A0A068BGU5_MOUSE Loading...

Antigen peptide transporter 2

ABC transporter associated with antigen processing. In complex with TAP1 mediates unidirectional translocation of peptide antigens from cytosol to endoplasmic reticulum (ER) for loading onto MHC class I (MHCI) molecules. Uses the chemical energy of ATP to export peptides against the concentration gradient. During the transport cycle alternates between 'inward-facing' state with peptide binding site facing the cytosol to 'outward-facing' state with peptide binding site facing the ER lumen. Peptide antigen binding to ATP-loaded TAP1-TAP2 induces a switch to hydrolysis-competent 'outward-facing' conformation ready for peptide loading onto nascent MHCI molecules. Subsequently ATP hydrolysis resets the transporter to the 'inward facing' state for a new cycle. As a component of the peptide loading complex (PLC), acts as a molecular scaffold essential for peptide-MHCI assembly and antigen presentation.

AlphaFold DB , UniProt , Accession A0A068BGU5, Species MOUSE (Mus musculus, Mouse), Gene Tap2, Length 703 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.5	Very low	51.1	Low	238 Å²	238	110 Å²	110	100%	1.172	57%	0.567	S	S	*	*				0	111.1	0	-110.7	169.4	167.9	0	0	107.2
2	A	32.7	Very low	52.6	Low	66 Å²	66	102.1 Å²	102.1	55%	0.545	53%	0.527	S	S	.	.			trans	-78.7	149.4	-166.1	0	0	0	0	0	113	S4 Y5	A2-S4 PolarHBondContact O-N 3.31Å; A2-Y5 PolarHBondContact O-N 2.98Å
3	L	35.1	Very low	53.7	Low	154 Å²	154	97.6 Å²	97.6	81%	0.806	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-53.9	-9.3	175.3	-86.5	106.5	0	0	0	115.2	Y5 L6	L3-Y5 VanDerWaalsContact C-N 3.28Å; L3-Y5 PolarHBondContact O-N 3.15Å; L3-L6 PolarHBondContact O-N 3.26Å
4	S	43.6	Very low	54.8	Low	84 Å²	84	99.1 Å²	99.1	59%	0.587	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-68	-20.3	-179.9	52	0	0	0	0	114.5	A2	A2-S4 PolarHBondContact O-N 3.31Å
5	Y	52.3	Low	55.6	Low	135 Å²	135	94.9 Å²	94.9	53%	0.529	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-82.6	-15.1	178.7	-75.6	-85.6	0	0	0	114.6	A2 L3 L61	A2-Y5 PolarHBondContact O-N 2.98Å; L3-Y5 VanDerWaalsContact C-N 3.28Å; L3-Y5 PolarHBondContact O-N 3.15Å; Y5-L61 HydrophobicContact CE1-CD2 3.94Å
6	L	52.4	Low	56.6	Low	113 Å²	113	88.9 Å²	88.9	59%	0.592	47%	0.467	S	S	*	.	H	α-helix	trans	-81.3	-34.2	-174.6	-99	135.2	0	0	0	114	L3 W9 V10	L3-L6 PolarHBondContact O-N 3.26Å; L6-W9 WeakPolarHBondContact O-CB 3.4Å; L6-W9 PolarHBondContact O-N 2.73Å; L6-V10 PolarHBondContact O-N 3.24Å; L6-V10 VanDerWaalsContact O-N 3.14Å
