H	α-helix	trans	-66.9	-44.7	-174.9	-174.1	-117.8	0	0	0	110.9	D699 R703 T704 S705 S764 V766 L770 F777 V785	D699-F701 WeakPolarHBondContact OD1-CB 3.37Å; D699-F701 PolarHBondContact OD1-N 3.34Å; F701-R703 VanDerWaalsContact C-N 3.3Å; F701-R703 PolarHBondContact O-N 3.47Å; F701-T704 CarbonylContact O-C 3.38Å; F701-T704 WeakPolarHBondContact O-CB 3.42Å; F701-T704 PolarHBondContact O-N 2.93Å; F701-T704 VanDerWaalsContact O-N 3.08Å; F701-S705 WeakPolarHBondContact O-CB 3.42Å; F701-S705 PolarHBondContact O-N 3.11Å; F701-S764 WeakPolarHBondContact CD1-O 3.48Å; F701-S764 WeakPolarHBondContact CE1-O 3.45Å; F701-V766 HydrophobicContact CE1-CG2 4.12Å; F701-V766 HydrophobicContact CZ-CG2 4.08Å; F701-L770 HydrophobicContact CE2-CD2 3.92Å; F701-L770 HydrophobicContact CZ-CD2 3.59Å; F701-F777 HydrophobicContact CE2-CD2 4.04Å; F701-F777 AromaticContact CE2-CE2 3.82Å; F701-F777 HydrophobicContact CE2-CE2 3.82Å; F701-F777 HydrophobicContact CZ-CD2 4.27Å; F701-F777 AromaticContact CZ-CE2 3.61Å; F701-F777 HydrophobicContact CZ-CE2 3.61Å; F701-F777 HydrophobicContact CZ-CZ 4.48Å; F701-V785 HydrophobicContact CE1-CG2 4.37Å; F701-V785 HydrophobicContact CZ-CG2 4.49Å
702	H	98.3	Very high	97	Very high	22 Å²	22	44 Å²	44	10%	0.102	23%	0.225	C	C	.	.	H	α-helix	trans	-62.5	-34.5	175.3	-58.8	158.9	0	0	0	112.8	L666 Y669 M697 D699 L706 E763 S764	L666-H702 HydrophobicContact CD2-CB 3.79Å; Y669-H702 HydrophobicContact CE2-CB 3.98Å; Y669-H702 AromaticContact CE2-CG 3.96Å; Y669-H702 AromaticContact CE2-ND1 3.53Å; Y669-H702 AromaticContact CZ-ND1 3.7Å; Y669-H702 PolarHBondContact OH-ND1 2.79Å; M697-H702 HydrophobicContact CG-CB 3.83Å; M697-H702 VanDerWaalsContact SD-C 3.51Å; M697-H702 HydrophobicContact SD-CB 4.1Å; D699-H702 HydrophobicContact CB-CB 4.14Å; H702-L706 WeakPolarHBondContact O-CB 3.36Å; H702-L706 PolarHBondContact O-N 3.43Å; H702-E763 PolarHBondContact NE2-O 3.35Å; H702-S764 PolarHBondContact CD2-O 2.94Å
703	R	97.9	Very high	96.9	Very high	30 Å²	30	39 Å²	39	11%	0.113	21%	0.206	C	C	.	.	H	α-helix	trans	-67.9	-38.5	171.9	-71.8	-175.5	-63.5	-99	-9.6	112.6	L691 R692 M697 V698 D699 S700 F701 Q707	L691-R703 HydrophobicContact CB-CG 4.35Å; L691-R703 HydrophobicContact CD1-CG 4.22Å; R692-R703 VanDerWaalsContact CG-NH1 3.27Å; M697-R703 HydrophobicContact CB-CG 4.33Å; M697-R703 HydrophobicContact CG-CG 3.78Å; M697-R703 PolarHBondContact O-NH1 2.89Å; M697-R703 HydrophobicContact SD-CB 4.28Å; M697-R703 HydrophobicContact SD-CG 3.69Å; V698-R703 VanDerWaalsContact O-CZ 3.26Å; V698-R703 PolarHBondContact O-NH1 2.92Å; V698-R703 PolarHBondContact O-NH2 3.39Å; D699-R703 VanDerWaalsContact C-NH2 3.31Å; D699-R703 WeakPolarHBondContact O-CG 3.47Å; D699-R703 PolarHBondContact O-NE 3.09Å; D699-R703 PolarHBondContact O-NH1 3.25Å; D699-R703 PolarHBondContact O-NH2 2.67Å; D699-R703 VanDerWaalsContact O-NH2 3.11Å; S700-R703 VanDerWaalsContact CA-NH2 3.29Å; S700-R703 PolarHBondContact O-N 2.96Å; F701-R703 VanDerWaalsContact C-N 3.3Å; F701-R703 PolarHBondContact O-N 3.47Å; R703-Q707 WeakPolarHBondContact O-CB 3.48Å; R703-Q707 PolarHBondContact O-N 3.49Å
704	T	96.9	Very high	96.8	Very high	53 Å²	53	39.3 Å²	39.3	33%	0.325	20%	0.201	S	C	.	.	H	α-helix	trans	-65.7	-45.7	174.5	-62.8	0	0	0	0	110.9	S700 F701 Q707 Y708 L770	S700-T704 PolarHBondContact O-N 3.49Å; S700-T704 PolarHBondContact O-OG1 3.07Å; F701-T704 CarbonylContact O-C 3.38Å; F701-T704 WeakPolarHBondContact O-CB 3.42Å; F701-T704 PolarHBondContact O-N 2.93Å; F701-T704 VanDerWaalsContact O-N 3.08Å; T704-Q707 WeakPolarHBondContact O-CB 3.17Å; T704-Q707 PolarHBondContact O-N 2.84Å; T704-Q707 VanDerWaalsContact O-N 3.17Å; T704-Y708 HydrophobicContact CG2-CD2 3.8Å; T704-Y708 HydrophobicContact CG2-CE2 3.53Å; T704-Y708 WeakPolarHBondContact O-CD2 3.36Å; T704-Y708 PolarHBondContact O-N 2.79Å; T704-L770 HydrophobicContact CG2-CD1 4.48Å
705	S	98.3	Very high	96.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-53.8	-54.5	172.1	164.1	0	0	0	0	111.6	F701 Q707 Y708 G709 G765 H767	F701-S705 WeakPolarHBondContact O-CB 3.42Å; F701-S705 PolarHBondContact O-N 3.11Å; S705-Q707 VanDerWaalsContact C-N 3.26Å; S705-Q707 PolarHBondContact O-N 2.74Å; S705-Y708 PolarHBondContact O-N 2.86Å; S705-G709 PolarHBondContact O-N 3.39Å; S705-G765 VanDerWaalsContact CB-O 3.29Å; S705-G765 WeakPolarHBondContact CB-O 3.37Å; S705-G765 PolarHBondContact OG-O 3.4Å; S705-H767 PolarHBondContact O-CE1 2.87Å; S705-H767 VanDerWaalsContact O-CE1 3.26Å; S705-H767 PolarHBondContact OG-CE1 3Å; S705-H767 PolarHBondContact OG-ND1 3Å
706	L	98.4	Very high	96.2	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-55.4	-42	176.6	-174.3	75	0	0	0	111.6	W660 L661 L664 L666 F673 L691 M697 H702 Y708 G709 I710	W660-L706 HydrophobicContact CH2-CD1 3.69Å; W660-L706 HydrophobicContact CZ3-CD1 3.71Å; L661-L706 HydrophobicContact CD1-CD1 3.93Å; L664-L706 HydrophobicContact CD1-CD1 4.11Å; L666-L706 HydrophobicContact CD1-CB 4.25Å; L666-L706 HydrophobicContact CD1-CD1 4.47Å; F673-L706 HydrophobicContact CE1-CD1 4.37Å; F673-L706 HydrophobicContact CZ-CD1 4.13Å; F673-L706 HydrophobicContact CZ-CD2 3.93Å; L691-L706 HydrophobicContact CD2-CD2 3.41Å; L691-L706 VanDerWaalsContact CD2-CD2 3.41Å; M697-L706 HydrophobicContact CE-CB 4.35Å; M697-L706 HydrophobicContact CE-CD2 4.14Å; M697-L706 HydrophobicContact SD-CB 4.21Å; M697-L706 HydrophobicContact SD-CD2 4.1Å; H702-L706 WeakPolarHBondContact O-CB 3.36Å; H702-L706 PolarHBondContact O-N 3.43Å; L706-Y708 VanDerWaalsContact C-N 3.33Å; L706-Y708 PolarHBondContact O-N 2.78Å; L706-G709 PolarHBondContact O-N 2.94Å; L706-I710 HydrophobicContact CD2-CD1 4.47Å; L706-I710 HydrophobicContact CG-CD1 4.07Å; L706-I710 VanDerWaalsContact O-CG1 3.24Å; L706-I710 WeakPolarHBondContact O-CG1 3.48Å; L706-I710 PolarHBondContact O-N 3.38Å
707	Q	97.6	Very high	95.8	Very high	77 Å²	77	42.8 Å²	42.8	36%	0.36	22%	0.216	S	C	.	.	H	α-helix	trans	-61.3	-38.2	177.8	-175.8	62	82.5	0	0	112.7	R703 T704 S705 I710 M711	R703-Q707 WeakPolarHBondContact O-CB 3.48Å; R703-Q707 PolarHBondContact O-N 3.49Å; T704-Q707 WeakPolarHBondContact O-CB 3.17Å; T704-Q707 PolarHBondContact O-N 2.84Å; T704-Q707 VanDerWaalsContact O-N 3.17Å; S705-Q707 VanDerWaalsContact C-N 3.26Å; S705-Q707 PolarHBondContact O-N 2.74Å; Q707-I710 PolarHBondContact O-N 2.93Å; Q707-M711 HydrophobicContact CG-SD 4.47Å; Q707-M711 VanDerWaalsContact O-CG 3.31Å; Q707-M711 WeakPolarHBondContact O-CG 3.45Å; Q707-M711 PolarHBondContact O-N 3.47Å
708	Y	98	Very high	95.5	Very high	29 Å²	29	44.2 Å²	44.2	11%	0.114	22%	0.222	C	C	.	.	H	α-helix	trans	-73.9	-36.6	175.3	-75.8	-64.7	0	0	0	112.9	T704 S705 L706 I710 M711 C712 L770 L773 D774	T704-Y708 HydrophobicContact CG2-CD2 3.8Å; T704-Y708 HydrophobicContact CG2-CE2 3.53Å; T704-Y708 WeakPolarHBondContact O-CD2 3.36Å; T704-Y708 PolarHBondContact O-N 2.79Å; S705-Y708 PolarHBondContact O-N 2.86Å; L706-Y708 VanDerWaalsContact C-N 3.33Å; L706-Y708 PolarHBondContact O-N 2.78Å; Y708-I710 VanDerWaalsContact C-N 3.32Å; Y708-I710 PolarHBondContact O-N 2.9Å; Y708-M711 HydrophobicContact CD1-CE 4.19Å; Y708-M711 HydrophobicContact CD1-SD 3.9Å; Y708-M711 HydrophobicContact CE1-CE 4.1Å; Y708-M711 HydrophobicContact CE1-SD 4.07Å; Y708-M711 WeakPolarHBondContact O-CB 3.48Å; Y708-M711 PolarHBondContact O-N 3.36Å; Y708-M711 VanDerWaalsContact O-N 3.13Å; Y708-C712 PolarHBondContact O-N 2.92Å; Y708-L770 HydrophobicContact CD2-CD1 3.56Å; Y708-L770 HydrophobicContact CE2-CD1 4.04Å; Y708-L770 HydrophobicContact CG-CD1 4.4Å; Y708-L773 HydrophobicContact CD1-CB 3.42Å; Y708-L773 VanDerWaalsContact CD1-CB 3.42Å; Y708-L773 HydrophobicContact CD1-CD1 4Å; Y708-L773 HydrophobicContact CD1-CG 4.35Å; Y708-L773 HydrophobicContact CE1-CB 3.56Å; Y708-L773 WeakPolarHBondContact CE1-O 3.45Å; Y708-L773 HydrophobicContact CG-CB 4.45Å; Y708-D774 HydrophobicContact CD2-CB 4.25Å; Y708-D774 HydrophobicContact CE1-CB 4.33Å; Y708-D774 HydrophobicContact CE2-CB 3.55Å; Y708-D774 WeakPolarHBondContact CE2-OD2 3.47Å
709	G	97.8	Very high	95.2	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-57.6	-43.6	168.3	0	0	0	0	0	112.3	S705 L706 C712 L713	S705-G709 PolarHBondContact O-N 3.39Å; L706-G709 PolarHBondContact O-N 2.94Å; G709-C712 WeakPolarHBondContact O-CB 3.44Å; G709-C712 PolarHBondContact O-N 3.44Å; G709-L713 PolarHBondContact O-N 3.46Å; G709-L713 VanDerWaalsContact O-N 3.12Å
710	I	97.1	Very high	94.9	Very high	7 Å²	7	42.1 Å²	42.1	4%	0.036	20%	0.202	C	C	.	.	H	α-helix	trans	-63	-41.2	173.7	-66.5	166.5	0	0	0	110.9	W660 L683 L706 Q707 Y708 C712 L713 K714	W660-I710 HydrophobicContact CH2-CG1 3.91Å; W660-I710 HydrophobicContact CZ2-CG1 4.3Å; L683-I710 HydrophobicContact CB-CD1 3.97Å; L683-I710 HydrophobicContact CB-CG1 4Å; L683-I710 HydrophobicContact CD1-CG1 4.2Å; L683-I710 HydrophobicContact CD2-CD1 4.45Å; L683-I710 HydrophobicContact CG-CG1 4.48Å; L706-I710 HydrophobicContact CD2-CD1 4.47Å; L706-I710 HydrophobicContact CG-CD1 4.07Å; L706-I710 VanDerWaalsContact O-CG1 3.24Å; L706-I710 WeakPolarHBondContact O-CG1 3.48Å; L706-I710 PolarHBondContact O-N 3.38Å; Q707-I710 PolarHBondContact O-N 2.93Å; Y708-I710 VanDerWaalsContact C-N 3.32Å; Y708-I710 PolarHBondContact O-N 2.9Å; I710-C712 VanDerWaalsContact C-N 3.3Å; I710-C712 PolarHBondContact O-N 2.81Å; I710-L713 PolarHBondContact O-N 2.91Å; I710-K714 HydrophobicContact CG2-CD 4.44Å; I710-K714 WeakPolarHBondContact O-CG 3.49Å; I710-K714 PolarHBondContact O-N 3.07Å
711	M	94.3	Very high	94.7	Very high	42 Å²	42	45.1 Å²	45.1	21%	0.207	21%	0.205	C	C	.	.	H	α-helix	trans	-64.8	-32.3	176.3	-74.3	170	60.9	0	0	112.8	Q707 Y708 K714 R715 L773 F833	Q707-M711 HydrophobicContact CG-SD 4.47Å; Q707-M711 VanDerWaalsContact O-CG 3.31Å; Q707-M711 WeakPolarHBondContact O-CG 3.45Å; Q707-M711 PolarHBondContact O-N 3.47Å; Y708-M711 HydrophobicContact CD1-CE 4.19Å; Y708-M711 HydrophobicContact CD1-SD 3.9Å; Y708-M711 HydrophobicContact CE1-CE 4.1Å; Y708-M711 HydrophobicContact CE1-SD 4.07Å; Y708-M711 WeakPolarHBondContact O-CB 3.48Å; Y708-M711 PolarHBondContact O-N 3.36Å; Y708-M711 VanDerWaalsContact O-N 3.13Å; M711-K714 PolarHBondContact O-N 3.04Å; M711-R715 WeakPolarHBondContact O-CG 3.3Å; M711-R715 PolarHBondContact O-N 2.96Å; M711-L773 HydrophobicContact CB-CD1 4Å; M711-L773 HydrophobicContact CE-CD1 4.43Å; M711-F833 HydrophobicContact CE-CE1 4.27Å; M711-F833 HydrophobicContact SD-CE1 3.98Å
712	C	96	Very high	94.5	Very high	9 Å²	9	45.7 Å²	45.7	6%	0.061	21%	0.208	C	C	.	.	H	α-helix	trans	-64.6	-50.3	171.1	-174.6	0	0	0	0	111.5	Y708 G709 I710 K714 R715 L716 L738 A769	Y708-C712 PolarHBondContact O-N 2.92Å; G709-C712 WeakPolarHBondContact O-CB 3.44Å; G709-C712 PolarHBondContact O-N 3.44Å; I710-C712 VanDerWaalsContact C-N 3.3Å; I710-C712 PolarHBondContact O-N 2.81Å; C712-K714 VanDerWaalsContact C-N 3.28Å; C712-K714 PolarHBondContact O-N 3.13Å; C712-R715 PolarHBondContact O-N 3.33Å; C712-R715 VanDerWaalsContact O-N 3.1Å; C712-L716 PolarHBondContact O-N 3.06Å; C712-L738 HydrophobicContact CB-CD1 4.16Å; C712-L738 PolarHBondContact SG-O 3.01Å; C712-A769 HydrophobicContact CB-CB 3.64Å
713	L	94.7	Very high	94.3	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-55.9	-42.4	174.3	-65.1	-172	0	0	0	112.2	M651 W655 W660 L683 G709 I710 L716 N717 Y718 L723	M651-L713 HydrophobicContact CE-CD1 3.83Å; M651-L713 HydrophobicContact CE-CD2 3.79Å; M651-L713 HydrophobicContact CE-CG 4.35Å; W655-L713 HydrophobicContact CH2-CD2 4.23Å; W660-L713 HydrophobicContact CD2-CD1 4.37Å; W660-L713 HydrophobicContact CZ2-CD1 3.63Å; W660-L713 HydrophobicContact CZ2-CG 4.08Å; L683-L713 HydrophobicContact CD1-CD1 3.81Å; G709-L713 PolarHBondContact O-N 3.46Å; G709-L713 VanDerWaalsContact O-N 3.12Å; I710-L713 PolarHBondContact O-N 2.91Å; L713-L716 CarbonylContact O-C 3.58Å; L713-L716 PolarHBondContact O-N 2.87Å; L713-N717 PolarHBondContact O-N 2.63Å; L713-Y718 HydrophobicContact CB-CD1 3.78Å; L713-Y718 HydrophobicContact CB-CE1 3.77Å; L713-Y718 HydrophobicContact CB-CG 4.37Å; L713-Y718 HydrophobicContact CD1-CD1 4.06Å; L713-Y718 HydrophobicContact CD1-CE1 4.01Å; L713-Y718 PolarHBondContact O-N 3.2Å; L713-L723 HydrophobicContact CD2-CD2 3.76Å
714	K	92.2	Very high	94.1	Very high	76 Å²	76	47 Å²	47	33%	0.33	22%	0.216	S	C	.	.	H	α-helix	trans	-62.6	-41.9	175.8	-73.7	-175.6	-176	-164.9	0	113.3	D684 I710 M711 C712 L716 N717 Y718	D684-K714 VanDerWaalsContact CG-CE 3.4Å; D684-K714 VanDerWaalsContact OD1-CE 3.31Å; D684-K714 WeakPolarHBondContact OD1-CE 3.19Å; D684-K714 IonicContact OD1-NZ 2.74Å; D684-K714 PolarHBondContact OD1-NZ 3.14Å; D684-K714 VanDerWaalsContact OD2-CE 3.26Å; D684-K714 WeakPolarHBondContact OD2-CE 3.1Å; D684-K714 IonicContact OD2-NZ 3.46Å; D684-K714 PolarHBondContact OD2-NZ 2.73Å; I710-K714 HydrophobicContact CG2-CD 4.44Å; I710-K714 WeakPolarHBondContact O-CG 3.49Å; I710-K714 PolarHBondContact O-N 3.07Å; M711-K714 PolarHBondContact O-N 3.04Å; C712-K714 VanDerWaalsContact C-N 3.28Å; C712-K714 PolarHBondContact O-N 3.13Å; K714-L716 PolarHBondContact O-N 3.42Å; K714-N717 PolarHBondContact O-N 3.4Å; K714-N717 VanDerWaalsContact O-N 3.08Å; K714-Y718 HydrophobicContact CG-CE2 3.74Å
715	R	92.4	Very high	94.1	Very high	140 Å²	140	48.5 Å²	48.5	53%	0.528	22%	0.218	S	C	.	.	H	α-helix	trans	-63.9	-29.2	175.6	-79.4	-174.7	174.8	-151	2.5	112.2	M711 C712 N717 L738	M711-R715 WeakPolarHBondContact O-CG 3.3Å; M711-R715 PolarHBondContact O-N 2.96Å; C712-R715 PolarHBondContact O-N 3.33Å; C712-R715 VanDerWaalsContact O-N 3.1Å; R715-N717 VanDerWaalsContact C-N 3.32Å; R715-L738 HydrophobicContact CB-CD2 4.48Å
716	L	90.1	Very high	93.9	Very high	12 Å²	12	51.5 Å²	51.5	6%	0.063	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	13.3	174.3	-61	172.3	0	0	0	113.1	C712 L713 K714 Y718 D719 L723 V739	C712-L716 PolarHBondContact O-N 3.06Å; L713-L716 CarbonylContact O-C 3.58Å; L713-L716 PolarHBondContact O-N 2.87Å; K714-L716 PolarHBondContact O-N 3.42Å; L716-Y718 PolarHBondContact O-N 2.7Å; L716-D719 WeakPolarHBondContact O-CB 3.33Å; L716-D719 PolarHBondContact O-N 3.39Å; L716-L723 HydrophobicContact CD1-CB 3.78Å; L716-L723 HydrophobicContact CD1-CD1 3.56Å; L716-L723 HydrophobicContact CD1-CG 4.23Å; L716-V739 HydrophobicContact CD1-CG1 4.16Å
717	N	88.1	Confident	93.9	Very high	87 Å²	87	53.2 Å²	53.2	47%	0.465	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	21	-176.9	-72.3	-49	0	0	0	115.5	L713 K714 R715 D719	L713-N717 PolarHBondContact O-N 2.63Å; K714-N717 PolarHBondContact O-N 3.4Å; K714-N717 VanDerWaalsContact O-N 3.08Å; R715-N717 VanDerWaalsContact C-N 3.32Å; N717-D719 VanDerWaalsContact C-N 3.29Å
718	Y	92.1	Very high	93.8	Very high	31 Å²	31	56.6 Å²	56.6	12%	0.122	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	35	-167.7	-58.4	-100.6	0	0	0	113.7	T645 L646 M651 A680 L713 K714 L716 R720	T645-Y718 PolarHBondContact OG1-O 2.87Å; L646-Y718 HydrophobicContact CD1-CD1 3.97Å; L646-Y718 HydrophobicContact CD1-CD2 4.4Å; L646-Y718 HydrophobicContact CD1-CG 3.89Å; L646-Y718 HydrophobicContact CD2-CD1 4.28Å; L646-Y718 HydrophobicContact CD2-CG 4.38Å; L646-Y718 HydrophobicContact CG-CG 4.39Å; M651-Y718 HydrophobicContact CE-CD1 4.06Å; A680-Y718 HydrophobicContact CB-CD1 4.12Å; A680-Y718 HydrophobicContact CB-CE1 4.39Å; A680-Y718 WeakPolarHBondContact O-CE1 3.49Å; L713-Y718 HydrophobicContact CB-CD1 3.78Å; L713-Y718 HydrophobicContact CB-CE1 3.77Å; L713-Y718 HydrophobicContact CB-CG 4.37Å; L713-Y718 HydrophobicContact CD1-CD1 4.06Å; L713-Y718 HydrophobicContact CD1-CE1 4.01Å; L713-Y718 PolarHBondContact O-N 3.2Å; K714-Y718 HydrophobicContact CG-CE2 3.74Å; L716-Y718 PolarHBondContact O-N 2.7Å; Y718-R720 PolarHBondContact O-N 3.06Å
719	D	89.4	Confident	93.5	Very high	63 Å²	63	60.1 Å²	60.1	34%	0.337	27%	0.269	S	S	.	.			trans	-81.7	111.1	163.4	-166	-39.5	0	0	0	110	L716 N717 K721 E722 L723	L716-D719 WeakPolarHBondContact O-CB 3.33Å; L716-D719 PolarHBondContact O-N 3.39Å; N717-D719 VanDerWaalsContact C-N 3.29Å; D719-K721 WeakPolarHBondContact OD1-CA 3.46Å; D719-K721 WeakPolarHBondContact OD1-CB 3.46Å; D719-K721 PolarHBondContact OD1-N 3.14Å; D719-E722 HydrophobicContact CB-CB 4.06Å; D719-E722 PolarHBondContact OD1-N 3.25Å; D719-L723 PolarHBondContact O-N 2.9Å
720	R	91.4	Very high	93.3	Very high	72 Å²	72	60.1 Å²	60.1	27%	0.272	27%	0.269	S	S	.	.	H	α-helix	trans	-67	-38.4	176.5	176.9	178.1	164.4	171.1	4.3	112.6	D650 M651 W655 Y718 L723 E724	D650-R720 WeakPolarHBondContact O-CD 3.3Å; D650-R720 PolarHBondContact O-NH1 2.61Å; M651-R720 HydrophobicContact CG-CB 3.78Å; M651-R720 HydrophobicContact CG-CG 4.33Å; M651-R720 HydrophobicContact SD-CB 3.97Å; W655-R720 HydrophobicContact CZ2-CG 4.13Å; W655-R720 VanDerWaalsContact NE1-CZ 3.33Å; Y718-R720 PolarHBondContact O-N 3.06Å; R720-L723 WeakPolarHBondContact O-CB 3.39Å; R720-L723 PolarHBondContact O-N 2.98Å; R720-E724 HydrophobicContact CG-CG 4.43Å; R720-E724 IonicContact CZ-OE1 3.49Å; R720-E724 VanDerWaalsContact CZ-OE1 3.24Å; R720-E724 IonicContact NE-OE1 3.82Å; R720-E724 PolarHBondContact NE-OE1 3.47Å; R720-E724 IonicContact NE-OE2 3.37Å; R720-E724 PolarHBondContact NE-OE2 2.86Å; R720-E724 IonicContact NH2-OE1 3.15Å; R720-E724 PolarHBondContact NH2-OE1 3.28Å; R720-E724 WeakPolarHBondContact O-CB 3.47Å; R720-E724 WeakPolarHBondContact O-CG 3.47Å; R720-E724 PolarHBondContact O-N 2.63Å
721	K	90.8	Very high	93	Very high	141 Å²	141	63.7 Å²	63.7	61%	0.613	29%	0.285	S	S	*	.	H	α-helix	trans	-74	-38.5	-174.4	-66.2	171.3	-175.6	162.8	0	110.7	D719 E724 K725	D719-K721 WeakPolarHBondContact OD1-CA 3.46Å; D719-K721 WeakPolarHBondContact OD1-CB 3.46Å; D719-K721 PolarHBondContact OD1-N 3.14Å; K721-E724 PolarHBondContact O-N 3.21Å; K721-K725 WeakPolarHBondContact O-CB 3.5Å; K721-K725 PolarHBondContact O-N 3.02Å
722	E	92.5	Very high	92.6	Very high	64 Å²	64	70 Å²	70	30%	0.299	31%	0.314	S	S	.	.	H	α-helix	trans	-69.3	-33.1	173.4	-173	59.3	-164.6	0	0	111.9	D719 K725 R726	D719-E722 HydrophobicContact CB-CB 4.06Å; D719-E722 PolarHBondContact OD1-N 3.25Å; E722-K725 VanDerWaalsContact CD-NZ 3.25Å; E722-K725 IonicContact OE1-NZ 3.6Å; E722-K725 PolarHBondContact OE1-NZ 3.07Å; E722-K725 WeakPolarHBondContact OE2-CD 3.36Å; E722-K725 IonicContact OE2-NZ 2.77Å; E722-K725 PolarHBondContact OE2-NZ 2.93Å; E722-R726 HydrophobicContact CG-CG 4.4Å; E722-R726 VanDerWaalsContact O-CB 3.31Å; E722-R726 WeakPolarHBondContact O-CB 3.14Å; E722-R726 VanDerWaalsContact O-CG 3.23Å; E722-R726 WeakPolarHBondContact O-CG 3.42Å; E722-R726 PolarHBondContact O-N 2.65Å; E722-R726 VanDerWaalsContact OE1-CD 3.3Å; E722-R726 WeakPolarHBondContact OE1-CD 3.22Å; E722-R726 WeakPolarHBondContact OE1-CG 3.47Å
723	L	94.5	Very high	92.3	Very high	1 Å²	1	75.2 Å²	75.2	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-62.5	-49.3	169.4	175	64.7	0	0	0	112.1	W655 L713 L716 D719 R720 R727 V739	W655-L723 HydrophobicContact CH2-CD2 3.96Å; W655-L723 HydrophobicContact CZ2-CD2 4.03Å; L713-L723 HydrophobicContact CD2-CD2 3.76Å; L716-L723 HydrophobicContact CD1-CB 3.78Å; L716-L723 HydrophobicContact CD1-CD1 3.56Å; L716-L723 HydrophobicContact CD1-CG 4.23Å; D719-L723 PolarHBondContact O-N 2.9Å; R720-L723 WeakPolarHBondContact O-CB 3.39Å; R720-L723 PolarHBondContact O-N 2.98Å; L723-R727 HydrophobicContact CD1-CG 4.39Å; L723-R727 WeakPolarHBondContact O-CB 3.35Å; L723-R727 VanDerWaalsContact O-CG 3.27Å; L723-R727 WeakPolarHBondContact O-CG 3.47Å; L723-R727 PolarHBondContact O-N 2.96Å; L723-R727 VanDerWaalsContact O-N 3.12Å; L723-V739 HydrophobicContact CD1-CB 4.24Å; L723-V739 HydrophobicContact CD1-CG1 4.38Å
724	E	94.5	Very high	92.1	Very high	77 Å²	77	78 Å²	78	36%	0.36	35%	0.351	S	S	.	.	H	α-helix	trans	-63.8	-46.3	-179.7	-73.7	168.4	163.3	0	0	111	R720 K721 R727 E728	R720-E724 HydrophobicContact CG-CG 4.43Å; R720-E724 IonicContact CZ-OE1 3.49Å; R720-E724 VanDerWaalsContact CZ-OE1 3.24Å; R720-E724 IonicContact NE-OE1 3.82Å; R720-E724 PolarHBondContact NE-OE1 3.47Å; R720-E724 IonicContact NE-OE2 3.37Å; R720-E724 PolarHBondContact NE-OE2 2.86Å; R720-E724 IonicContact NH2-OE1 3.15Å; R720-E724 PolarHBondContact NH2-OE1 3.28Å; R720-E724 WeakPolarHBondContact O-CB 3.47Å; R720-E724 WeakPolarHBondContact O-CG 3.47Å; R720-E724 PolarHBondContact O-N 2.63Å; K721-E724 PolarHBondContact O-N 3.21Å; E724-R727 WeakPolarHBondContact O-CB 3.43Å; E724-R727 PolarHBondContact O-N 3.35Å; E724-E728 PolarHBondContact O-N 2.89Å; E724-E728 VanDerWaalsContact O-N 3.07Å
725	K	95.4	Very high	92.2	Very high	85 Å²	85	77.9 Å²	77.9	37%	0.37	35%	0.351	S	S	.	.	H	α-helix	trans	-58.4	-50.5	174.8	169.4	176.6	152.6	-71.4	0	112.9	K721 E722 R727 E728 E729	K721-K725 WeakPolarHBondContact O-CB 3.5Å; K721-K725 PolarHBondContact O-N 3.02Å; E722-K725 VanDerWaalsContact CD-NZ 3.25Å; E722-K725 IonicContact OE1-NZ 3.6Å; E722-K725 PolarHBondContact OE1-NZ 3.07Å; E722-K725 WeakPolarHBondContact OE2-CD 3.36Å; E722-K725 IonicContact OE2-NZ 2.77Å; E722-K725 PolarHBondContact OE2-NZ 2.93Å; K725-R727 VanDerWaalsContact C-N 3.29Å; K725-R727 PolarHBondContact O-N 3.44Å; K725-E728 PolarHBondContact O-N 3.37Å; K725-E728 VanDerWaalsContact O-N 3.14Å; K725-E729 WeakPolarHBondContact CE-OE1 3.46Å; K725-E729 HydrophobicContact CG-CG 4.47Å; K725-E729 WeakPolarHBondContact CG-OE1 3.47Å; K725-E729 IonicContact NZ-OE1 2.78Å; K725-E729 PolarHBondContact NZ-OE1 3.32Å; K725-E729 WeakPolarHBondContact O-CG 3.48Å; K725-E729 PolarHBondContact O-N 2.93Å
726	R	95.7	Very high	92.2	Very high	63 Å²	63	73.3 Å²	73.3	24%	0.238	34%	0.337	C	S	.	.	H	α-helix	trans	-63.9	-35.3	-179.2	-73.3	170.9	63.8	151.1	-0.8	112.1	E722 E729 S730 D736 V739	E722-R726 HydrophobicContact CG-CG 4.4Å; E722-R726 VanDerWaalsContact O-CB 3.31Å; E722-R726 WeakPolarHBondContact O-CB 3.14Å; E722-R726 VanDerWaalsContact O-CG 3.23Å; E722-R726 WeakPolarHBondContact O-CG 3.42Å; E722-R726 PolarHBondContact O-N 2.65Å; E722-R726 VanDerWaalsContact OE1-CD 3.3Å; E722-R726 WeakPolarHBondContact OE1-CD 3.22Å; E722-R726 WeakPolarHBondContact OE1-CG 3.47Å; R726-E729 PolarHBondContact O-N 3.02Å; R726-S730 WeakPolarHBondContact O-CB 3.45Å; R726-S730 PolarHBondContact O-N 3.3Å; R726-S730 PolarHBondContact O-OG 3.28Å; R726-D736 IonicContact CZ-OD1 2.93Å; R726-D736 IonicContact CZ-OD2 3.15Å; R726-D736 IonicContact NE-OD2 3.61Å; R726-D736 PolarHBondContact NE-OD2 3.05Å; R726-D736 IonicContact NH2-OD1 3.15Å; R726-D736 PolarHBondContact NH2-OD1 2.8Å; R726-D736 IonicContact NH2-OD2 3.11Å; R726-D736 PolarHBondContact NH2-OD2 3.12Å; R726-V739 HydrophobicContact CB-CB 4.48Å; R726-V739 HydrophobicContact CB-CG1 4.1Å; R726-V739 HydrophobicContact CB-CG2 3.98Å
727	R	96.6	Very high	92.6	Very high	38 Å²	38	72.7 Å²	72.7	14%	0.143	33%	0.334	C	S	.	.	H	α-helix	trans	-64.1	-37.7	173.1	-78	172.4	166.5	-170	-6	113	S663 L723 E724 K725 S730 Q731 V739	S663-R727 PolarHBondContact OG-NH1 2.99Å; S663-R727 PolarHBondContact OG-NH2 3.47Å; L723-R727 HydrophobicContact CD1-CG 4.39Å; L723-R727 WeakPolarHBondContact O-CB 3.35Å; L723-R727 VanDerWaalsContact O-CG 3.27Å; L723-R727 WeakPolarHBondContact O-CG 3.47Å; L723-R727 PolarHBondContact O-N 2.96Å; L723-R727 VanDerWaalsContact O-N 3.12Å; E724-R727 WeakPolarHBondContact O-CB 3.43Å; E724-R727 PolarHBondContact O-N 3.35Å; K725-R727 VanDerWaalsContact C-N 3.29Å; K725-R727 PolarHBondContact O-N 3.44Å; R727-S730 PolarHBondContact O-OG 3.33Å; R727-Q731 WeakPolarHBondContact O-CG 3.47Å; R727-Q731 PolarHBondContact O-NE2 2.84Å; R727-V739 HydrophobicContact CG-CB 4.06Å; R727-V739 HydrophobicContact CG-CG2 4.01Å; R727-V739 WeakPolarHBondContact CG-O 3.21Å; R727-V739 PolarHBondContact NE-O 2.75Å
728	E	95.3	Very high	93	Very high	149 Å²	149	69.4 Å²	69.4	70%	0.696	32%	0.316	S	S	*	.	H	α-helix	trans	-69.1	-48.3	174.3	-174.5	173.9	-157.4	0	0	111	E724 K725 S730 Q731	E724-E728 PolarHBondContact O-N 2.89Å; E724-E728 VanDerWaalsContact O-N 3.07Å; K725-E728 PolarHBondContact O-N 3.37Å; K725-E728 VanDerWaalsContact O-N 3.14Å; E728-S730 PolarHBondContact O-N 3.11Å; E728-Q731 WeakPolarHBondContact O-CG 3.33Å; E728-Q731 PolarHBondContact O-N 2.57Å