7	R	55.6	Low	57.2	Low	214 Å²	214	87.2 Å²	87.2	81%	0.808	46%	0.456	S	S	*	.	H	α-helix	trans	-56.9	-46.8	-179	-85.8	-177.3	169.9	178.2	-3	115	W9 S11	R7-W9 VanDerWaalsContact C-N 3.26Å; R7-W9 PolarHBondContact O-N 2.59Å; R7-S11 PolarHBondContact O-N 3.18Å; R7-S11 PolarHBondContact O-OG 2.98Å
8	P	59.8	Low	57.8	Low	21 Å²	21	85.8 Å²	85.8	14%	0.136	46%	0.459	C	S	.	.	H	α-helix	trans	-69.9	-23.6	178.2	26.1	-34.1	0	0	0	113.2	S11 L12 L58 V62	P8-S11 VanDerWaalsContact CA-OG 3.32Å; P8-S11 WeakPolarHBondContact CA-OG 3.4Å; P8-S11 PolarHBondContact O-OG 3.04Å; P8-L12 WeakPolarHBondContact O-CB 3.44Å; P8-L12 PolarHBondContact O-N 3.43Å; P8-L58 HydrophobicContact CB-CD1 4.31Å; P8-L58 HydrophobicContact CB-CD2 4.17Å; P8-V62 HydrophobicContact CB-CG2 3.99Å
9	W	62.3	Low	58.5	Low	50 Å²	50	82.4 Å²	82.4	19%	0.189	44%	0.441	C	S	.	.	H	α-helix	trans	-72.9	-45.2	176.7	-123.7	85.9	0	0	0	112.2	L6 R7 S11 L12 L13 A110	L6-W9 WeakPolarHBondContact O-CB 3.4Å; L6-W9 PolarHBondContact O-N 2.73Å; R7-W9 VanDerWaalsContact C-N 3.26Å; R7-W9 PolarHBondContact O-N 2.59Å; W9-S11 VanDerWaalsContact C-N 3.33Å; W9-S11 PolarHBondContact O-N 3.11Å; W9-L12 PolarHBondContact O-N 2.91Å; W9-L13 HydrophobicContact CE3-CD1 3.6Å; W9-L13 HydrophobicContact CE3-CD2 4.39Å; W9-L13 HydrophobicContact CE3-CG 3.88Å; W9-L13 HydrophobicContact CZ3-CD1 3.7Å; W9-L13 HydrophobicContact CZ3-CD2 4.01Å; W9-L13 HydrophobicContact CZ3-CG 3.99Å; W9-L13 WeakPolarHBondContact O-CG 3.48Å; W9-L13 PolarHBondContact O-N 2.9Å; W9-A110 HydrophobicContact CH2-CB 3.73Å; W9-A110 HydrophobicContact CZ2-CB 4.12Å
10	V	62.5	Low	59	Low	75 Å²	75	78.7 Å²	78.7	46%	0.455	42%	0.421	S	S	.	.	H	α-helix	trans	-64.2	-39.3	178.3	175.6	0	0	0	0	111.2	L6 L14	L6-V10 PolarHBondContact O-N 3.24Å; L6-V10 VanDerWaalsContact O-N 3.14Å; V10-L14 HydrophobicContact CG1-CD1 3.95Å; V10-L14 HydrophobicContact CG1-CG 4.49Å; V10-L14 WeakPolarHBondContact O-CB 3.4Å; V10-L14 VanDerWaalsContact O-CG 3.26Å; V10-L14 WeakPolarHBondContact O-CG 3.45Å; V10-L14 PolarHBondContact O-N 3.15Å
11	S	65.5	Low	59.2	Low	60 Å²	60	77 Å²	77	42%	0.42	42%	0.422	S	S	.	.	H	α-helix	trans	-68.4	-36.8	177.5	45.9	0	0	0	0	113	R7 P8 W9 A15	R7-S11 PolarHBondContact O-N 3.18Å; R7-S11 PolarHBondContact O-OG 2.98Å; P8-S11 VanDerWaalsContact CA-OG 3.32Å; P8-S11 WeakPolarHBondContact CA-OG 3.4Å; P8-S11 PolarHBondContact O-OG 3.04Å; W9-S11 VanDerWaalsContact C-N 3.33Å; W9-S11 PolarHBondContact O-N 3.11Å; S11-A15 WeakPolarHBondContact O-CB 3.34Å; S11-A15 PolarHBondContact O-N 3.43Å