729	E	93.4	Very high	93.2	Very high	102 Å²	102	68 Å²	68	48%	0.477	31%	0.311	S	S	.	.	H	α-helix	trans	-58.2	-32.2	177	-72.8	175.2	-170.3	0	0	112.5	K725 R726 K735	K725-E729 WeakPolarHBondContact CE-OE1 3.46Å; K725-E729 HydrophobicContact CG-CG 4.47Å; K725-E729 WeakPolarHBondContact CG-OE1 3.47Å; K725-E729 IonicContact NZ-OE1 2.78Å; K725-E729 PolarHBondContact NZ-OE1 3.32Å; K725-E729 WeakPolarHBondContact O-CG 3.48Å; K725-E729 PolarHBondContact O-N 2.93Å; R726-E729 PolarHBondContact O-N 3.02Å; E729-K735 WeakPolarHBondContact O-CE 3.45Å; E729-K735 PolarHBondContact O-NZ 2.85Å
730	S	93.4	Very high	93.6	Very high	1 Å²	1	65.3 Å²	65.3	1%	0.007	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-0.3	-179.3	79.4	0	0	0	0	115.8	R726 R727 E728 H732	R726-S730 WeakPolarHBondContact O-CB 3.45Å; R726-S730 PolarHBondContact O-N 3.3Å; R726-S730 PolarHBondContact O-OG 3.28Å; R727-S730 PolarHBondContact O-OG 3.33Å; E728-S730 PolarHBondContact O-N 3.11Å; S730-H732 VanDerWaalsContact C-N 3.32Å; S730-H732 PolarHBondContact O-N 2.84Å
731	Q	89.3	Confident	94	Very high	82 Å²	82	62.9 Å²	62.9	38%	0.383	29%	0.289	S	S	.	.	S	Bend	trans	-59.6	-39.9	-174.4	-73.5	-60	-68.7	0	0	113.9	R727 E728 Q744	R727-Q731 WeakPolarHBondContact O-CG 3.47Å; R727-Q731 PolarHBondContact O-NE2 2.84Å; E728-Q731 WeakPolarHBondContact O-CG 3.33Å; E728-Q731 PolarHBondContact O-N 2.57Å; Q731-Q744 VanDerWaalsContact CD-OE1 3.25Å; Q731-Q744 PolarHBondContact O-NE2 3.47Å
732	H	87.5	Confident	94.3	Very high	176 Å²	176	56.4 Å²	56.4	82%	0.815	26%	0.261	S	S	*	.	S	Bend	trans	-106.3	-4.9	-164.2	-58.9	97.2	0	0	0	114.4	S730	S730-H732 VanDerWaalsContact C-N 3.32Å; S730-H732 PolarHBondContact O-N 2.84Å
733	E	88.9	Confident	94.6	Very high	117 Å²	117	57.9 Å²	57.9	55%	0.547	27%	0.271	S	S	.	.	S	Bend	trans	-139	144.9	-171.9	-65.4	-177.2	140.6	0	0	110.7	K735	E733-K735 VanDerWaalsContact C-N 3.26Å; E733-K735 HydrophobicContact CB-CD 4.09Å; E733-K735 HydrophobicContact CB-CG 4.27Å; E733-K735 PolarHBondContact O-N 3.06Å; E733-K735 WeakPolarHBondContact OE2-CD 3.36Å; E733-K735 WeakPolarHBondContact OE2-CE 3.49Å; E733-K735 IonicContact OE2-NZ 2.9Å; E733-K735 PolarHBondContact OE2-NZ 3.03Å
734	I	91.3	Very high	94.7	Very high	60 Å²	60	58.3 Å²	58.3	31%	0.308	27%	0.273	S	S	.	.	S	Bend	trans	-76	81.9	174.8	-55	-175.5	0	0	0	109.2	L806 L809	I734-L806 HydrophobicContact CG2-CD1 3.84Å; I734-L809 HydrophobicContact CB-CB 4.46Å; I734-L809 HydrophobicContact CB-CD1 4.37Å; I734-L809 HydrophobicContact CG2-CB 3.9Å; I734-L809 HydrophobicContact CG2-CD1 4.34Å
735	K	93	Very high	94.9	Very high	74 Å²	74	54.7 Å²	54.7	32%	0.322	26%	0.256	S	S	.	.			trans	-147.8	159.2	176.1	71	-171.3	-179.3	-164	0	110.6	E729 E733 V737 W740	E729-K735 WeakPolarHBondContact O-CE 3.45Å; E729-K735 PolarHBondContact O-NZ 2.85Å; E733-K735 VanDerWaalsContact C-N 3.26Å; E733-K735 HydrophobicContact CB-CD 4.09Å; E733-K735 HydrophobicContact CB-CG 4.27Å; E733-K735 PolarHBondContact O-N 3.06Å; E733-K735 WeakPolarHBondContact OE2-CD 3.36Å; E733-K735 WeakPolarHBondContact OE2-CE 3.49Å; E733-K735 IonicContact OE2-NZ 2.9Å; E733-K735 PolarHBondContact OE2-NZ 3.03Å; K735-V737 PolarHBondContact O-N 2.8Å; K735-W740 PolarHBondContact O-NE1 2.72Å
736	D	93.9	Very high	95	Very high	44 Å²	44	51.2 Å²	51.2	24%	0.235	24%	0.242	C	C	.	.			trans	46.8	52.5	175.2	-165.3	23	0	0	0	114.5	R726 L738 V739 W740	R726-D736 IonicContact CZ-OD1 2.93Å; R726-D736 IonicContact CZ-OD2 3.15Å; R726-D736 IonicContact NE-OD2 3.61Å; R726-D736 PolarHBondContact NE-OD2 3.05Å; R726-D736 IonicContact NH2-OD1 3.15Å; R726-D736 PolarHBondContact NH2-OD1 2.8Å; R726-D736 IonicContact NH2-OD2 3.11Å; R726-D736 PolarHBondContact NH2-OD2 3.12Å; D736-L738 PolarHBondContact O-N 3Å; D736-V739 WeakPolarHBondContact O-CG2 3.45Å; D736-V739 PolarHBondContact O-N 3.22Å; D736-W740 VanDerWaalsContact O-CD1 3.29Å
737	V	97	Very high	95.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-61.4	-19.9	-177.1	173.6	0	0	0	0	111.7	K735 V739 W740 G768 L771 L806 G810 T811	K735-V737 PolarHBondContact O-N 2.8Å; V737-V739 PolarHBondContact O-N 2.99Å; V737-V739 VanDerWaalsContact O-N 3.17Å; V737-W740 HydrophobicContact CB-CD2 4.43Å; V737-W740 HydrophobicContact CG1-CD2 4.38Å; V737-W740 HydrophobicContact CG1-CE3 4.45Å; V737-W740 HydrophobicContact CG2-CD2 4.12Å; V737-W740 HydrophobicContact CG2-CE3 4.42Å; V737-W740 HydrophobicContact CG2-CH2 4.3Å; V737-W740 HydrophobicContact CG2-CZ2 3.97Å; V737-W740 PolarHBondContact O-N 2.87Å; V737-G768 CarbonylContact O-C 3.54Å; V737-G768 WeakPolarHBondContact O-CA 3.22Å; V737-L771 HydrophobicContact CG1-CB 4.08Å; V737-L771 HydrophobicContact CG1-CD1 4.33Å; V737-L806 HydrophobicContact CG1-CD1 4.41Å; V737-L806 HydrophobicContact CG2-CD1 3.44Å; V737-L806 VanDerWaalsContact CG2-CD1 3.44Å; V737-L806 HydrophobicContact CG2-CG 4.13Å; V737-G810 PolarHBondContact N-O 2.94Å; V737-T811 HydrophobicContact CB-CG2 3.89Å; V737-T811 HydrophobicContact CG1-CG2 4.27Å; V737-T811 HydrophobicContact CG2-CG2 4.49Å
738	L	96.9	Very high	95.1	Very high	18 Å²	18	51.9 Å²	51.9	9%	0.094	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-51.2	-36	174	175.6	61.3	0	0	0	114.1	C712 R715 D736 A769 A772 L773	C712-L738 HydrophobicContact CB-CD1 4.16Å; C712-L738 PolarHBondContact SG-O 3.01Å; R715-L738 HydrophobicContact CB-CD2 4.48Å; D736-L738 PolarHBondContact O-N 3Å; L738-A769 HydrophobicContact CD1-CB 4.17Å; L738-A769 WeakPolarHBondContact O-CB 3.06Å; L738-A769 PolarHBondContact O-N 3.42Å; L738-A772 HydrophobicContact CB-CB 4.28Å; L738-L773 HydrophobicContact CD1-CD1 3.73Å; L738-L773 HydrophobicContact CD1-CD2 4Å; L738-L773 HydrophobicContact CD1-CG 3.89Å
739	V	97.3	Very high	95.2	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-96.2	-10.9	-174.9	-55.7	0	0	0	0	114.5	L716 L723 R726 R727 D736 V737	L716-V739 HydrophobicContact CD1-CG1 4.16Å; L723-V739 HydrophobicContact CD1-CB 4.24Å; L723-V739 HydrophobicContact CD1-CG1 4.38Å; R726-V739 HydrophobicContact CB-CB 4.48Å; R726-V739 HydrophobicContact CB-CG1 4.1Å; R726-V739 HydrophobicContact CB-CG2 3.98Å; R727-V739 HydrophobicContact CG-CB 4.06Å; R727-V739 HydrophobicContact CG-CG2 4.01Å; R727-V739 WeakPolarHBondContact CG-O 3.21Å; R727-V739 PolarHBondContact NE-O 2.75Å; D736-V739 WeakPolarHBondContact O-CG2 3.45Å; D736-V739 PolarHBondContact O-N 3.22Å; V737-V739 PolarHBondContact O-N 2.99Å; V737-V739 VanDerWaalsContact O-N 3.17Å
740	W	98.1	Very high	95.4	Very high	7 Å²	7	43.2 Å²	43.2	3%	0.027	21%	0.209	C	C	.	.			trans	-56.6	137.9	-172.6	-73.7	20	0	0	0	112.8	K735 D736 V737 Q744 V745 W748 G768 L806	K735-W740 PolarHBondContact O-NE1 2.72Å; D736-W740 VanDerWaalsContact O-CD1 3.29Å; V737-W740 HydrophobicContact CB-CD2 4.43Å; V737-W740 HydrophobicContact CG1-CD2 4.38Å; V737-W740 HydrophobicContact CG1-CE3 4.45Å; V737-W740 HydrophobicContact CG2-CD2 4.12Å; V737-W740 HydrophobicContact CG2-CE3 4.42Å; V737-W740 HydrophobicContact CG2-CH2 4.3Å; V737-W740 HydrophobicContact CG2-CZ2 3.97Å; V737-W740 PolarHBondContact O-N 2.87Å; W740-Q744 HydrophobicContact CB-CB 4.05Å; W740-Q744 HydrophobicContact CB-CG 3.95Å; W740-Q744 HydrophobicContact CD2-CB 4.4Å; W740-Q744 HydrophobicContact CD2-CG 3.43Å; W740-Q744 VanDerWaalsContact CD2-CG 3.43Å; W740-Q744 HydrophobicContact CE3-CB 4.45Å; W740-Q744 HydrophobicContact CE3-CG 3.63Å; W740-Q744 HydrophobicContact CG-CB 4.26Å; W740-Q744 HydrophobicContact CG-CG 3.6Å; W740-Q744 HydrophobicContact CZ3-CG 4.26Å; W740-V745 HydrophobicContact CE3-CG2 4.25Å; W740-W748 HydrophobicContact CH2-CB 4.3Å; W740-W748 HydrophobicContact CH2-CG 4.25Å; W740-W748 HydrophobicContact CZ3-CB 3.74Å; W740-W748 AromaticContact CZ3-CG 3.84Å; W740-W748 HydrophobicContact CZ3-CG 3.84Å; W740-G768 WeakPolarHBondContact O-CA 3.41Å; W740-G768 PolarHBondContact O-N 2.96Å; W740-L806 HydrophobicContact CE3-CD1 4.4Å; W740-L806 HydrophobicContact CH2-CD1 3.5Å; W740-L806 HydrophobicContact CZ2-CD1 4.28Å; W740-L806 HydrophobicContact CZ3-CD1 3.56Å
741	T	98.3	Very high	95.5	Very high	20 Å²	20	47.2 Å²	47.2	12%	0.123	24%	0.236	C	C	.	.			trans	-77.9	167.6	173.9	67.3	0	0	0	0	111.6	S663 D743 Q744 V745	S663-T741 CarbonylContact O-C 3.09Å; S663-T741 VanDerWaalsContact O-CA 3.28Å; S663-T741 WeakPolarHBondContact O-CA 3.5Å; T741-D743 VanDerWaalsContact C-N 3.26Å; T741-D743 PolarHBondContact O-N 2.7Å; T741-D743 PolarHBondContact OG1-N 2.96Å; T741-D743 PolarHBondContact OG1-OD2 3.46Å; T741-Q744 PolarHBondContact O-N 3.4Å; T741-Q744 PolarHBondContact OG1-N 3.21Å; T741-V745 WeakPolarHBondContact O-CG2 3.44Å; T741-V745 PolarHBondContact O-N 2.93Å; T741-V745 VanDerWaalsContact O-N 3.1Å
742	N	98.4	Very high	95.9	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.032	23%	0.225	C	C	.	.	H	α-helix	trans	-53.3	-44.2	166	179.7	-110.8	0	0	0	111.4	S663 G665 Q744 V745 V746 L761 V766	S663-N742 PolarHBondContact O-N 3.48Å; G665-N742 VanDerWaalsContact CA-CG 3.5Å; N742-Q744 VanDerWaalsContact C-N 3.34Å; N742-Q744 PolarHBondContact O-N 3.37Å; N742-V745 PolarHBondContact O-N 3.02Å; N742-V745 VanDerWaalsContact O-N 3.13Å; N742-V746 WeakPolarHBondContact O-CG2 3.42Å; N742-V746 PolarHBondContact O-N 2.9Å; N742-L761 PolarHBondContact ND2-O 2.84Å; N742-V766 PolarHBondContact ND2-O 3.07Å
743	D	97.5	Very high	96.3	Very high	95 Å²	95	38.9 Å²	38.9	51%	0.508	21%	0.213	S	C	.	.	H	α-helix	trans	-61.4	-38.7	177.4	-41.9	-81.4	0	0	0	112.8	T741 V746 H747	T741-D743 VanDerWaalsContact C-N 3.26Å; T741-D743 PolarHBondContact O-N 2.7Å; T741-D743 PolarHBondContact OG1-N 2.96Å; T741-D743 PolarHBondContact OG1-OD2 3.46Å; D743-V746 WeakPolarHBondContact O-CB 3.5Å; D743-V746 PolarHBondContact O-N 3.28Å; D743-H747 WeakPolarHBondContact O-CB 3.49Å; D743-H747 PolarHBondContact O-N 3.49Å
744	Q	97.2	Very high	96.7	Very high	10 Å²	10	33.8 Å²	33.8	5%	0.047	19%	0.189	C	C	.	.	H	α-helix	trans	-65.8	-39.3	175.5	-174.5	68.1	52.4	0	0	111.4	Q731 W740 T741 N742 H747 W748	Q731-Q744 VanDerWaalsContact CD-OE1 3.25Å; Q731-Q744 PolarHBondContact O-NE2 3.47Å; W740-Q744 HydrophobicContact CB-CB 4.05Å; W740-Q744 HydrophobicContact CB-CG 3.95Å; W740-Q744 HydrophobicContact CD2-CB 4.4Å; W740-Q744 HydrophobicContact CD2-CG 3.43Å; W740-Q744 VanDerWaalsContact CD2-CG 3.43Å; W740-Q744 HydrophobicContact CE3-CB 4.45Å; W740-Q744 HydrophobicContact CE3-CG 3.63Å; W740-Q744 HydrophobicContact CG-CB 4.26Å; W740-Q744 HydrophobicContact CG-CG 3.6Å; W740-Q744 HydrophobicContact CZ3-CG 4.26Å; T741-Q744 PolarHBondContact O-N 3.4Å; T741-Q744 PolarHBondContact OG1-N 3.21Å; N742-Q744 VanDerWaalsContact C-N 3.34Å; N742-Q744 PolarHBondContact O-N 3.37Å; Q744-H747 PolarHBondContact O-N 3.42Å; Q744-W748 WeakPolarHBondContact O-CB 3.46Å; Q744-W748 PolarHBondContact O-N 2.92Å
745	V	97.9	Very high	96.9	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-67.9	-40.7	174.2	-178.1	0	0	0	0	110.6	W740 T741 N742 W748 V749 L761 V766 L771	W740-V745 HydrophobicContact CE3-CG2 4.25Å; T741-V745 WeakPolarHBondContact O-CG2 3.44Å; T741-V745 PolarHBondContact O-N 2.93Å; T741-V745 VanDerWaalsContact O-N 3.1Å; N742-V745 PolarHBondContact O-N 3.02Å; N742-V745 VanDerWaalsContact O-N 3.13Å; V745-W748 HydrophobicContact CG1-CE3 4.37Å; V745-W748 PolarHBondContact O-N 3.43Å; V745-V749 WeakPolarHBondContact O-CG2 3.36Å; V745-V749 PolarHBondContact O-N 3.42Å; V745-L761 HydrophobicContact CB-CD1 4.46Å; V745-L761 HydrophobicContact CG1-CD1 3.76Å; V745-V766 HydrophobicContact CG1-CG1 4.2Å; V745-L771 HydrophobicContact CG1-CD1 4.13Å; V745-L771 HydrophobicContact CG2-CD1 3.84Å
746	V	97.9	Very high	97.1	Very high	12 Å²	12	42.5 Å²	42.5	7%	0.073	23%	0.227	C	C	.	.	H	α-helix	trans	-57.7	-48.4	172.7	167.1	0	0	0	0	110.8	N742 D743 W748 V749 Q750 A758 L761	N742-V746 WeakPolarHBondContact O-CG2 3.42Å; N742-V746 PolarHBondContact O-N 2.9Å; D743-V746 WeakPolarHBondContact O-CB 3.5Å; D743-V746 PolarHBondContact O-N 3.28Å; V746-W748 VanDerWaalsContact C-N 3.34Å; V746-W748 PolarHBondContact O-N 3.3Å; V746-V749 PolarHBondContact O-N 2.93Å; V746-Q750 WeakPolarHBondContact O-CG 3.27Å; V746-Q750 PolarHBondContact O-N 2.83Å; V746-A758 HydrophobicContact CG1-CB 4.28Å; V746-L761 HydrophobicContact CG2-CB 3.76Å; V746-L761 HydrophobicContact CG2-CD1 4.08Å; V746-L761 HydrophobicContact CG2-CG 4.44Å