12	L	68.8	Low	60.3	Low	15 Å²	15	71.3 Å²	71.3	8%	0.079	40%	0.396	C	S	.	.	H	α-helix	trans	-68.1	-43.2	174.7	-170.4	149.7	0	0	0	112.4	P8 W9 A15 D16 L53 V62 L66 L69	P8-L12 WeakPolarHBondContact O-CB 3.44Å; P8-L12 PolarHBondContact O-N 3.43Å; W9-L12 PolarHBondContact O-N 2.91Å; L12-A15 PolarHBondContact O-N 3.37Å; L12-D16 WeakPolarHBondContact O-CB 3.19Å; L12-D16 PolarHBondContact O-N 3.34Å; L12-L53 HydrophobicContact CD1-CD1 3.65Å; L12-L53 HydrophobicContact CD1-CD2 4.3Å; L12-L53 HydrophobicContact CD1-CG 4.5Å; L12-V62 HydrophobicContact CD1-CB 4.38Å; L12-V62 HydrophobicContact CD1-CG1 3.25Å; L12-L66 HydrophobicContact CD1-CD1 3.83Å; L12-L69 HydrophobicContact CD2-CD1 4.33Å
13	L	67.3	Low	61.8	Low	44 Å²	44	68.9 Å²	68.9	23%	0.23	37%	0.373	C	S	.	.	H	α-helix	trans	-62.7	-41.1	175.8	-73.9	178.5	0	0	0	112.1	W9 D16 M17 Y106	W9-L13 HydrophobicContact CE3-CD1 3.6Å; W9-L13 HydrophobicContact CE3-CD2 4.39Å; W9-L13 HydrophobicContact CE3-CG 3.88Å; W9-L13 HydrophobicContact CZ3-CD1 3.7Å; W9-L13 HydrophobicContact CZ3-CD2 4.01Å; W9-L13 HydrophobicContact CZ3-CG 3.99Å; W9-L13 WeakPolarHBondContact O-CG 3.48Å; W9-L13 PolarHBondContact O-N 2.9Å; L13-D16 PolarHBondContact O-N 3.49Å; L13-M17 WeakPolarHBondContact O-CB 3.47Å; L13-M17 WeakPolarHBondContact O-CG 3.27Å; L13-M17 PolarHBondContact O-N 3.43Å; L13-Y106 HydrophobicContact CD2-CD1 3.35Å; L13-Y106 HydrophobicContact CD2-CE1 3.46Å; L13-Y106 VanDerWaalsContact CD2-CE1 3.46Å; L13-Y106 HydrophobicContact CD2-CG 3.97Å
14	L	68.4	Low	63.1	Low	118 Å²	118	68 Å²	68	62%	0.618	37%	0.365	S	S	*	.	H	α-helix	trans	-64.9	-40.3	176.2	-74.5	169.3	0	0	0	112	V10 A18	V10-L14 HydrophobicContact CG1-CD1 3.95Å; V10-L14 HydrophobicContact CG1-CG 4.49Å; V10-L14 WeakPolarHBondContact O-CB 3.4Å; V10-L14 VanDerWaalsContact O-CG 3.26Å; V10-L14 WeakPolarHBondContact O-CG 3.45Å; V10-L14 PolarHBondContact O-N 3.15Å; L14-A18 WeakPolarHBondContact O-CB 3.41Å; L14-A18 PolarHBondContact O-N 2.96Å
15	A	67.8	Low	64	Low	36 Å²	36	65.7 Å²	65.7	30%	0.298	36%	0.355	S	S	.	.	H	α-helix	trans	-65.9	-41.5	176.1	0	0	0	0	0	112.1	S11 L12 A18 L19 L49	S11-A15 WeakPolarHBondContact O-CB 3.34Å; S11-A15 PolarHBondContact O-N 3.43Å; L12-A15 PolarHBondContact O-N 3.37Å; A15-A18 PolarHBondContact O-N 2.88Å; A15-L19 WeakPolarHBondContact O-CB 3.42Å; A15-L19 PolarHBondContact O-N 2.66Å; A15-L49 HydrophobicContact CB-CD2 4.07Å
16	D	72.1	Confident	64	Low	0 Å²	0	64.1 Å²	64.1	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-68.5	-37.5	177.4	-174.9	49.3	0	0	0	112.3	L12 L13 L19 L20 R45 L49 Y106	L12-D16 WeakPolarHBondContact O-CB 3.19Å; L12-D16 PolarHBondContact O-N 3.34Å; L13-D16 PolarHBondContact O-N 3.49Å; D16-L19 PolarHBondContact O-N 3.33Å; D16-L20 WeakPolarHBondContact O-CB 3.22Å; D16-L20 WeakPolarHBondContact O-CG 3.37Å; D16-L20 PolarHBondContact O-N 2.75Å; D16-R45 IonicContact OD1-CZ 2.68Å; D16-R45 VanDerWaalsContact OD1-CZ 3.29Å; D16-R45 IonicContact OD1-NE 3.71Å; D16-R45 PolarHBondContact OD1-NE 3.06Å; D16-R45 IonicContact OD1-NH2 2.71Å; D16-R45 PolarHBondContact OD1-NH2 2.91Å; D16-R45 IonicContact OD2-CZ 3.59Å; D16-R45 IonicContact OD2-NH2 3.41Å; D16-R45 PolarHBondContact OD2-NH2 3.16Å; D16-L49 HydrophobicContact CB-CD1 4.09Å; D16-L49 HydrophobicContact CB-CD2 4.31Å; D16-Y106 WeakPolarHBondContact OD2-CE1 3.41Å; D16-Y106 PolarHBondContact OD2-OH 3.18Å
17	M	66.8	Low	64.2	Low	60 Å²	60	63.8 Å²	63.8	30%	0.296	36%	0.362	S	S	.	.	H	α-helix	trans	-65.7	-40.3	173.1	-73.3	-71.3	-111.5	0	0	112.5	L13 L19 G21 W99 Y106	L13-M17 WeakPolarHBondContact O-CB 3.47Å; L13-M17 WeakPolarHBondContact O-CG 3.27Å; L13-M17 PolarHBondContact O-N 3.43Å; M17-L19 VanDerWaalsContact C-N 3.3Å; M17-L19 PolarHBondContact O-N 2.71Å; M17-G21 PolarHBondContact O-N 3.02Å; M17-W99 HydrophobicContact CE-CE3 4.45Å; M17-W99 HydrophobicContact CE-CH2 3.3Å; M17-W99 HydrophobicContact CE-CZ2 3.7Å; M17-W99 HydrophobicContact CE-CZ3 3.73Å; M17-Y106 HydrophobicContact SD-CE2 4.36Å
18	A	67.8	Low	64.3	Low	61 Å²	61	53.7 Å²	53.7	50%	0.504	33%	0.325	S	S	.	.	H	α-helix	trans	-64.2	-37.8	174.1	0	0	0	0	0	111.7	L14 A15 G21 L22	L14-A18 WeakPolarHBondContact O-CB 3.41Å; L14-A18 PolarHBondContact O-N 2.96Å; A15-A18 PolarHBondContact O-N 2.88Å; A18-G21 PolarHBondContact O-N 3.47Å; A18-L22 PolarHBondContact O-N 3.2Å; A18-L22 VanDerWaalsContact O-N 3.1Å
19	L	70.6	Confident	64.2	Low	22 Å²	22	58.8 Å²	58.8	12%	0.115	35%	0.351	C	S	.	.	H	α-helix	trans	-73.7	-36.7	-179.8	-160.5	134.7	0	0	0	112.7	A15 D16 M17 G21 L22 L23 R45 V48	A15-L19 WeakPolarHBondContact O-CB 3.42Å; A15-L19 PolarHBondContact O-N 2.66Å; D16-L19 PolarHBondContact O-N 3.33Å; M17-L19 VanDerWaalsContact C-N 3.3Å; M17-L19 PolarHBondContact O-N 2.71Å; L19-G21 VanDerWaalsContact C-N 3.34Å; L19-L22 PolarHBondContact O-N 2.95Å; L19-L23 HydrophobicContact CD2-CD1 3.67Å; L19-L23 HydrophobicContact CD2-CG 4.45Å; L19-L23 WeakPolarHBondContact O-CG 3.35Å; L19-L23 PolarHBondContact O-N 2.97Å; L19-R45 HydrophobicContact CD2-CB 4.22Å; L19-R45 HydrophobicContact CD2-CG 3.55Å; L19-V48 HydrophobicContact CD1-CB 3.58Å; L19-V48 HydrophobicContact CD1-CG1 3.24Å; L19-V48 HydrophobicContact CD1-CG2 4.3Å
20	L	69	Low	64.1	Low	8 Å²	8	63.4 Å²	63.4	4%	0.042	38%	0.378	C	S	.	.	H	α-helix	trans	-61.7	-40.7	168.9	-81.7	178	0	0	0	112.1	D16 L22 L23 Q24 R45 A95 L102	D16-L20 WeakPolarHBondContact O-CB 3.22Å; D16-L20 WeakPolarHBondContact O-CG 3.37Å; D16-L20 PolarHBondContact O-N 2.75Å; L20-L22 VanDerWaalsContact C-N 3.34Å; L20-L22 PolarHBondContact O-N 3.44Å; L20-L23 PolarHBondContact O-N 2.92Å; L20-Q24 PolarHBondContact O-N 2.76Å; L20-R45 VanDerWaalsContact CD1-NH2 3.33Å; L20-A95 HydrophobicContact CD2-CB 4.16Å; L20-L102 HydrophobicContact CD1-CD2 4.11Å