747	H	97.1	Very high	97.2	Very high	108 Å²	108	42.8 Å²	42.8	50%	0.5	23%	0.225	S	C	.	.	H	α-helix	trans	-64.1	-37.8	177.9	-176.9	-115.9	0	0	0	112.2	D743 Q744 Q750 S751	D743-H747 WeakPolarHBondContact O-CB 3.49Å; D743-H747 PolarHBondContact O-N 3.49Å; Q744-H747 PolarHBondContact O-N 3.42Å; H747-Q750 WeakPolarHBondContact O-CB 3.24Å; H747-Q750 PolarHBondContact O-N 3.43Å; H747-S751 PolarHBondContact O-N 3.07Å
748	W	97.5	Very high	97.2	Very high	7 Å²	7	42.8 Å²	42.8	3%	0.027	23%	0.225	C	C	.	.	H	α-helix	trans	-65.2	-43.9	172.8	171.4	79	0	0	0	112.7	W740 Q744 V745 V746 Q750 S751 I752 L782 M799 E802 F803 L806	W740-W748 HydrophobicContact CH2-CB 4.3Å; W740-W748 HydrophobicContact CH2-CG 4.25Å; W740-W748 HydrophobicContact CZ3-CB 3.74Å; W740-W748 AromaticContact CZ3-CG 3.84Å; W740-W748 HydrophobicContact CZ3-CG 3.84Å; Q744-W748 WeakPolarHBondContact O-CB 3.46Å; Q744-W748 PolarHBondContact O-N 2.92Å; V745-W748 HydrophobicContact CG1-CE3 4.37Å; V745-W748 PolarHBondContact O-N 3.43Å; V746-W748 VanDerWaalsContact C-N 3.34Å; V746-W748 PolarHBondContact O-N 3.3Å; W748-Q750 PolarHBondContact O-N 3.14Å; W748-S751 PolarHBondContact O-N 3.22Å; W748-S751 VanDerWaalsContact O-N 3.11Å; W748-S751 PolarHBondContact O-OG 3.13Å; W748-I752 HydrophobicContact CH2-CD1 3.83Å; W748-I752 HydrophobicContact CZ2-CD1 3.88Å; W748-I752 HydrophobicContact CZ2-CG2 4.31Å; W748-I752 HydrophobicContact CZ3-CD1 4.2Å; W748-I752 PolarHBondContact O-N 3.49Å; W748-I752 VanDerWaalsContact O-N 3.1Å; W748-L782 HydrophobicContact CZ3-CD2 4.07Å; W748-M799 HydrophobicContact CH2-CE 4.45Å; W748-M799 HydrophobicContact CH2-SD 4.36Å; W748-M799 HydrophobicContact CZ3-CE 4.44Å; W748-E802 HydrophobicContact CZ2-CB 3.98Å; W748-E802 WeakPolarHBondContact CZ2-O 3.48Å; W748-F803 HydrophobicContact CH2-CB 4.46Å; W748-L806 HydrophobicContact CD2-CD2 4.09Å; W748-L806 HydrophobicContact CE3-CD2 4.11Å; W748-L806 HydrophobicContact CH2-CD2 3.85Å; W748-L806 HydrophobicContact CZ2-CB 3.91Å; W748-L806 HydrophobicContact CZ2-CD2 3.8Å; W748-L806 HydrophobicContact CZ2-CG 4.36Å; W748-L806 HydrophobicContact CZ3-CD2 4Å
749	V	97.8	Very high	97.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.9	-33.9	174.1	176.1	0	0	0	0	111.3	V745 V746 I752 L754 A758 L761 L786 M799	V745-V749 WeakPolarHBondContact O-CG2 3.36Å; V745-V749 PolarHBondContact O-N 3.42Å; V746-V749 PolarHBondContact O-N 2.93Å; V749-I752 WeakPolarHBondContact O-CG1 3.47Å; V749-L754 HydrophobicContact CG1-CB 3.79Å; V749-L754 CarbonylContact O-C 3.52Å; V749-L754 WeakPolarHBondContact O-CA 3.35Å; V749-L754 PolarHBondContact O-N 3.35Å; V749-A758 HydrophobicContact CB-CB 4.07Å; V749-A758 HydrophobicContact CG1-CB 3.82Å; V749-L761 HydrophobicContact CG2-CD1 4.03Å; V749-L786 HydrophobicContact CG1-CD1 4.12Å; V749-L786 HydrophobicContact CG1-CD2 3.94Å; V749-L786 HydrophobicContact CG2-CD1 4.23Å; V749-L786 HydrophobicContact CG2-CD2 4.43Å; V749-M799 HydrophobicContact CG2-CE 4.45Å
750	Q	97.1	Very high	97	Very high	70 Å²	70	46.8 Å²	46.8	33%	0.327	26%	0.257	S	S	.	.	H	α-helix	trans	-68.4	-40.8	172.5	-69.4	177.6	31.8	0	0	112.8	V746 H747 W748 G753 R755 A758	V746-Q750 WeakPolarHBondContact O-CG 3.27Å; V746-Q750 PolarHBondContact O-N 2.83Å; H747-Q750 WeakPolarHBondContact O-CB 3.24Å; H747-Q750 PolarHBondContact O-N 3.43Å; W748-Q750 PolarHBondContact O-N 3.14Å; Q750-G753 PolarHBondContact O-N 3.31Å; Q750-G753 VanDerWaalsContact O-N 3.13Å; Q750-R755 HydrophobicContact CB-CG 4.05Å; Q750-R755 HydrophobicContact CG-CB 4.44Å; Q750-R755 HydrophobicContact CG-CG 4.32Å; Q750-R755 VanDerWaalsContact O-CG 3.31Å; Q750-R755 WeakPolarHBondContact O-CG 3.19Å; Q750-A758 HydrophobicContact CG-CB 3.62Å
751	S	96.3	Very high	97	Very high	84 Å²	84	46.4 Å²	46.4	59%	0.587	26%	0.255	S	S	*	.	H	α-helix	trans	-71.7	-30.7	-176.2	73.9	0	0	0	0	113.3	H747 W748 G753	H747-S751 PolarHBondContact O-N 3.07Å; W748-S751 PolarHBondContact O-N 3.22Å; W748-S751 VanDerWaalsContact O-N 3.11Å; W748-S751 PolarHBondContact O-OG 3.13Å; S751-G753 PolarHBondContact O-N 2.99Å
752	I	96.6	Very high	96.9	Very high	29 Å²	29	51 Å²	51	15%	0.149	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	6.2	170.7	68.8	176.8	0	0	0	113.6	W748 V749 L754 V798 M799 E802	W748-I752 HydrophobicContact CH2-CD1 3.83Å; W748-I752 HydrophobicContact CZ2-CD1 3.88Å; W748-I752 HydrophobicContact CZ2-CG2 4.31Å; W748-I752 HydrophobicContact CZ3-CD1 4.2Å; W748-I752 PolarHBondContact O-N 3.49Å; W748-I752 VanDerWaalsContact O-N 3.1Å; V749-I752 WeakPolarHBondContact O-CG1 3.47Å; I752-L754 HydrophobicContact CD1-CD1 3.97Å; I752-L754 HydrophobicContact CG1-CB 4.46Å; I752-L754 HydrophobicContact CG1-CD1 4.3Å; I752-L754 HydrophobicContact CG1-CG 4.32Å; I752-V798 WeakPolarHBondContact O-CG1 3.31Å; I752-M799 HydrophobicContact CD1-CE 3.89Å; I752-E802 HydrophobicContact CB-CB 4.31Å; I752-E802 HydrophobicContact CB-CG 4.1Å; I752-E802 HydrophobicContact CD1-CB 4.1Å; I752-E802 HydrophobicContact CG2-CB 3.83Å; I752-E802 HydrophobicContact CG2-CG 3.87Å
753	G	95.8	Very high	96.8	Very high	54 Å²	54	55.6 Å²	55.6	56%	0.557	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	89	4.3	173.9	0	0	0	0	0	115.7	Q750 S751 R755	Q750-G753 PolarHBondContact O-N 3.31Å; Q750-G753 VanDerWaalsContact O-N 3.13Å; S751-G753 PolarHBondContact O-N 2.99Å; G753-R755 VanDerWaalsContact C-N 3.27Å; G753-R755 PolarHBondContact O-N 3.15Å
754	L	96.9	Very high	96.8	Very high	11 Å²	11	51.7 Å²	51.7	6%	0.058	28%	0.276	C	S	.	.			trans	-95.1	39.1	-178.5	-63.6	177.1	0	0	0	112.4	V749 I752 D756 Y757 A758 I788 A795 V798 M799	V749-L754 HydrophobicContact CG1-CB 3.79Å; V749-L754 CarbonylContact O-C 3.52Å; V749-L754 WeakPolarHBondContact O-CA 3.35Å; V749-L754 PolarHBondContact O-N 3.35Å; I752-L754 HydrophobicContact CD1-CD1 3.97Å; I752-L754 HydrophobicContact CG1-CB 4.46Å; I752-L754 HydrophobicContact CG1-CD1 4.3Å; I752-L754 HydrophobicContact CG1-CG 4.32Å; L754-D756 VanDerWaalsContact C-N 3.3Å; L754-D756 PolarHBondContact O-N 2.77Å; L754-Y757 HydrophobicContact CB-CD2 4.18Å; L754-Y757 HydrophobicContact CD2-CD2 4.21Å; L754-Y757 HydrophobicContact CD2-CE2 4.26Å; L754-Y757 PolarHBondContact O-N 2.78Å; L754-Y757 VanDerWaalsContact O-N 3.11Å; L754-A758 PolarHBondContact O-N 3.43Å; L754-I788 HydrophobicContact CD1-CD1 4.31Å; L754-A795 HydrophobicContact CD2-CB 3.69Å; L754-V798 HydrophobicContact CD1-CG1 4.19Å; L754-V798 HydrophobicContact CG-CG1 4.27Å; L754-M799 HydrophobicContact CD1-CB 4.07Å; L754-M799 HydrophobicContact CD1-CE 3.55Å
755	R	96.4	Very high	96.9	Very high	168 Å²	168	51.2 Å²	51.2	63%	0.634	27%	0.274	S	S	*	.	H	α-helix	trans	-56.1	-40.9	-170.1	-58.4	-177.4	72.6	179.8	2.7	113.4	Q750 G753 Y757 A758	Q750-R755 HydrophobicContact CB-CG 4.05Å; Q750-R755 HydrophobicContact CG-CB 4.44Å; Q750-R755 HydrophobicContact CG-CG 4.32Å; Q750-R755 VanDerWaalsContact O-CG 3.31Å; Q750-R755 WeakPolarHBondContact O-CG 3.19Å; G753-R755 VanDerWaalsContact C-N 3.27Å; G753-R755 PolarHBondContact O-N 3.15Å; R755-Y757 PolarHBondContact O-N 2.79Å; R755-A758 PolarHBondContact O-N 2.94Å
756	D	96.1	Very high	96.9	Very high	148 Å²	148	51.2 Å²	51.2	79%	0.791	27%	0.274	S	S	*	.	H	α-helix	trans	-66.6	-23.8	-176.3	-49.7	-38	0	0	0	112.9	L754	L754-D756 VanDerWaalsContact C-N 3.3Å; L754-D756 PolarHBondContact O-N 2.77Å
757	Y	97	Very high	96.9	Very high	50 Å²	50	50.8 Å²	50.8	20%	0.196	27%	0.271	C	S	.	.	H	α-helix	trans	-94.9	-21.9	178.9	-53.8	-80.5	0	0	0	112.8	L754 R755 G759 N760 L786 I788 S792 A795	L754-Y757 HydrophobicContact CB-CD2 4.18Å; L754-Y757 HydrophobicContact CD2-CD2 4.21Å; L754-Y757 HydrophobicContact CD2-CE2 4.26Å; L754-Y757 PolarHBondContact O-N 2.78Å; L754-Y757 VanDerWaalsContact O-N 3.11Å; R755-Y757 PolarHBondContact O-N 2.79Å; Y757-G759 PolarHBondContact O-N 3.19Å; Y757-G759 VanDerWaalsContact O-N 3.13Å; Y757-N760 WeakPolarHBondContact O-CB 3.13Å; Y757-N760 PolarHBondContact O-N 3.12Å; Y757-L786 VanDerWaalsContact O-CD2 3.31Å; Y757-L786 WeakPolarHBondContact O-CD2 3.37Å; Y757-I788 HydrophobicContact CD1-CB 4.36Å; Y757-I788 HydrophobicContact CD1-CG1 3.73Å; Y757-I788 HydrophobicContact CD2-CG1 4.25Å; Y757-I788 HydrophobicContact CE1-CB 4.29Å; Y757-I788 HydrophobicContact CE1-CG1 4.09Å; Y757-I788 HydrophobicContact CE1-CG2 4.34Å; Y757-I788 HydrophobicContact CG-CG1 3.82Å; Y757-S792 PolarHBondContact OH-OG 2.87Å; Y757-A795 HydrophobicContact CE2-CB 4.29Å
758	A	96.4	Very high	96.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.4	-27.6	-173	0	0	0	0	0	113.3	V746 V749 Q750 L754 R755 N760 L761	V746-A758 HydrophobicContact CG1-CB 4.28Å; V749-A758 HydrophobicContact CB-CB 4.07Å; V749-A758 HydrophobicContact CG1-CB 3.82Å; Q750-A758 HydrophobicContact CG-CB 3.62Å; L754-A758 PolarHBondContact O-N 3.43Å; R755-A758 PolarHBondContact O-N 2.94Å; A758-N760 PolarHBondContact O-N 3.46Å; A758-L761 PolarHBondContact O-N 3.01Å
759	G	94.6	Very high	97	Very high	41 Å²	41	45.4 Å²	45.4	42%	0.423	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-58.3	-29.1	173.5	0	0	0	0	0	113.7	Y757 L761 H762	Y757-G759 PolarHBondContact O-N 3.19Å; Y757-G759 VanDerWaalsContact O-N 3.13Å; G759-L761 PolarHBondContact O-N 3.23Å; G759-L761 VanDerWaalsContact O-N 3.17Å; G759-H762 PolarHBondContact O-N 3.39Å; G759-H762 PolarHBondContact O-ND1 3.16Å
760	N	96.8	Very high	96.9	Very high	62 Å²	62	45.4 Å²	45.4	33%	0.332	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-73.8	-3.1	-177.1	-60.3	-26.7	0	0	0	113.9	Y757 A758 L786 Q787	Y757-N760 WeakPolarHBondContact O-CB 3.13Å; Y757-N760 PolarHBondContact O-N 3.12Å; A758-N760 PolarHBondContact O-N 3.46Å; N760-L786 PolarHBondContact ND2-O 3Å; N760-Q787 HydrophobicContact CB-CG 4.41Å
761	L	96.9	Very high	96.9	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-85.8	-12.3	173.6	-61.1	-174.8	0	0	0	114.1	N742 V745 V746 V749 A758 G759 S764 V766 L782 V785 L786	N742-L761 PolarHBondContact ND2-O 2.84Å; V745-L761 HydrophobicContact CB-CD1 4.46Å; V745-L761 HydrophobicContact CG1-CD1 3.76Å; V746-L761 HydrophobicContact CG2-CB 3.76Å; V746-L761 HydrophobicContact CG2-CD1 4.08Å; V746-L761 HydrophobicContact CG2-CG 4.44Å; V749-L761 HydrophobicContact CG2-CD1 4.03Å; A758-L761 PolarHBondContact O-N 3.01Å; G759-L761 PolarHBondContact O-N 3.23Å; G759-L761 VanDerWaalsContact O-N 3.17Å; L761-S764 WeakPolarHBondContact O-CB 3.2Å; L761-S764 PolarHBondContact O-N 2.76Å; L761-S764 PolarHBondContact O-OG 2.86Å; L761-V766 HydrophobicContact CD2-CB 4.28Å; L761-V766 HydrophobicContact CD2-CG1 4.49Å; L761-V766 HydrophobicContact CD2-CG2 4.35Å; L761-L782 HydrophobicContact CD2-CD1 4.07Å; L761-V785 HydrophobicContact CD2-CG1 3.95Å; L761-L786 HydrophobicContact CD1-CD2 4.07Å; L761-L786 HydrophobicContact CD2-CD2 3.61Å; L761-L786 HydrophobicContact CD2-CG 3.92Å; L761-L786 HydrophobicContact CG-CD2 3.58Å; L761-L786 HydrophobicContact CG-CG 4.42Å
762	H	96.1	Very high	96.9	Very high	116 Å²	116	38.7 Å²	38.7	54%	0.537	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	139.7	172.6	-64.4	85.3	0	0	0	109.6	G759 S764	G759-H762 PolarHBondContact O-N 3.39Å; G759-H762 PolarHBondContact O-ND1 3.16Å; H762-S764 PolarHBondContact O-N 2.76Å
763	E	97.3	Very high	96.8	Very high	103 Å²	103	38.5 Å²	38.5	48%	0.481	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	-1.9	-177.2	-53.5	-156.8	155.7	0	0	116.5	G665 P667 Q668 H702 G765	G665-E763 CarbonylContact O-C 3.6Å; G665-E763 WeakPolarHBondContact O-CA 3.31Å; P667-E763 HydrophobicContact CG-CG 4.07Å; Q668-E763 PolarHBondContact NE2-O 2.85Å; H702-E763 PolarHBondContact NE2-O 3.35Å; E763-G765 VanDerWaalsContact C-N 3.31Å; E763-G765 PolarHBondContact O-N 3.09Å