21	G	62.6	Low	64.1	Low	43 Å²	43	61.4 Å²	61.4	44%	0.443	37%	0.365	S	S	.	.	H	α-helix	trans	-62.7	-37.6	174.5	0	0	0	0	0	113.2	M17 A18 L19 Q24	M17-G21 PolarHBondContact O-N 3.02Å; A18-G21 PolarHBondContact O-N 3.47Å; L19-G21 VanDerWaalsContact C-N 3.34Å; G21-Q24 PolarHBondContact O-N 2.78Å
22	L	63.8	Low	63.9	Low	119 Å²	119	61.8 Å²	61.8	62%	0.623	37%	0.366	S	S	*	.	H	α-helix	trans	-68.9	-38	174.3	-75.6	165.4	0	0	0	112.6	A18 L19 L20 Q24 G25	A18-L22 PolarHBondContact O-N 3.2Å; A18-L22 VanDerWaalsContact O-N 3.1Å; L19-L22 PolarHBondContact O-N 2.95Å; L20-L22 VanDerWaalsContact C-N 3.34Å; L20-L22 PolarHBondContact O-N 3.44Å; L22-Q24 VanDerWaalsContact C-N 3.29Å; L22-Q24 PolarHBondContact O-N 3.28Å; L22-G25 PolarHBondContact O-N 3.22Å
23	L	63.9	Low	63.3	Low	14 Å²	14	69.6 Å²	69.6	7%	0.073	40%	0.402	C	S	.	.	H	α-helix	trans	-72.7	-20.2	176.2	-74.5	167.1	0	0	0	113.2	L19 L20 G25 G28 E41 R45 A95	L19-L23 HydrophobicContact CD2-CD1 3.67Å; L19-L23 HydrophobicContact CD2-CG 4.45Å; L19-L23 WeakPolarHBondContact O-CG 3.35Å; L19-L23 PolarHBondContact O-N 2.97Å; L20-L23 PolarHBondContact O-N 2.92Å; L23-G25 VanDerWaalsContact C-N 3.29Å; L23-G28 WeakPolarHBondContact O-CA 3.36Å; L23-G28 PolarHBondContact O-N 3.36Å; L23-E41 HydrophobicContact CD1-CG 4.32Å; L23-R45 HydrophobicContact CD1-CG 3.79Å; L23-A95 HydrophobicContact CB-CB 4.43Å
24	Q	62.5	Low	63.1	Low	136 Å²	136	68.7 Å²	68.7	64%	0.636	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-18.1	172.3	-154	175.5	6.7	0	0	112.6	L20 G21 L22 A95	L20-Q24 PolarHBondContact O-N 2.76Å; G21-Q24 PolarHBondContact O-N 2.78Å; L22-Q24 VanDerWaalsContact C-N 3.29Å; L22-Q24 PolarHBondContact O-N 3.28Å; Q24-A95 HydrophobicContact CB-CB 4.38Å; Q24-A95 PolarHBondContact NE2-O 3.37Å
25	G	61.6	Low	62.7	Low	35 Å²	35	66.2 Å²	66.2	36%	0.361	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-150.6	178	0	0	0	0	0	114.8	L22 L23 L27 G28	L22-G25 PolarHBondContact O-N 3.22Å; L23-G25 VanDerWaalsContact C-N 3.29Å; G25-L27 PolarHBondContact O-N 2.74Å; G25-L27 VanDerWaalsContact O-N 3.09Å; G25-G28 PolarHBondContact O-N 3.24Å; G25-G28 VanDerWaalsContact O-N 3.07Å
26	S	53.5	Low	62.4	Low	103 Å²	103	68.4 Å²	68.4	72%	0.72	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-28	-171.1	53.5	0	0	0	0	115.5