764	S	97.7	Very high	96.8	Very high	12 Å²	12	36.7 Å²	36.7	8%	0.084	19%	0.186	C	C	.	.	S	Bend	trans	-72.7	-16.1	-176.8	70.6	0	0	0	0	115.2	G665 F701 H702 L761 H762 V766	G665-S764 PolarHBondContact O-N 2.68Å; F701-S764 WeakPolarHBondContact CD1-O 3.48Å; F701-S764 WeakPolarHBondContact CE1-O 3.45Å; H702-S764 PolarHBondContact CD2-O 2.94Å; L761-S764 WeakPolarHBondContact O-CB 3.2Å; L761-S764 PolarHBondContact O-N 2.76Å; L761-S764 PolarHBondContact O-OG 2.86Å; H762-S764 PolarHBondContact O-N 2.76Å; S764-V766 VanDerWaalsContact C-N 3.25Å; S764-V766 PolarHBondContact O-N 3.08Å; S764-V766 PolarHBondContact OG-N 3.28Å; S764-V766 VanDerWaalsContact OG-N 3.14Å
765	G	97.9	Very high	96.5	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.219	C	C	.	.			trans	71.8	5.7	-169.1	0	0	0	0	0	115.9	L664 G665 L666 S705 E763 H767	L664-G765 CarbonylContact O-C 3.56Å; L664-G765 VanDerWaalsContact O-CA 3.26Å; L664-G765 WeakPolarHBondContact O-CA 3.46Å; L664-G765 VanDerWaalsContact O-O 3.11Å; G665-G765 WeakPolarHBondContact O-CA 3.46Å; G665-G765 PolarHBondContact O-N 2.66Å; L666-G765 VanDerWaalsContact CD2-CA 3.49Å; S705-G765 VanDerWaalsContact CB-O 3.29Å; S705-G765 WeakPolarHBondContact CB-O 3.37Å; S705-G765 PolarHBondContact OG-O 3.4Å; E763-G765 VanDerWaalsContact C-N 3.31Å; E763-G765 PolarHBondContact O-N 3.09Å; G765-H767 PolarHBondContact O-N 3.19Å; G765-H767 PolarHBondContact O-ND1 3.09Å
766	V	98.5	Very high	96.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.22	C	C	.	.			trans	-75.8	124.1	175.8	177.8	0	0	0	0	110.6	F701 N742 V745 L761 S764 L770 L771 F777 L782 V785	F701-V766 HydrophobicContact CE1-CG2 4.12Å; F701-V766 HydrophobicContact CZ-CG2 4.08Å; N742-V766 PolarHBondContact ND2-O 3.07Å; V745-V766 HydrophobicContact CG1-CG1 4.2Å; L761-V766 HydrophobicContact CD2-CB 4.28Å; L761-V766 HydrophobicContact CD2-CG1 4.49Å; L761-V766 HydrophobicContact CD2-CG2 4.35Å; S764-V766 VanDerWaalsContact C-N 3.25Å; S764-V766 PolarHBondContact O-N 3.08Å; S764-V766 PolarHBondContact OG-N 3.28Å; S764-V766 VanDerWaalsContact OG-N 3.14Å; V766-L770 HydrophobicContact CG2-CD2 4.37Å; V766-L771 HydrophobicContact CG1-CD2 3.98Å; V766-F777 HydrophobicContact CG2-CZ 4.13Å; V766-L782 HydrophobicContact CG1-CD1 4.03Å; V766-V785 HydrophobicContact CG2-CB 4.48Å; V766-V785 HydrophobicContact CG2-CG1 3.89Å; V766-V785 HydrophobicContact CG2-CG2 4.46Å
767	H	98.4	Very high	96.3	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.014	18%	0.183	C	C	.	.			trans	-154.5	170.1	178.7	62.6	-80.9	0	0	0	110.1	L664 S705 G765 A769 L770 L771	L664-H767 PolarHBondContact O-ND1 3.28Å; S705-H767 PolarHBondContact O-CE1 2.87Å; S705-H767 VanDerWaalsContact O-CE1 3.26Å; S705-H767 PolarHBondContact OG-CE1 3Å; S705-H767 PolarHBondContact OG-ND1 3Å; G765-H767 PolarHBondContact O-N 3.19Å; G765-H767 PolarHBondContact O-ND1 3.09Å; H767-A769 PolarHBondContact CD2-N 3.36Å; H767-A769 PolarHBondContact O-N 3.29Å; H767-L770 WeakPolarHBondContact O-CB 3.47Å; H767-L770 PolarHBondContact O-N 3.08Å; H767-L770 VanDerWaalsContact O-N 3.07Å; H767-L771 PolarHBondContact O-N 2.73Å
768	G	97.7	Very high	96.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-51	-48.1	-171.9	0	0	0	0	0	116.3	V737 W740 L770 L771 A772	V737-G768 CarbonylContact O-C 3.54Å; V737-G768 WeakPolarHBondContact O-CA 3.22Å; W740-G768 WeakPolarHBondContact O-CA 3.41Å; W740-G768 PolarHBondContact O-N 2.96Å; G768-L770 VanDerWaalsContact C-N 3.29Å; G768-L770 PolarHBondContact O-N 3.01Å; G768-L771 WeakPolarHBondContact O-CB 3.35Å; G768-L771 PolarHBondContact O-N 3.5Å; G768-L771 VanDerWaalsContact O-N 3.07Å; G768-A772 WeakPolarHBondContact O-CB 3.22Å; G768-A772 PolarHBondContact O-N 3.13Å
769	A	97.7	Very high	96.1	Very high	2 Å²	2	36.4 Å²	36.4	2%	0.017	19%	0.194	C	C	.	.	H	α-helix	trans	-63.1	-31.6	-179.8	0	0	0	0	0	113.5	C712 L738 H767 L773	C712-A769 HydrophobicContact CB-CB 3.64Å; L738-A769 HydrophobicContact CD1-CB 4.17Å; L738-A769 WeakPolarHBondContact O-CB 3.06Å; L738-A769 PolarHBondContact O-N 3.42Å; H767-A769 PolarHBondContact CD2-N 3.36Å; H767-A769 PolarHBondContact O-N 3.29Å; A769-L773 HydrophobicContact CB-CD1 4.24Å; A769-L773 WeakPolarHBondContact O-CB 3.25Å; A769-L773 WeakPolarHBondContact O-CG 3.39Å; A769-L773 PolarHBondContact O-N 3.38Å
770	L	97.5	Very high	96.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.9	-49.1	170.6	-179.1	71.1	0	0	0	110.4	F701 T704 Y708 V766 H767 G768 A772 L773 D774 F777	F701-L770 HydrophobicContact CE2-CD2 3.92Å; F701-L770 HydrophobicContact CZ-CD2 3.59Å; T704-L770 HydrophobicContact CG2-CD1 4.48Å; Y708-L770 HydrophobicContact CD2-CD1 3.56Å; Y708-L770 HydrophobicContact CE2-CD1 4.04Å; Y708-L770 HydrophobicContact CG-CD1 4.4Å; V766-L770 HydrophobicContact CG2-CD2 4.37Å; H767-L770 WeakPolarHBondContact O-CB 3.47Å; H767-L770 PolarHBondContact O-N 3.08Å; H767-L770 VanDerWaalsContact O-N 3.07Å; G768-L770 VanDerWaalsContact C-N 3.29Å; G768-L770 PolarHBondContact O-N 3.01Å; L770-A772 VanDerWaalsContact C-N 3.32Å; L770-A772 PolarHBondContact O-N 3.38Å; L770-L773 PolarHBondContact O-N 3.3Å; L770-D774 HydrophobicContact CD1-CB 3.95Å; L770-D774 WeakPolarHBondContact O-CB 3.46Å; L770-D774 PolarHBondContact O-N 3.39Å; L770-F777 HydrophobicContact CD2-CD2 3.96Å; L770-F777 HydrophobicContact CD2-CE2 3.89Å; L770-F777 HydrophobicContact CD2-CG 4.38Å; L770-F777 HydrophobicContact CD2-CZ 4.24Å; L770-F777 HydrophobicContact CG-CD2 4.23Å; L770-F777 HydrophobicContact CG-CG 4.25Å
771	L	96.8	Very high	96.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.9	-40.9	-179.9	-49.9	-173.4	0	0	0	112	V737 V745 V766 H767 G768 F777 F803 L806 R813	V737-L771 HydrophobicContact CG1-CB 4.08Å; V737-L771 HydrophobicContact CG1-CD1 4.33Å; V745-L771 HydrophobicContact CG1-CD1 4.13Å; V745-L771 HydrophobicContact CG2-CD1 3.84Å; V766-L771 HydrophobicContact CG1-CD2 3.98Å; H767-L771 PolarHBondContact O-N 2.73Å; G768-L771 WeakPolarHBondContact O-CB 3.35Å; G768-L771 PolarHBondContact O-N 3.5Å; G768-L771 VanDerWaalsContact O-N 3.07Å; L771-F777 HydrophobicContact CD2-CD1 3.65Å; L771-F777 HydrophobicContact CD2-CE1 3.34Å; L771-F777 HydrophobicContact CD2-CZ 4.32Å; L771-F803 HydrophobicContact CD2-CE2 4.32Å; L771-L806 HydrophobicContact CD1-CD2 3.9Å; L771-R813 WeakPolarHBondContact O-CD 3.44Å; L771-R813 PolarHBondContact O-NH1 2.87Å
772	A	95.7	Very high	96.2	Very high	14 Å²	14	37.1 Å²	37.1	12%	0.116	19%	0.189	C	C	.	.	H	α-helix	trans	-82.8	-20	-175.1	0	0	0	0	0	114.8	L738 G768 L770 T811	L738-A772 HydrophobicContact CB-CB 4.28Å; G768-A772 WeakPolarHBondContact O-CB 3.22Å; G768-A772 PolarHBondContact O-N 3.13Å; L770-A772 VanDerWaalsContact C-N 3.32Å; L770-A772 PolarHBondContact O-N 3.38Å; A772-T811 HydrophobicContact CB-CG2 3.75Å
773	L	94.6	Very high	96.2	Very high	24 Å²	24	31.6 Å²	31.6	13%	0.126	16%	0.164	C	C	.	.	H	α-helix	trans	-122.9	-18.1	-170.4	-55.6	177.7	0	0	0	115.2	Y708 M711 L738 A769 L770 E775	Y708-L773 HydrophobicContact CD1-CB 3.42Å; Y708-L773 VanDerWaalsContact CD1-CB 3.42Å; Y708-L773 HydrophobicContact CD1-CD1 4Å; Y708-L773 HydrophobicContact CD1-CG 4.35Å; Y708-L773 HydrophobicContact CE1-CB 3.56Å; Y708-L773 WeakPolarHBondContact CE1-O 3.45Å; Y708-L773 HydrophobicContact CG-CB 4.45Å; M711-L773 HydrophobicContact CB-CD1 4Å; M711-L773 HydrophobicContact CE-CD1 4.43Å; L738-L773 HydrophobicContact CD1-CD1 3.73Å; L738-L773 HydrophobicContact CD1-CD2 4Å; L738-L773 HydrophobicContact CD1-CG 3.89Å; A769-L773 HydrophobicContact CB-CD1 4.24Å; A769-L773 WeakPolarHBondContact O-CB 3.25Å; A769-L773 WeakPolarHBondContact O-CG 3.39Å; A769-L773 PolarHBondContact O-N 3.38Å; L770-L773 PolarHBondContact O-N 3.3Å; L773-E775 PolarHBondContact O-N 2.69Å
774	D	95	Very high	96.2	Very high	17 Å²	17	32.3 Å²	32.3	9%	0.091	17%	0.17	C	C	.	.			trans	-92.6	98.3	176.6	-163.9	-15	0	0	0	111	Y708 L770 N776 F777 R813	Y708-D774 HydrophobicContact CD2-CB 4.25Å; Y708-D774 HydrophobicContact CE1-CB 4.33Å; Y708-D774 HydrophobicContact CE2-CB 3.55Å; Y708-D774 WeakPolarHBondContact CE2-OD2 3.47Å; L770-D774 HydrophobicContact CD1-CB 3.95Å; L770-D774 WeakPolarHBondContact O-CB 3.46Å; L770-D774 PolarHBondContact O-N 3.39Å; D774-N776 PolarHBondContact O-N 3.49Å; D774-N776 VanDerWaalsContact O-N 3.14Å; D774-N776 WeakPolarHBondContact OD1-CA 3.5Å; D774-N776 WeakPolarHBondContact OD1-CB 3.48Å; D774-N776 PolarHBondContact OD1-N 3.31Å; D774-F777 HydrophobicContact CB-CB 3.78Å; D774-F777 PolarHBondContact O-N 3.46Å; D774-R813 PolarHBondContact O-NH1 2.77Å; D774-R813 PolarHBondContact O-NH2 2.89Å
775	E	91.3	Very high	96.1	Very high	164 Å²	164	33.3 Å²	33.3	77%	0.766	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-23.2	173.9	-66.6	176.1	165.1	0	0	112.7	L773 R813	L773-E775 PolarHBondContact O-N 2.69Å; E775-R813 PolarHBondContact O-NH2 3.45Å
776	N	91.9	Very high	96.1	Very high	121 Å²	121	33.3 Å²	33.3	65%	0.647	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-9.7	175.4	-65.2	125.3	0	0	0	113.8	D774	D774-N776 PolarHBondContact O-N 3.49Å; D774-N776 VanDerWaalsContact O-N 3.14Å; D774-N776 WeakPolarHBondContact OD1-CA 3.5Å; D774-N776 WeakPolarHBondContact OD1-CB 3.48Å; D774-N776 PolarHBondContact OD1-N 3.31Å
777	F	95.7	Very high	96	Very high	3 Å²	3	39.8 Å²	39.8	1%	0.013	21%	0.206	C	C	.	.			trans	-88.3	118.6	174.6	-162.4	-92.3	0	0	0	110.3	F701 V766 L770 L771 D774 T781 L782 F803 R813	F701-F777 HydrophobicContact CE2-CD2 4.04Å; F701-F777 AromaticContact CE2-CE2 3.82Å; F701-F777 HydrophobicContact CE2-CE2 3.82Å; F701-F777 HydrophobicContact CZ-CD2 4.27Å; F701-F777 AromaticContact CZ-CE2 3.61Å; F701-F777 HydrophobicContact CZ-CE2 3.61Å; F701-F777 HydrophobicContact CZ-CZ 4.48Å; V766-F777 HydrophobicContact CG2-CZ 4.13Å; L770-F777 HydrophobicContact CD2-CD2 3.96Å; L770-F777 HydrophobicContact CD2-CE2 3.89Å; L770-F777 HydrophobicContact CD2-CG 4.38Å; L770-F777 HydrophobicContact CD2-CZ 4.24Å; L770-F777 HydrophobicContact CG-CD2 4.23Å; L770-F777 HydrophobicContact CG-CG 4.25Å; L771-F777 HydrophobicContact CD2-CD1 3.65Å; L771-F777 HydrophobicContact CD2-CE1 3.34Å; L771-F777 HydrophobicContact CD2-CZ 4.32Å; D774-F777 HydrophobicContact CB-CB 3.78Å; D774-F777 PolarHBondContact O-N 3.46Å; F777-T781 HydrophobicContact CD2-CG2 3.65Å; F777-T781 HydrophobicContact CE2-CG2 3.46Å; F777-T781 VanDerWaalsContact CE2-CG2 3.46Å; F777-T781 HydrophobicContact CZ-CG2 4.27Å; F777-L782 HydrophobicContact CE1-CB 3.84Å; F777-L782 HydrophobicContact CE1-CD1 4.19Å; F777-L782 HydrophobicContact CE1-CG 4.4Å; F777-L782 HydrophobicContact CZ-CB 4.03Å; F777-L782 HydrophobicContact CZ-CD1 4.09Å; F777-F803 HydrophobicContact CD1-CE2 4.32Å; F777-F803 HydrophobicContact CD1-CZ 4.31Å; F777-F803 HydrophobicContact CE1-CE2 4.42Å; F777-R813 PolarHBondContact O-NH1 2.93Å; F777-R813 PolarHBondContact O-NH2 3.3Å
778	D	94.7	Very high	96	Very high	50 Å²	50	39.9 Å²	39.9	27%	0.267	21%	0.207	S	C	.	.			trans	-128.6	175.3	-173.6	79.8	-29.9	0	0	0	112.7	N780 T781 L782	D778-N780 PolarHBondContact O-N 3.29Å; D778-N780 PolarHBondContact OD1-N 2.85Å; D778-N780 WeakPolarHBondContact OD2-CB 3.31Å; D778-N780 PolarHBondContact OD2-ND2 2.86Å; D778-T781 PolarHBondContact O-N 2.93Å; D778-T781 VanDerWaalsContact OD1-CB 3.25Å; D778-T781 WeakPolarHBondContact OD1-CB 3.41Å; D778-T781 PolarHBondContact OD1-N 3.39Å; D778-T781 PolarHBondContact OD1-OG1 3.48Å; D778-L782 PolarHBondContact O-N 2.76Å
779	H	95.4	Very high	95.9	Very high	33 Å²	33	42.6 Å²	42.6	15%	0.153	23%	0.225	C	C	.	.	H	α-helix	trans	-61.2	-28.6	178.8	70.2	96.1	0	0	0	113.2	A783 M799 E800 F803	H779-A783 VanDerWaalsContact O-CB 3.24Å; H779-A783 WeakPolarHBondContact O-CB 3.48Å; H779-A783 PolarHBondContact O-N 2.95Å; H779-M799 HydrophobicContact CB-CG 4.45Å; H779-E800 WeakPolarHBondContact ND1-CB 3.4Å; H779-F803 HydrophobicContact CB-CB 3.85Å; H779-F803 HydrophobicContact CB-CD1 3.81Å; H779-F803 HydrophobicContact CB-CG 3.87Å
780	N	95.7	Very high	95.7	Very high	70 Å²	70	47.3 Å²	47.3	37%	0.374	25%	0.253	S	S	.	.	H	α-helix	trans	-71.1	-43.7	176.5	-60.8	-68.6	0	0	0	111.2	D778 A783 L784	D778-N780 PolarHBondContact O-N 3.29Å; D778-N780 PolarHBondContact OD1-N 2.85Å; D778-N780 WeakPolarHBondContact OD2-CB 3.31Å; D778-N780 PolarHBondContact OD2-ND2 2.86Å; N780-A783 PolarHBondContact O-N 3.06Å; N780-L784 WeakPolarHBondContact O-CG 3.27Å; N780-L784 PolarHBondContact O-N 2.93Å
781	T	96.6	Very high	95.5	Very high	47 Å²	47	54.5 Å²	54.5	29%	0.288	29%	0.287	S	S	.	.	H	α-helix	trans	-62.6	-44.8	174.9	-53.3	0	0	0	0	110.6	F777 D778 A783 L784 V785	F777-T781 HydrophobicContact CD2-CG2 3.65Å; F777-T781 HydrophobicContact CE2-CG2 3.46Å; F777-T781 VanDerWaalsContact CE2-CG2 3.46Å; F777-T781 HydrophobicContact CZ-CG2 4.27Å; D778-T781 PolarHBondContact O-N 2.93Å; D778-T781 VanDerWaalsContact OD1-CB 3.25Å; D778-T781 WeakPolarHBondContact OD1-CB 3.41Å; D778-T781 PolarHBondContact OD1-N 3.39Å; D778-T781 PolarHBondContact OD1-OG1 3.48Å; T781-A783 PolarHBondContact O-N 3.5Å; T781-L784 WeakPolarHBondContact O-CB 3.42Å; T781-L784 PolarHBondContact O-N 3.15Å; T781-L784 VanDerWaalsContact O-N 3.16Å; T781-V785 WeakPolarHBondContact O-CG2 3.26Å; T781-V785 PolarHBondContact O-N 2.74Å
782	L	97.5	Very high	95.5	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.7	-41	175.6	-173	52.8	0	0	0	112.3	W748 L761 V766 F777 D778 L784 V785 L786 M799 F803	W748-L782 HydrophobicContact CZ3-CD2 4.07Å; L761-L782 HydrophobicContact CD2-CD1 4.07Å; V766-L782 HydrophobicContact CG1-CD1 4.03Å; F777-L782 HydrophobicContact CE1-CB 3.84Å; F777-L782 HydrophobicContact CE1-CD1 4.19Å; F777-L782 HydrophobicContact CE1-CG 4.4Å; F777-L782 HydrophobicContact CZ-CB 4.03Å; F777-L782 HydrophobicContact CZ-CD1 4.09Å; D778-L782 PolarHBondContact O-N 2.76Å; L782-L784 VanDerWaalsContact C-N 3.26Å; L782-L784 PolarHBondContact O-N 3.16Å; L782-V785 PolarHBondContact O-N 2.93Å; L782-L786 HydrophobicContact CD1-CD1 4.26Å; L782-L786 HydrophobicContact CD1-CG 4.34Å; L782-L786 HydrophobicContact CG-CD1 3.99Å; L782-L786 WeakPolarHBondContact O-CB 3.4Å; L782-L786 WeakPolarHBondContact O-CG 3.32Å; L782-L786 PolarHBondContact O-N 2.65Å; L782-M799 HydrophobicContact CB-SD 4.27Å; L782-M799 HydrophobicContact CD2-CE 4.47Å; L782-M799 HydrophobicContact CD2-SD 3.66Å; L782-M799 HydrophobicContact CG-SD 3.88Å; L782-F803 HydrophobicContact CD2-CD2 3.73Å; L782-F803 HydrophobicContact CD2-CE2 4.01Å
783	A	97.1	Very high	95.5	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.008	32%	0.318	C	S	.	.	H	α-helix	trans	-64.3	-27.2	174.5	0	0	0	0	0	113.5	H779 N780 T781 Q787 I788 M799	H779-A783 VanDerWaalsContact O-CB 3.24Å; H779-A783 WeakPolarHBondContact O-CB 3.48Å; H779-A783 PolarHBondContact O-N 2.95Å; N780-A783 PolarHBondContact O-N 3.06Å; T781-A783 PolarHBondContact O-N 3.5Å; A783-Q787 PolarHBondContact O-N 3.19Å; A783-I788 HydrophobicContact CB-CB 4.46Å; A783-I788 HydrophobicContact CB-CD1 4.14Å; A783-I788 PolarHBondContact O-N 2.89Å; A783-M799 HydrophobicContact CB-CG 4.15Å
784	L	96.5	Very high	95.5	Very high	117 Å²	117	65.8 Å²	65.8	61%	0.613	35%	0.346	S	S	*	.	H	α-helix	trans	-74.8	-44.1	172.6	-72.5	167.6	0	0	0	111.8	N780 T781 L782 L786 Q787	N780-L784 WeakPolarHBondContact O-CG 3.27Å; N780-L784 PolarHBondContact O-N 2.93Å; T781-L784 WeakPolarHBondContact O-CB 3.42Å; T781-L784 PolarHBondContact O-N 3.15Å; T781-L784 VanDerWaalsContact O-N 3.16Å; L782-L784 VanDerWaalsContact C-N 3.26Å; L782-L784 PolarHBondContact O-N 3.16Å; L784-L786 VanDerWaalsContact C-N 3.33Å; L784-L786 PolarHBondContact O-N 2.99Å; L784-Q787 WeakPolarHBondContact O-CA 3.38Å; L784-Q787 PolarHBondContact O-N 3.34Å
785	V	96.7	Very high	95.6	Very high	34 Å²	34	65.4 Å²	65.4	21%	0.206	35%	0.345	C	S	.	.	H	α-helix	trans	-63.3	-40.1	175.3	180	0	0	0	0	111.2	F701 L761 V766 T781 L782 Q787	F701-V785 HydrophobicContact CE1-CG2 4.37Å; F701-V785 HydrophobicContact CZ-CG2 4.49Å; L761-V785 HydrophobicContact CD2-CG1 3.95Å; V766-V785 HydrophobicContact CG2-CB 4.48Å; V766-V785 HydrophobicContact CG2-CG1 3.89Å; V766-V785 HydrophobicContact CG2-CG2 4.46Å; T781-V785 WeakPolarHBondContact O-CG2 3.26Å; T781-V785 PolarHBondContact O-N 2.74Å; L782-V785 PolarHBondContact O-N 2.93Å; V785-Q787 PolarHBondContact O-N 3.31Å; V785-Q787 VanDerWaalsContact O-N 3.16Å
786	L	97.3	Very high	95.9	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-5.4	172.4	-74.5	169.1	0	0	0	114.1	V749 Y757 N760 L761 L782 L784 I788 M799	V749-L786 HydrophobicContact CG1-CD1 4.12Å; V749-L786 HydrophobicContact CG1-CD2 3.94Å; V749-L786 HydrophobicContact CG2-CD1 4.23Å; V749-L786 HydrophobicContact CG2-CD2 4.43Å; Y757-L786 VanDerWaalsContact O-CD2 3.31Å; Y757-L786 WeakPolarHBondContact O-CD2 3.37Å; N760-L786 PolarHBondContact ND2-O 3Å; L761-L786 HydrophobicContact CD1-CD2 4.07Å; L761-L786 HydrophobicContact CD2-CD2 3.61Å; L761-L786 HydrophobicContact CD2-CG 3.92Å; L761-L786 HydrophobicContact CG-CD2 3.58Å; L761-L786 HydrophobicContact CG-CG 4.42Å; L782-L786 HydrophobicContact CD1-CD1 4.26Å; L782-L786 HydrophobicContact CD1-CG 4.34Å; L782-L786 HydrophobicContact CG-CD1 3.99Å; L782-L786 WeakPolarHBondContact O-CB 3.4Å; L782-L786 WeakPolarHBondContact O-CG 3.32Å; L782-L786 PolarHBondContact O-N 2.65Å; L784-L786 VanDerWaalsContact C-N 3.33Å; L784-L786 PolarHBondContact O-N 2.99Å; L786-I788 HydrophobicContact CB-CD1 4.09Å; L786-I788 HydrophobicContact CB-CG1 3.81Å; L786-I788 HydrophobicContact CD1-CD1 4.13Å; L786-I788 PolarHBondContact O-N 3.4Å; L786-M799 HydrophobicContact CD1-CE 3.4Å; L786-M799 HydrophobicContact CD1-SD 4.28Å
787	Q	97.3	Very high	96.1	Very high	136 Å²	136	59.3 Å²	59.3	64%	0.636	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	29.9	-177.6	-47.7	-175.7	22.5	0	0	114	N760 A783 L784 V785 P789	N760-Q787 HydrophobicContact CB-CG 4.41Å; A783-Q787 PolarHBondContact O-N 3.19Å; L784-Q787 WeakPolarHBondContact O-CA 3.38Å; L784-Q787 PolarHBondContact O-N 3.34Å; V785-Q787 PolarHBondContact O-N 3.31Å; V785-Q787 VanDerWaalsContact O-N 3.16Å; Q787-P789 VanDerWaalsContact O-CD 3.31Å; Q787-P789 WeakPolarHBondContact O-CD 3.22Å
788	I	96.9	Very high	96.2	Very high	4 Å²	4	60.8 Å²	60.8	2%	0.021	32%	0.32	C	S	.	.			trans	-67.3	120.5	178.7	-56.9	176.9	0	0	0	108.7	L754 Y757 A783 L786 A795 R796 M799	L754-I788 HydrophobicContact CD1-CD1 4.31Å; Y757-I788 HydrophobicContact CD1-CB 4.36Å; Y757-I788 HydrophobicContact CD1-CG1 3.73Å; Y757-I788 HydrophobicContact CD2-CG1 4.25Å; Y757-I788 HydrophobicContact CE1-CB 4.29Å; Y757-I788 HydrophobicContact CE1-CG1 4.09Å; Y757-I788 HydrophobicContact CE1-CG2 4.34Å; Y757-I788 HydrophobicContact CG-CG1 3.82Å; A783-I788 HydrophobicContact CB-CB 4.46Å; A783-I788 HydrophobicContact CB-CD1 4.14Å; A783-I788 PolarHBondContact O-N 2.89Å; L786-I788 HydrophobicContact CB-CD1 4.09Å; L786-I788 HydrophobicContact CB-CG1 3.81Å; L786-I788 HydrophobicContact CD1-CD1 4.13Å; L786-I788 PolarHBondContact O-N 3.4Å; I788-A795 HydrophobicContact CG2-CB 3.77Å; I788-R796 HydrophobicContact CG2-CG 3.8Å; I788-R796 PolarHBondContact O-NE 3.36Å; I788-R796 PolarHBondContact O-NH2 3.43Å; I788-M799 HydrophobicContact CD1-CB 4.45Å
789	P	95.5	Very high	96.3	Very high	58 Å²	58	58.4 Å²	58.4	38%	0.377	31%	0.308	S	S	.	.			trans	-57.2	148.4	-179.7	-25.7	34.4	0	0	0	112.3	Q787 Q791 S792 R796	Q787-P789 VanDerWaalsContact O-CD 3.31Å; Q787-P789 WeakPolarHBondContact O-CD 3.22Å; P789-Q791 VanDerWaalsContact CB-OE1 3.3Å; P789-Q791 PolarHBondContact O-N 3.42Å; P789-S792 WeakPolarHBondContact O-CB 3.27Å; P789-S792 PolarHBondContact O-N 3.22Å; P789-R796 PolarHBondContact O-NE 2.91Å; P789-R796 VanDerWaalsContact O-NE 3.11Å
790	T	93.8	Very high	96.4	Very high	101 Å²	101	60.9 Å²	60.9	62%	0.62	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-24.5	176.7	48.8	0	0	0	0	112.4	S792	T790-S792 VanDerWaalsContact C-N 3.28Å; T790-S792 PolarHBondContact O-N 2.83Å
791	Q	94.7	Very high	96.5	Very high	151 Å²	151	64.9 Å²	64.9	71%	0.706	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-20.5	172.8	-55.1	79.8	2.5	0	0	112.6	P789 T793	P789-Q791 VanDerWaalsContact CB-OE1 3.3Å; P789-Q791 PolarHBondContact O-N 3.42Å; Q791-T793 PolarHBondContact O-N 2.87Å
792	S	94.9	Very high	96.5	Very high	31 Å²	31	64.6 Å²	64.6	22%	0.217	33%	0.325	C	S	.	.			trans	-83.7	62.2	-178.9	-160.2	0	0	0	0	110.8	Y757 P789 T790 Q794 A795 R796	Y757-S792 PolarHBondContact OH-OG 2.87Å; P789-S792 WeakPolarHBondContact O-CB 3.27Å; P789-S792 PolarHBondContact O-N 3.22Å; T790-S792 VanDerWaalsContact C-N 3.28Å; T790-S792 PolarHBondContact O-N 2.83Å; S792-Q794 VanDerWaalsContact C-N 3.33Å; S792-Q794 PolarHBondContact O-N 3.5Å; S792-A795 PolarHBondContact O-N 2.92Å; S792-A795 WeakPolarHBondContact OG-CB 3.16Å; S792-R796 PolarHBondContact O-N 3.46Å; S792-R796 VanDerWaalsContact O-N 3.07Å
793	T	95.6	Very high	96.5	Very high	90 Å²	90	64.8 Å²	64.8	55%	0.552	33%	0.325	S	S	*	.	H	α-helix	trans	-58.8	-41.1	-173.5	53.8	0	0	0	0	112.5	Q791 R796 Q797	Q791-T793 PolarHBondContact O-N 2.87Å; T793-R796 PolarHBondContact O-N 3.29Å; T793-Q797 WeakPolarHBondContact O-CG 3.44Å; T793-Q797 PolarHBondContact O-N 2.81Å
794	Q	96.5	Very high	96.4	Very high	153 Å²	153	67.7 Å²	67.7	72%	0.715	34%	0.341	S	S	*	.	H	α-helix	trans	-60.3	-46.1	176.3	-174.9	-178.8	5.2	0	0	112.1	S792 R796 Q797 V798	S792-Q794 VanDerWaalsContact C-N 3.33Å; S792-Q794 PolarHBondContact O-N 3.5Å; Q794-R796 VanDerWaalsContact C-N 3.31Å; Q794-R796 PolarHBondContact O-N 2.97Å; Q794-Q797 PolarHBondContact O-N 3.3Å; Q794-V798 WeakPolarHBondContact O-CG2 3.37Å; Q794-V798 PolarHBondContact O-N 2.8Å
795	A	96.4	Very high	96.3	Very high	9 Å²	9	65 Å²	65	7%	0.074	33%	0.327	C	S	.	.	H	α-helix	trans	-64.9	-37.2	178.7	0	0	0	0	0	111.7	L754 Y757 I788 S792 V798 M799	L754-A795 HydrophobicContact CD2-CB 3.69Å; Y757-A795 HydrophobicContact CE2-CB 4.29Å; I788-A795 HydrophobicContact CG2-CB 3.77Å; S792-A795 PolarHBondContact O-N 2.92Å; S792-A795 WeakPolarHBondContact OG-CB 3.16Å; A795-V798 PolarHBondContact O-N 3.47Å; A795-M799 WeakPolarHBondContact O-CB 3.08Å; A795-M799 PolarHBondContact O-N 3.08Å
796	R	96.6	Very high	96.3	Very high	45 Å²	45	63.3 Å²	63.3	17%	0.17	32%	0.317	C	S	.	.	H	α-helix	trans	-68.4	-39	176.3	-72.1	179.2	164	-90.8	-5.1	112.8	I788 P789 S792 T793 Q794 M799 E800	I788-R796 HydrophobicContact CG2-CG 3.8Å; I788-R796 PolarHBondContact O-NE 3.36Å; I788-R796 PolarHBondContact O-NH2 3.43Å; P789-R796 PolarHBondContact O-NE 2.91Å; P789-R796 VanDerWaalsContact O-NE 3.11Å; S792-R796 PolarHBondContact O-N 3.46Å; S792-R796 VanDerWaalsContact O-N 3.07Å; T793-R796 PolarHBondContact O-N 3.29Å; Q794-R796 VanDerWaalsContact C-N 3.31Å; Q794-R796 PolarHBondContact O-N 2.97Å; R796-M799 PolarHBondContact O-N 2.84Å; R796-E800 WeakPolarHBondContact O-CB 3.33Å; R796-E800 PolarHBondContact O-N 2.79Å
797	Q	96.9	Very high	96.2	Very high	112 Å²	112	63.7 Å²	63.7	52%	0.523	32%	0.319	S	S	.	.	H	α-helix	trans	-67.3	-34.2	174	-74	174.6	-4.5	0	0	113.1	T793 Q794 R801	T793-Q797 WeakPolarHBondContact O-CG 3.44Å; T793-Q797 PolarHBondContact O-N 2.81Å; Q794-Q797 PolarHBondContact O-N 3.3Å; Q797-R801 WeakPolarHBondContact O-CB 3.35Å; Q797-R801 PolarHBondContact O-N 3.18Å; Q797-R801 VanDerWaalsContact O-N 3.13Å
798	V	97.7	Very high	95.9	Very high	34 Å²	34	60 Å²	60	21%	0.206	31%	0.312	C	S	.	.	H	α-helix	trans	-67.5	-47.8	171.8	170.9	0	0	0	0	110.2	I752 L754 Q794 A795 E800 R801 E802	I752-V798 WeakPolarHBondContact O-CG1 3.31Å; L754-V798 HydrophobicContact CD1-CG1 4.19Å; L754-V798 HydrophobicContact CG-CG1 4.27Å; Q794-V798 WeakPolarHBondContact O-CG2 3.37Å; Q794-V798 PolarHBondContact O-N 2.8Å; A795-V798 PolarHBondContact O-N 3.47Å; V798-E800 PolarHBondContact O-N 3.33Å; V798-R801 PolarHBondContact O-N 3.14Å; V798-E802 HydrophobicContact CG1-CG 4.34Å; V798-E802 WeakPolarHBondContact O-CB 3.42Å; V798-E802 WeakPolarHBondContact O-CG 3.18Å; V798-E802 PolarHBondContact O-N 3.22Å
799	M	97.8	Very high	95.7	Very high	1 Å²	1	65 Å²	65	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-57.8	-46.9	176.6	177.4	52.2	48.7	0	0	112.2	W748 V749 I752 L754 H779 L782 A783 L786 I788 A795 R796 F803	W748-M799 HydrophobicContact CH2-CE 4.45Å; W748-M799 HydrophobicContact CH2-SD 4.36Å; W748-M799 HydrophobicContact CZ3-CE 4.44Å; V749-M799 HydrophobicContact CG2-CE 4.45Å; I752-M799 HydrophobicContact CD1-CE 3.89Å; L754-M799 HydrophobicContact CD1-CB 4.07Å; L754-M799 HydrophobicContact CD1-CE 3.55Å; H779-M799 HydrophobicContact CB-CG 4.45Å; L782-M799 HydrophobicContact CB-SD 4.27Å; L782-M799 HydrophobicContact CD2-CE 4.47Å; L782-M799 HydrophobicContact CD2-SD 3.66Å; L782-M799 HydrophobicContact CG-SD 3.88Å; A783-M799 HydrophobicContact CB-CG 4.15Å; L786-M799 HydrophobicContact CD1-CE 3.4Å; L786-M799 HydrophobicContact CD1-SD 4.28Å; I788-M799 HydrophobicContact CD1-CB 4.45Å; A795-M799 WeakPolarHBondContact O-CB 3.08Å; A795-M799 PolarHBondContact O-N 3.08Å; R796-M799 PolarHBondContact O-N 2.84Å; M799-F803 WeakPolarHBondContact O-CB 3.48Å; M799-F803 PolarHBondContact O-N 3.42Å; M799-F803 HydrophobicContact SD-CB 4.46Å