27	L	56.4	Low	62.1	Low	105 Å²	105	68.7 Å²	68.7	55%	0.55	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-31.5	178.2	-83.6	156.6	0	0	0	113.5	G25 N29 L30	G25-L27 PolarHBondContact O-N 2.74Å; G25-L27 VanDerWaalsContact O-N 3.09Å; L27-N29 VanDerWaalsContact C-N 3.29Å; L27-N29 PolarHBondContact O-N 2.67Å; L27-L30 PolarHBondContact O-N 2.93Å
28	G	57.8	Low	62.1	Low	3 Å²	3	66.3 Å²	66.3	3%	0.031	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-68.2	-28.3	179.9	0	0	0	0	0	113.3	L23 G25 L30 L31 R93	L23-G28 WeakPolarHBondContact O-CA 3.36Å; L23-G28 PolarHBondContact O-N 3.36Å; G25-G28 PolarHBondContact O-N 3.24Å; G25-G28 VanDerWaalsContact O-N 3.07Å; G28-L30 PolarHBondContact O-N 3.23Å; G28-L31 PolarHBondContact O-N 2.99Å; G28-R93 PolarHBondContact O-NH1 3.17Å; G28-R93 VanDerWaalsContact O-NH1 3.13Å; G28-R93 PolarHBondContact O-NH2 3.27Å
29	N	58.5	Low	62.1	Low	127 Å²	127	67.9 Å²	67.9	68%	0.679	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-73.5	-11.5	-178.2	-74.3	-13.3	0	0	0	114.2	L27 R93	L27-N29 VanDerWaalsContact C-N 3.29Å; L27-N29 PolarHBondContact O-N 2.67Å; N29-R93 PolarHBondContact OD1-NH1 2.99Å
30	L	58.7	Low	62.2	Low	147 Å²	147	69.9 Å²	69.9	77%	0.77	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-89.4	-9.1	175.9	-68.4	165.3	0	0	0	113.3	L27 G28	L27-L30 PolarHBondContact O-N 2.93Å; G28-L30 PolarHBondContact O-N 3.23Å
31	L	62.9	Low	62.3	Low	33 Å²	33	69.9 Å²	69.9	17%	0.173	40%	0.396	C	S	.	.	S	Bend	trans	-90.7	136.7	-176.6	-72.8	165.2	0	0	0	112.3	G28 I40 R93	G28-L31 PolarHBondContact O-N 2.99Å; L31-I40 HydrophobicContact CD2-CB 4.04Å; L31-I40 HydrophobicContact CD2-CG2 3.3Å; L31-R93 PolarHBondContact O-NH2 3.49Å
32	P	61.3	Low	62.5	Low	69 Å²	69	68 Å²	68	45%	0.448	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-62.1	144.9	-179.6	24.8	-32.7	0	0	0	111.8	G37 I40	P32-G37 WeakPolarHBondContact O-CA 3.42Å; P32-I40 HydrophobicContact CG-CD1 3.91Å
33	Q	55.8	Low	62.8	Low	178 Å²	178	65.9 Å²	65.9	83%	0.832	37%	0.369	S	S	*	.	S	Bend	trans	-81	141.5	177.8	-63.3	-175.9	-0.7	0	0	111.1
34	G	63.1	Low	63.2	Low	25 Å²	25	69 Å²	69	26%	0.258	39%	0.385	S	S	.	.	S	Bend	trans	111.8	-170.9	178.9	0	0	0	0	0	114.7	P36 G37 L38	G34-P36 VanDerWaalsContact C-N 3.32Å; G34-G37 PolarHBondContact O-N 3.43Å; G34-L38 PolarHBondContact O-N 3Å
35	L	59.9	Low	63.7	Low	66 Å²	66	63 Å²	63	35%	0.346	36%	0.357	S	S	.	.	H	α-helix	trans	-51.2	-40	178	-73.5	167	0	0	0	114	G37 L38 W39 F77 A81	L35-G37 VanDerWaalsContact C-N 3.31Å; L35-G37 PolarHBondContact O-N 3.34Å; L35-L38 PolarHBondContact O-N 3.29Å; L35-W39 PolarHBondContact O-N 2.96Å; L35-F77 HydrophobicContact CD2-CB 4.28Å; L35-A81 HydrophobicContact CD1-CB 4.46Å