800	E	96.6	Very high	95.4	Very high	85 Å²	85	62.6 Å²	62.6	40%	0.397	32%	0.324	S	S	.	.	H	α-helix	trans	-56.6	-53.7	175.3	178.4	176.6	-173.1	0	0	112.6	H779 R796 V798 N804	H779-E800 WeakPolarHBondContact ND1-CB 3.4Å; R796-E800 WeakPolarHBondContact O-CB 3.33Å; R796-E800 PolarHBondContact O-N 2.79Å; V798-E800 PolarHBondContact O-N 3.33Å; E800-N804 VanDerWaalsContact O-CG 3.28Å; E800-N804 PolarHBondContact O-N 2.86Å; E800-N804 VanDerWaalsContact O-N 3.14Å; E800-N804 PolarHBondContact O-ND2 2.88Å
801	R	97.3	Very high	95.3	Very high	153 Å²	153	59 Å²	59	58%	0.577	30%	0.302	S	S	*	.	H	α-helix	trans	-61	-51.8	-178.9	-176	-171	-55.3	154	7.4	111.9	Q797 V798 N804 N805	Q797-R801 WeakPolarHBondContact O-CB 3.35Å; Q797-R801 PolarHBondContact O-N 3.18Å; Q797-R801 VanDerWaalsContact O-N 3.13Å; V798-R801 PolarHBondContact O-N 3.14Å; R801-N804 PolarHBondContact O-N 2.75Å; R801-N805 WeakPolarHBondContact O-CB 3.39Å; R801-N805 PolarHBondContact O-N 3.12Å
802	E	97.2	Very high	94.7	Very high	42 Å²	42	59.1 Å²	59.1	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-76.9	-27.1	-173	-59.2	-50.2	141.8	0	0	112.3	W748 I752 V798 N805 L806	W748-E802 HydrophobicContact CZ2-CB 3.98Å; W748-E802 WeakPolarHBondContact CZ2-O 3.48Å; I752-E802 HydrophobicContact CB-CB 4.31Å; I752-E802 HydrophobicContact CB-CG 4.1Å; I752-E802 HydrophobicContact CD1-CB 4.1Å; I752-E802 HydrophobicContact CG2-CB 3.83Å; I752-E802 HydrophobicContact CG2-CG 3.87Å; V798-E802 HydrophobicContact CG1-CG 4.34Å; V798-E802 WeakPolarHBondContact O-CB 3.42Å; V798-E802 WeakPolarHBondContact O-CG 3.18Å; V798-E802 PolarHBondContact O-N 3.22Å; E802-N805 WeakPolarHBondContact O-CB 3.32Å; E802-N805 PolarHBondContact O-N 3.43Å; E802-N805 PolarHBondContact OE2-ND2 2.84Å; E802-L806 VanDerWaalsContact O-CB 3.25Å; E802-L806 WeakPolarHBondContact O-CB 3.37Å; E802-L806 PolarHBondContact O-N 2.88Å
803	F	97.1	Very high	94	Very high	3 Å²	3	59.8 Å²	59.8	1%	0.013	31%	0.305	C	S	.	.	H	α-helix	trans	-65	-42.1	169.3	-177	-92.8	0	0	0	111.5	W748 L771 F777 H779 L782 M799 N805 L806 L807	W748-F803 HydrophobicContact CH2-CB 4.46Å; L771-F803 HydrophobicContact CD2-CE2 4.32Å; F777-F803 HydrophobicContact CD1-CE2 4.32Å; F777-F803 HydrophobicContact CD1-CZ 4.31Å; F777-F803 HydrophobicContact CE1-CE2 4.42Å; H779-F803 HydrophobicContact CB-CB 3.85Å; H779-F803 HydrophobicContact CB-CD1 3.81Å; H779-F803 HydrophobicContact CB-CG 3.87Å; L782-F803 HydrophobicContact CD2-CD2 3.73Å; L782-F803 HydrophobicContact CD2-CE2 4.01Å; M799-F803 WeakPolarHBondContact O-CB 3.48Å; M799-F803 PolarHBondContact O-N 3.42Å; M799-F803 HydrophobicContact SD-CB 4.46Å; F803-N805 VanDerWaalsContact C-N 3.34Å; F803-N805 PolarHBondContact O-N 3.07Å; F803-L806 WeakPolarHBondContact O-CB 3.47Å; F803-L806 PolarHBondContact O-N 3.02Å; F803-L807 HydrophobicContact CD1-CD1 4.16Å; F803-L807 HydrophobicContact CD1-CG 4.32Å; F803-L807 HydrophobicContact CE1-CD1 3.6Å; F803-L807 HydrophobicContact CE1-CG 4.04Å; F803-L807 HydrophobicContact CZ-CD1 4.22Å; F803-L807 HydrophobicContact CZ-CG 4.43Å; F803-L807 WeakPolarHBondContact O-CG 3.45Å; F803-L807 PolarHBondContact O-N 3.49Å
804	N	95.3	Very high	92.4	Very high	62 Å²	62	65 Å²	65	33%	0.332	32%	0.32	S	S	.	.	H	α-helix	trans	-66.9	-36.2	175.3	-68.4	-20.5	0	0	0	111.7	E800 R801 L807 A808 L815	E800-N804 VanDerWaalsContact O-CG 3.28Å; E800-N804 PolarHBondContact O-N 2.86Å; E800-N804 VanDerWaalsContact O-N 3.14Å; E800-N804 PolarHBondContact O-ND2 2.88Å; R801-N804 PolarHBondContact O-N 2.75Å; N804-L807 PolarHBondContact O-N 3.42Å; N804-A808 VanDerWaalsContact O-CB 3.29Å; N804-A808 WeakPolarHBondContact O-CB 3.2Å; N804-A808 PolarHBondContact O-N 2.99Å; N804-L815 HydrophobicContact CB-CD2 4.35Å
805	N	95.4	Very high	90.6	Very high	60 Å²	60	62 Å²	62	32%	0.321	31%	0.309	S	S	.	.	H	α-helix	trans	-62.1	-46.3	170.9	-169.8	21.1	0	0	0	111.9	R801 E802 F803 L807 A808 L809	R801-N805 WeakPolarHBondContact O-CB 3.39Å; R801-N805 PolarHBondContact O-N 3.12Å; E802-N805 WeakPolarHBondContact O-CB 3.32Å; E802-N805 PolarHBondContact O-N 3.43Å; E802-N805 PolarHBondContact OE2-ND2 2.84Å; F803-N805 VanDerWaalsContact C-N 3.34Å; F803-N805 PolarHBondContact O-N 3.07Å; N805-L807 PolarHBondContact O-N 2.96Å; N805-A808 PolarHBondContact O-N 3.19Å; N805-L809 WeakPolarHBondContact O-CB 3.42Å; N805-L809 WeakPolarHBondContact O-CG 3.36Å; N805-L809 PolarHBondContact O-N 2.9Å; N805-L809 VanDerWaalsContact OD1-CD1 3.26Å; N805-L809 WeakPolarHBondContact OD1-CD1 3.37Å
806	L	95.9	Very high	88.5	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-58.4	-44	175.7	177	67.9	0	0	0	112	I734 V737 W740 W748 L771 E802 F803 G810	I734-L806 HydrophobicContact CG2-CD1 3.84Å; V737-L806 HydrophobicContact CG1-CD1 4.41Å; V737-L806 HydrophobicContact CG2-CD1 3.44Å; V737-L806 VanDerWaalsContact CG2-CD1 3.44Å; V737-L806 HydrophobicContact CG2-CG 4.13Å; W740-L806 HydrophobicContact CE3-CD1 4.4Å; W740-L806 HydrophobicContact CH2-CD1 3.5Å; W740-L806 HydrophobicContact CZ2-CD1 4.28Å; W740-L806 HydrophobicContact CZ3-CD1 3.56Å; W748-L806 HydrophobicContact CD2-CD2 4.09Å; W748-L806 HydrophobicContact CE3-CD2 4.11Å; W748-L806 HydrophobicContact CH2-CD2 3.85Å; W748-L806 HydrophobicContact CZ2-CB 3.91Å; W748-L806 HydrophobicContact CZ2-CD2 3.8Å; W748-L806 HydrophobicContact CZ2-CG 4.36Å; W748-L806 HydrophobicContact CZ3-CD2 4Å; L771-L806 HydrophobicContact CD1-CD2 3.9Å; E802-L806 VanDerWaalsContact O-CB 3.25Å; E802-L806 WeakPolarHBondContact O-CB 3.37Å; E802-L806 PolarHBondContact O-N 2.88Å; F803-L806 WeakPolarHBondContact O-CB 3.47Å; F803-L806 PolarHBondContact O-N 3.02Å; L806-G810 VanDerWaalsContact O-CA 3.3Å; L806-G810 WeakPolarHBondContact O-CA 3.42Å; L806-G810 PolarHBondContact O-N 3.43Å
807	L	94.1	Very high	85.9	Confident	7 Å²	7	72.4 Å²	72.4	4%	0.037	37%	0.366	C	S	.	.	H	α-helix	trans	-66.2	-46.8	175.4	-68.6	-169.2	0	0	0	111.9	F803 N804 N805 L809 T811 L815	F803-L807 HydrophobicContact CD1-CD1 4.16Å; F803-L807 HydrophobicContact CD1-CG 4.32Å; F803-L807 HydrophobicContact CE1-CD1 3.6Å; F803-L807 HydrophobicContact CE1-CG 4.04Å; F803-L807 HydrophobicContact CZ-CD1 4.22Å; F803-L807 HydrophobicContact CZ-CG 4.43Å; F803-L807 WeakPolarHBondContact O-CG 3.45Å; F803-L807 PolarHBondContact O-N 3.49Å; N804-L807 PolarHBondContact O-N 3.42Å; N805-L807 PolarHBondContact O-N 2.96Å; L807-L809 PolarHBondContact O-N 2.83Å; L807-T811 HydrophobicContact CD2-CG2 3.85Å; L807-T811 PolarHBondContact O-N 3.16Å; L807-T811 PolarHBondContact O-OG1 3.05Å; L807-L815 HydrophobicContact CB-CD2 4.47Å
808	A	92.4	Very high	83.6	Confident	60 Å²	60	70 Å²	70	50%	0.496	37%	0.372	S	S	.	.	H	α-helix	trans	-68.9	-30.5	-174.9	0	0	0	0	0	114.3	N804 N805 L815	N804-A808 VanDerWaalsContact O-CB 3.29Å; N804-A808 WeakPolarHBondContact O-CB 3.2Å; N804-A808 PolarHBondContact O-N 2.99Å; N805-A808 PolarHBondContact O-N 3.19Å; A808-L815 HydrophobicContact CB-CD1 4.45Å
809	L	92.4	Very high	80.8	Confident	107 Å²	107	77.4 Å²	77.4	56%	0.56	40%	0.404	S	S	*	.	H	α-helix	trans	-92.4	-32.5	176	-63.5	179.6	0	0	0	113	I734 N805 L807	I734-L809 HydrophobicContact CB-CB 4.46Å; I734-L809 HydrophobicContact CB-CD1 4.37Å; I734-L809 HydrophobicContact CG2-CB 3.9Å; I734-L809 HydrophobicContact CG2-CD1 4.34Å; N805-L809 WeakPolarHBondContact O-CB 3.42Å; N805-L809 WeakPolarHBondContact O-CG 3.36Å; N805-L809 PolarHBondContact O-N 2.9Å; N805-L809 VanDerWaalsContact OD1-CD1 3.26Å; N805-L809 WeakPolarHBondContact OD1-CD1 3.37Å; L807-L809 PolarHBondContact O-N 2.83Å
810	G	89.7	Confident	78.2	Confident	8 Å²	8	84.7 Å²	84.7	8%	0.082	44%	0.438	C	S	.	.	H	α-helix	trans	-107.8	-5.9	-165.6	0	0	0	0	0	116.6	V737 L806	V737-G810 PolarHBondContact N-O 2.94Å; L806-G810 VanDerWaalsContact O-CA 3.3Å; L806-G810 WeakPolarHBondContact O-CA 3.42Å; L806-G810 PolarHBondContact O-N 3.43Å
811	T	90.7	Very high	75.7	Confident	25 Å²	25	89.1 Å²	89.1	15%	0.153	46%	0.456	C	S	.	.			trans	-144.7	162.5	-172.6	77.2	0	0	0	0	113.6	V737 A772 L807 R813	V737-T811 HydrophobicContact CB-CG2 3.89Å; V737-T811 HydrophobicContact CG1-CG2 4.27Å; V737-T811 HydrophobicContact CG2-CG2 4.49Å; A772-T811 HydrophobicContact CB-CG2 3.75Å; L807-T811 HydrophobicContact CD2-CG2 3.85Å; L807-T811 PolarHBondContact O-N 3.16Å; L807-T811 PolarHBondContact O-OG1 3.05Å; T811-R813 VanDerWaalsContact C-N 3.26Å; T811-R813 PolarHBondContact O-N 2.94Å; T811-R813 WeakPolarHBondContact OG1-CB 3.46Å; T811-R813 PolarHBondContact OG1-N 3.44Å; T811-R813 VanDerWaalsContact OG1-N 3.16Å
812	D	82.8	Confident	72.8	Confident	155 Å²	155	86.5 Å²	86.5	83%	0.829	46%	0.457	S	S	*	.	S	Bend	trans	-82.4	7.1	168.9	-47.9	-65.4	0	0	0	113.6	K814	D812-K814 PolarHBondContact O-N 2.95Å
813	R	79.9	Confident	70	Confident	44 Å²	44	94.6 Å²	94.6	17%	0.166	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-70.4	126.3	-179.5	-73.1	-180	63	179.5	3.6	109.4	L771 D774 E775 F777 T811	L771-R813 WeakPolarHBondContact O-CD 3.44Å; L771-R813 PolarHBondContact O-NH1 2.87Å; D774-R813 PolarHBondContact O-NH1 2.77Å; D774-R813 PolarHBondContact O-NH2 2.89Å; E775-R813 PolarHBondContact O-NH2 3.45Å; F777-R813 PolarHBondContact O-NH1 2.93Å; F777-R813 PolarHBondContact O-NH2 3.3Å; T811-R813 VanDerWaalsContact C-N 3.26Å; T811-R813 PolarHBondContact O-N 2.94Å; T811-R813 WeakPolarHBondContact OG1-CB 3.46Å; T811-R813 PolarHBondContact OG1-N 3.44Å; T811-R813 VanDerWaalsContact OG1-N 3.16Å
814	K	61.2	Low	67.4	Low	201 Å²	201	104.8 Å²	104.8	87%	0.874	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-64.2	140.6	165.7	-70.2	-168.2	172.3	-165.4	0	109.5	D812	D812-K814 PolarHBondContact O-N 2.95Å
815	L	58.6	Low	64.8	Low	90 Å²	90	113.5 Å²	113.5	47%	0.471	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-68.1	140.3	164.2	-58.6	177.1	0	0	0	108.9	N804 L807 A808 D817	N804-L815 HydrophobicContact CB-CD2 4.35Å; L807-L815 HydrophobicContact CB-CD2 4.47Å; A808-L815 HydrophobicContact CB-CD1 4.45Å; L815-D817 PolarHBondContact O-N 3.34Å
816	D	53.4	Low	61.9	Low	121 Å²	121	114.1 Å²	114.1	65%	0.647	57%	0.572	S	S	*	*			trans	-85.2	86.1	176.4	-170	45.9	0	0	0	108.5	G818	D816-G818 PolarHBondContact O-N 3.29Å
817	D	41.4	Very low	58.9	Low	151 Å²	151	117.5 Å²	117.5	81%	0.807	59%	0.594	S	S	*	*			trans	-59.6	109.8	165.8	-78.6	-43.6	0	0	0	107.4	L815 E819	L815-D817 PolarHBondContact O-N 3.34Å; D817-E819 PolarHBondContact O-N 3.18Å
818	G	48.9	Very low	56.4	Low	62 Å²	62	120.5 Å²	120.5	64%	0.639	62%	0.615	S	S	*	*	S	Bend	trans	-72.7	31.5	-148.6	0	0	0	0	0	119	D816	D816-G818 PolarHBondContact O-N 3.29Å
819	E	39.4	Very low	53.9	Low	189 Å²	189	124.9 Å²	124.9	88%	0.883	62%	0.619	S	S	*	*	S	Bend	trans	-108.2	25.8	-171.3	-65.2	-156.2	143.3	0	0	116.2	D817	D817-E819 PolarHBondContact O-N 3.18Å
820	E	42.6	Very low	51.5	Low	154 Å²	154	128.5 Å²	128.5	72%	0.72	63%	0.625	S	S	*	*			trans	-149.5	58.7	162.6	-137.4	-174	-148.7	0	0	117.2	V822	E820-V822 HydrophobicContact CG-CG2 4.13Å; E820-V822 PolarHBondContact O-N 3.16Å
821	K	43	Very low	49	Very low	178 Å²	178	136.7 Å²	136.7	77%	0.774	66%	0.659	S	S	*	*			trans	-75.3	59.1	170.6	-79.4	-179	178.2	167	0	114.2
822	V	37.1	Very low	46.8	Very low	97 Å²	97	141.7 Å²	141.7	59%	0.588	68%	0.675	S	S	*	*			trans	-75.7	125.3	162.2	176.5	0	0	0	0	109.1	E820 R824	E820-V822 HydrophobicContact CG-CG2 4.13Å; E820-V822 PolarHBondContact O-N 3.16Å; V822-R824 VanDerWaalsContact C-N 3.34Å; V822-R824 PolarHBondContact O-N 2.89Å
823	F	39.5	Very low	44.9	Very low	213 Å²	213	139.8 Å²	139.8	93%	0.934	66%	0.659	S	S	*	*			trans	-62.6	81.7	-178.7	-89.3	-95.6	0	0	0	113.4	R825	F823-R825 PolarHBondContact O-N 3.16Å
824	R	42.3	Very low	42.9	Very low	217 Å²	217	148 Å²	148	82%	0.819	69%	0.69	S	S	*	*			trans	-78.9	115.3	168.2	-68.2	-165.5	-170.8	-100.2	3.2	110.3	V822 A826	V822-R824 VanDerWaalsContact C-N 3.34Å; V822-R824 PolarHBondContact O-N 2.89Å; R824-A826 PolarHBondContact O-N 3.14Å
825	R	39.9	Very low	41.4	Very low	244 Å²	244	144.1 Å²	144.1	92%	0.921	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-57.2	129.5	172.1	-158.3	180	-150.3	130.3	2.3	109.9	F823	F823-R825 PolarHBondContact O-N 3.16Å
826	A	35.7	Very low	40.4	Very low	74 Å²	74	149.2 Å²	149.2	61%	0.612	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-52.1	129.7	-171.8	0	0	0	0	0	112.9	R824 S828	R824-A826 PolarHBondContact O-N 3.14Å; A826-S828 PolarHBondContact O-N 2.89Å
827	P	32.9	Very low	39.3	Very low	71 Å²	71	150 Å²	150	46%	0.461	70%	0.702	S	S	.	*	P	Polyproline II helix	trans	-63.2	137.1	178.6	-23.2	33.6	0	0	0	112.4	W829 R832	P827-W829 PolarHBondContact O-N 3.27Å; P827-R832 HydrophobicContact CB-CG 4.05Å; P827-R832 PolarHBondContact O-NE 3.03Å
828	S	40.8	Very low	38.9	Very low	69 Å²	69	150.9 Å²	150.9	48%	0.483	70%	0.702	S	S	.	*	P	Polyproline II helix	trans	-49.4	137.2	169.9	175.3	0	0	0	0	110.7	A826 R830 K831	A826-S828 PolarHBondContact O-N 2.89Å; S828-R830 PolarHBondContact O-N 2.7Å; S828-R830 VanDerWaalsContact O-N 3.12Å; S828-K831 WeakPolarHBondContact O-CA 3.41Å; S828-K831 WeakPolarHBondContact O-CB 3.43Å; S828-K831 PolarHBondContact O-N 3.34Å
829	W	39.1	Very low	38.2	Very low	152 Å²	152	156.6 Å²	156.6	58%	0.576	71%	0.711	S	S	*	*	H	α-helix	trans	-48	-42.1	-178.7	55.8	-80.8	0	0	0	112.7	P827 K831 R832 F833	P827-W829 PolarHBondContact O-N 3.27Å; W829-K831 PolarHBondContact O-N 3.42Å; W829-K831 VanDerWaalsContact O-N 3.11Å; W829-R832 PolarHBondContact O-N 3.1Å; W829-F833 HydrophobicContact CB-CE2 4.13Å; W829-F833 WeakPolarHBondContact O-CD2 3.32Å
830	R	42.6	Very low	37.9	Very low	184 Å²	184	152.3 Å²	152.3	69%	0.694	70%	0.702	S	S	*	*	H	α-helix	trans	-60.6	-20.3	176.8	-63.2	-174	-176.2	-107.6	7.5	114.8	S828	S828-R830 PolarHBondContact O-N 2.7Å; S828-R830 VanDerWaalsContact O-N 3.12Å
831	K	38.2	Very low	37.2	Very low	179 Å²	179	149 Å²	149	78%	0.778	71%	0.709	S	S	*	*	H	α-helix	trans	-90.3	-17	172.9	-75.9	-169.3	173.7	-175.2	0	113.7	S828 W829	S828-K831 WeakPolarHBondContact O-CA 3.41Å; S828-K831 WeakPolarHBondContact O-CB 3.43Å; S828-K831 PolarHBondContact O-N 3.34Å; W829-K831 PolarHBondContact O-N 3.42Å; W829-K831 VanDerWaalsContact O-N 3.11Å
832	R	42.9	Very low	36.6	Very low	130 Å²	130	144.1 Å²	144.1	49%	0.491	71%	0.709	S	S	.	*	H	α-helix	trans	-87.2	-6.8	177.6	-67.2	-163.6	-92.5	179.4	1.5	114	P827 W829	P827-R832 HydrophobicContact CB-CG 4.05Å; P827-R832 PolarHBondContact O-NE 3.03Å; W829-R832 PolarHBondContact O-N 3.1Å
833	F	44.6	Very low	36.4	Very low	115 Å²	115	148.1 Å²	148.1	50%	0.504	72%	0.724	S	S	.	*			trans	-121.8	42.7	-174.1	-58.1	-53.2	0	0	0	114.1	M711 W829	M711-F833 HydrophobicContact CE-CE1 4.27Å; M711-F833 HydrophobicContact SD-CE1 3.98Å; W829-F833 HydrophobicContact CB-CE2 4.13Å; W829-F833 WeakPolarHBondContact O-CD2 3.32Å
834	R	37.7	Very low	35.9	Very low	218 Å²	218	146 Å²	146	82%	0.823	72%	0.721	S	S	*	*	S	Bend	trans	-85.5	147.4	158	-74.3	-164.9	174	-153.1	-1.2	109.5
835	P	29.8	Very low	35.6	Very low	119 Å²	119	139.2 Å²	139.2	77%	0.773	72%	0.719	S	S	*	*			trans	-52.1	140.4	162	-22.8	34.1	0	0	0	109.8
836	R	36.3	Very low	35	Very low	197 Å²	197	133 Å²	133	74%	0.743	71%	0.708	S	S	*	*			trans	-97	109.8	177.7	-175.8	173.8	-179.2	165.7	-2.6	108.3	H838	R836-H838 PolarHBondContact O-CE1 3.4Å; R836-H838 PolarHBondContact O-N 3.14Å; R836-H838 PolarHBondContact O-ND1 3.11Å
837	D	29.8	Very low	34.6	Very low	136 Å²	136	135.1 Å²	135.1	73%	0.727	72%	0.719	S	S	*	*			trans	-62.1	126	175.6	-57.7	-61	0	0	0	109.8	H839	D837-H839 PolarHBondContact O-N 2.64Å
838	H	33.3	Very low	34.5	Very low	171 Å²	171	136.9 Å²	136.9	79%	0.792	74%	0.739	S	S	*	*	S	Bend	trans	-81	41.6	-168.8	-79.2	53	0	0	0	113.5	R836	R836-H838 PolarHBondContact O-CE1 3.4Å; R836-H838 PolarHBondContact O-N 3.14Å; R836-H838 PolarHBondContact O-ND1 3.11Å
839	H	34.9	Very low	34.2	Very low	182 Å²	182	142.1 Å²	142.1	84%	0.843	76%	0.756	S	S	*	*			trans	-133.9	41.8	-172	-70.4	110.1	0	0	0	114.5	D837	D837-H839 PolarHBondContact O-N 2.64Å
840	S	33	Very low	34.1	Very low	99 Å²	99	140.8 Å²	140.8	69%	0.692	76%	0.764	S	S	*	*			trans	-151	100.4	168.5	63.2	0	0	0	0	112.3
841	G	28.7	Very low	33.6	Very low	83 Å²	83	140.3 Å²	140.3	86%	0.856	78%	0.775	S	S	*	*			trans	-153	4.8	-173.2	0	0	0	0	0	117.5
842	G	28.9	Very low	33.5	Very low	76 Å²	76	137.4 Å²	137.4	78%	0.784	77%	0.774	S	S	*	*			trans	75.6	174	180	0	0	0	0	0	114.6
843	M	33.6	Very low	33.1	Very low	182 Å²	182	136.2 Å²	136.2	90%	0.897	79%	0.792	S	S	*	*			cis	-161.3	125.9	-11.5	179.2	-177.9	75.9	0	0	109.4
844	L	29.2	Very low	32.9	Very low	168 Å²	168	133.9 Å²	133.9	88%	0.88	80%	0.8	S	S	*	*			trans	-153.2	120.4	156.9	-98.2	-177.6	0	0	0	109.5
845	G	34.8	Very low	32.9	Very low	74 Å²	74	133.6 Å²	133.6	76%	0.763	81%	0.805	S	S	*	*			trans	-118.5	111.9	170.8	0	0	0	0	0	109.8
846	T	28.2	Very low	33.1	Very low	114 Å²	114	139.3 Å²	139.3	70%	0.699	81%	0.812	S	S	*	*			trans	-147.5	139.1	173.7	50	0	0	0	0	110.6
847	S	27.5	Very low	32.9	Very low	119 Å²	119	137 Å²	137	83%	0.832	82%	0.819	S	S	*	*			trans	58.7	82.2	156.6	-51	0	0	0	0	117.5
848	A	31.7	Very low	33	Very low	107 Å²	107	136.1 Å²	136.1	88%	0.884	82%	0.824	S	S	*	*			trans	-93.4	96.6	158.1	0	0	0	0	0	109.9
849	E	34.5	Very low	32.9	Very low	179 Å²	179	134.3 Å²	134.3	84%	0.836	83%	0.825	S	S	*	*			trans	-155	157.6	170.8	-137	167.6	-144.4	0	0	112.6
850	T	35.6	Very low	32.9	Very low	124 Å²	124	134.1 Å²	134.1	76%	0.761	83%	0.829	S	S	*	*			trans	66.6	83.4	173.7	63.5	0	0	0	0	119.5
851	L	33	Very low	33.3	Very low	174 Å²	174	132.2 Å²	132.2	91%	0.911	83%	0.825	S	S	*	*			trans	-143.5	155.6	134.1	-87.2	-167.2	0	0	0	109.6
852	P	34.8	Very low	33.7	Very low	119 Å²	119	135 Å²	135	77%	0.773	83%	0.827	S	S	*	*			trans	-87.1	169.7	-154.2	33.4	-37.6	0	0	0	116.2	G854	P852-G854 PolarHBondContact O-N 3.32Å
853	A	36	Very low	33.9	Very low	105 Å²	105	139.5 Å²	139.5	87%	0.868	83%	0.833	S	S	*	*			trans	-73.5	114.5	-178	0	0	0	0	0	112.9
854	G	39.8	Very low	34.1	Very low	65 Å²	65	139.8 Å²	139.8	67%	0.67	83%	0.832	S	S	*	*	S	Bend	trans	-126.8	-39.4	169	0	0	0	0	0	113.9	P852	P852-G854 PolarHBondContact O-N 3.32Å
855	F	37	Very low	34.8	Very low	212 Å²	212	137.1 Å²	137.1	93%	0.93	83%	0.825	S	S	*	*			trans	-132.3	103.1	-178.5	-73.4	-89	0	0	0	111.6
856	R	35.1	Very low	35.4	Very low	240 Å²	240	139.4 Å²	139.4	91%	0.906	83%	0.826	S	S	*	*			trans	-130.6	123	162.4	-78.4	-170.2	175.4	-162.1	0.1	108.8
857	V	31.6	Very low	36	Very low	148 Å²	148	140.2 Å²	140.2	90%	0.897	83%	0.834	S	S	*	*			trans	-132.1	149.6	163.9	-179.6	0	0	0	0	107.2
858	S	32.1	Very low	36.8	Very low	118 Å²	118	139 Å²	139	83%	0.825	83%	0.831	S	S	*	*			trans	-80.1	160.6	-151.4	-57.3	0	0	0	0	117
859	T	31.7	Very low	37.5	Very low	132 Å²	132	139.7 Å²	139.7	81%	0.81	83%	0.826	S	S	*	*			trans	-65.6	143.4	177.1	48.7	0	0	0	0	114.9
860	L	34.2	Very low	37.9	Very low	179 Å²	179	137.2 Å²	137.2	94%	0.937	83%	0.826	S	S	*	*			trans	-133.2	159.6	147.1	-75.8	178.7	0	0	0	109.6
861	G	40.6	Very low	37.9	Very low	58 Å²	58	141.3 Å²	141.3	60%	0.598	83%	0.833	S	S	*	*			trans	-82.9	-177.7	-167.5	0	0	0	0	0	116.5
862	P	38.1	Very low	37.9	Very low	141 Å²	141	142.2 Å²	142.2	92%	0.916	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-69.8	140.3	-176.1	29.1	-35.2	0	0	0	112.9
863	L	32.4	Very low	37.7	Very low	172 Å²	172	144.1 Å²	144.1	90%	0.901	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-100.9	149.7	-179	-74.1	166.9	0	0	0	112.7
864	Q	38.6	Very low	37.5	Very low	187 Å²	187	146.5 Å²	146.5	87%	0.874	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-74.5	159.2	174.7	-77.7	179.2	-98.8	0	0	113.1
865	P	44.3	Very low	37.7	Very low	113 Å²	113	149.3 Å²	149.3	73%	0.734	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-69.4	150.9	168.4	30.5	-35.8	0	0	0	112.6
866	P	45.7	Very low	37.5	Very low	122 Å²	122	147.4 Å²	147.4	79%	0.792	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-80.1	161.9	-176.7	32.5	-36.3	0	0	0	114.3
867	P	42.3	Very low	37.3	Very low	131 Å²	131	140.5 Å²	140.5	85%	0.851	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-87.8	166.6	-172.7	35.9	-37.5	0	0	0	115.1
868	A	43.4	Very low	37.2	Very low	93 Å²	93	141.8 Å²	141.8	77%	0.769	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-83.3	153.5	177.3	0	0	0	0	0	113.7
869	P	46.9	Very low	37.2	Very low	121 Å²	121	140.7 Å²	140.7	79%	0.786	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-74.2	158.8	179.2	30.5	-35.7	0	0	0	113.9
870	P	41.9	Very low	37.1	Very low	128 Å²	128	141.2 Å²	141.2	83%	0.831	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-84.8	154	-166.9	33.4	-37	0	0	0	115.3
871	K	36.6	Very low	37	Very low	209 Å²	209	142.3 Å²	142.3	91%	0.909	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-77.4	150.5	171.4	-59.6	178.6	-179.9	-179.4	0	111.7
872	K	32	Very low	36.6	Very low	194 Å²	194	146.7 Å²	146.7	84%	0.843	80%	0.804	S	S	*	*			trans	-131.9	113.1	157.8	-86.1	-170.6	174.5	-177.7	0	111.5
873	I	32.2	Very low	36.4	Very low	159 Å²	159	150.9 Å²	150.9	82%	0.815	80%	0.804	S	S	*	*			trans	54.1	119.4	137.9	-58.1	168.3	0	0	0	118
874	M	32.2	Very low	36.3	Very low	154 Å²	154	145.3 Å²	145.3	76%	0.759	79%	0.788	S	S	*	*			trans	-84.5	173.7	164.6	-66.2	-169.4	69.6	0	0	111.8
875	P	42.8	Very low	35.9	Very low	125 Å²	125	145.6 Å²	145.6	81%	0.812	79%	0.789	S	S	*	*				-124.5	174.6	108.1	37.1	-34.1	0	0	0	113.9
876	E	32.9	Very low	35.7	Very low	172 Å²	172	148.2 Å²	148.2	80%	0.804	79%	0.793	S	S	*	*			trans	-88.2	154.6	-166.1	-62.5	158.7	100.4	0	0	114.8
877	A	30.1	Very low	35.1	Very low	95 Å²	95	150.8 Å²	150.8	79%	0.785	80%	0.799	S	S	*	*			trans	-148.8	146.3	147.6	0	0	0	0	0	109.4
878	H	31.1	Very low	34.6	Very low	174 Å²	174	149.9 Å²	149.9	81%	0.806	80%	0.796	S	S	*	*			trans	-74.9	172.5	176.7	-45.7	-62	0	0	0	110.7
879	S	30.6	Very low	34.3	Very low	96 Å²	96	149.4 Å²	149.4	67%	0.671	79%	0.792	S	S	*	*			cis	-163.3	148.2	20.5	-151.9	0	0	0	0	113.8
880	H	30.4	Very low	34	Very low	143 Å²	143	153.7 Å²	153.7	66%	0.662	80%	0.799	S	S	*	*			trans	38.9	138.8	139.1	-81	-104	0	0	0	124.5
881	Y	32	Very low	33.7	Very low	201 Å²	201	158.5 Å²	158.5	79%	0.788	80%	0.8	S	S	*	*			trans	69.4	150.7	155.2	-65.1	-54.6	0	0	0	117.6
882	L	33.3	Very low	33.8	Very low	150 Å²	150	159.1 Å²	159.1	79%	0.785	81%	0.814	S	S	*	*			cis	-145.8	161.7	4.4	-130.3	163.1	0	0	0	110.1
883	Y	32.7	Very low	33.9	Very low	230 Å²	230	157.4 Å²	157.4	90%	0.902	81%	0.812	S	S	*	*			trans	-135.6	141.6	172.6	-156.9	-83.9	0	0	0	109.7
884	G	30	Very low	34	Very low	55 Å²	55	157.3 Å²	157.3	57%	0.567	81%	0.812	S	S	*	*			trans	90.3	151.8	-167.8	0	0	0	0	0	112.2
885	H	30.4	Very low	34.1	Very low	193 Å²	193	157.5 Å²	157.5	89%	0.894	82%	0.815	S	S	*	*			cis	-138.6	159.8	11.9	-113.5	-101.9	0	0	0	111.9
886	M	40.5	Very low	33.6	Very low	168 Å²	168	159.4 Å²	159.4	83%	0.828	82%	0.815	S	S	*	*			trans	-75.8	132.8	158.3	-66.5	-173.6	-65.1	0	0	109.7
887	L	33.7	Very low	33.6	Very low	176 Å²	176	158.6 Å²	158.6	92%	0.921	82%	0.816	S	S	*	*				170	153.8	125.6	-93.2	164.7	0	0	0	112.9
888	S	32.2	Very low	33.8	Very low	112 Å²	112	162.9 Å²	162.9	78%	0.783	82%	0.818	S	S	*	*			trans	87.3	119.6	153.8	-145.4	0	0	0	0	121.5
889	A	36.5	Very low	34	Very low	82 Å²	82	162.1 Å²	162.1	68%	0.678	82%	0.819	S	S	*	*			trans	65.1	116.1	135	0	0	0	0	0	123.6
890	F	40	Very low	34.3	Very low	212 Å²	212	167.2 Å²	167.2	93%	0.93	83%	0.83	S	S	*	*				27.9	103	127	-81.3	-84.7	0	0	0	120.4
891	R	35.5	Very low	34.6	Very low	229 Å²	229	169.2 Å²	169.2	86%	0.864	84%	0.844	S	S	*	*				172	150.1	127.6	-101.5	178.7	171	178.6	-6.5	108.7
892	D	38.8	Very low	34.9	Very low	222 Å²	222	166.3 Å²	166.3	100%	1.187	85%	0.849	S	S	*	*			cis	-113.5	0	7.7	-67.4	-59.2	0	0	0	113.4

Retrieved 892 of 892 residues in 1486.3 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).