36	P	62.8	Low	64.4	Low	82 Å²	82	62.8 Å²	62.8	53%	0.532	35%	0.347	S	S	.	.	H	α-helix	trans	-63.1	-37.7	176.6	-20.2	32.4	0	0	0	112.4	G34 W39 I40	G34-P36 VanDerWaalsContact C-N 3.32Å; P36-W39 PolarHBondContact O-N 3.48Å; P36-I40 WeakPolarHBondContact O-CD1 3.44Å; P36-I40 VanDerWaalsContact O-CG1 3.25Å; P36-I40 WeakPolarHBondContact O-CG1 3.42Å; P36-I40 PolarHBondContact O-N 3.15Å
37	G	64.3	Low	65.2	Low	7 Å²	7	59.9 Å²	59.9	7%	0.072	33%	0.334	C	S	.	.	H	α-helix	trans	-63	-40.9	176.2	0	0	0	0	0	113	P32 G34 L35 I40 E41	P32-G37 WeakPolarHBondContact O-CA 3.42Å; G34-G37 PolarHBondContact O-N 3.43Å; L35-G37 VanDerWaalsContact C-N 3.31Å; L35-G37 PolarHBondContact O-N 3.34Å; G37-I40 PolarHBondContact O-N 2.91Å; G37-E41 WeakPolarHBondContact O-CB 3.44Å; G37-E41 PolarHBondContact O-N 3.38Å
38	L	67.6	Low	66	Low	9 Å²	9	57.9 Å²	57.9	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-65.6	-38.3	177.1	-75.5	172.9	0	0	0	112.9	G34 L35 G42 P74 V91 V94	G34-L38 PolarHBondContact O-N 3Å; L35-L38 PolarHBondContact O-N 3.29Å; L38-G42 PolarHBondContact O-N 3.02Å; L38-P74 HydrophobicContact CB-CB 4.31Å; L38-V91 HydrophobicContact CD1-CG1 3.31Å; L38-V91 HydrophobicContact CG-CG1 3.96Å; L38-V94 HydrophobicContact CD2-CG2 3.79Å
39	W	67.9	Low	66.6	Low	94 Å²	94	57.9 Å²	57.9	36%	0.356	33%	0.325	S	S	.	.	H	α-helix	trans	-69.6	-39.7	175.1	-83.4	95.6	0	0	0	111.7	L35 P36 G42 T43 L71 P74 L75 S78	L35-W39 PolarHBondContact O-N 2.96Å; P36-W39 PolarHBondContact O-N 3.48Å; W39-G42 PolarHBondContact O-N 2.61Å; W39-T43 WeakPolarHBondContact O-CB 3.39Å; W39-T43 VanDerWaalsContact O-CG2 3.3Å; W39-T43 WeakPolarHBondContact O-CG2 3.5Å; W39-T43 PolarHBondContact O-N 2.77Å; W39-T43 PolarHBondContact O-OG1 3.33Å; W39-L71 HydrophobicContact CE3-CD2 4.26Å; W39-L71 HydrophobicContact CZ3-CD2 4.16Å; W39-P74 HydrophobicContact CD2-CB 4.07Å; W39-P74 HydrophobicContact CG-CB 4.15Å; W39-L75 HydrophobicContact CH2-CG 4.12Å; W39-L75 HydrophobicContact CZ2-CG 4.27Å; W39-S78 PolarHBondContact NE1-OG 2.87Å; W39-S78 VanDerWaalsContact NE1-OG 3.14Å
40	I	71.5	Confident	67.2	Low	65 Å²	65	58 Å²	58	33%	0.333	32%	0.316	S	S	.	.	H	α-helix	trans	-65.2	-44.7	175	-62.8	163.1	0	0	0	110.3	L31 P32 P36 G37 G42 T43 L44	L31-I40 HydrophobicContact CD2-CB 4.04Å; L31-I40 HydrophobicContact CD2-CG2 3.3Å; P32-I40 HydrophobicContact CG-CD1 3.91Å; P36-I40 WeakPolarHBondContact O-CD1 3.44Å; P36-I40 VanDerWaalsContact O-CG1 3.25Å; P36-I40 WeakPolarHBondContact O-CG1 3.42Å; P36-I40 PolarHBondContact O-N 3.15Å; G37-I40 PolarHBondContact O-N 2.91Å; I40-G42 PolarHBondContact O-N 3.42Å; I40-T43 WeakPolarHBondContact CA-OG1 3.36Å; I40-T43 PolarHBondContact O-N 2.98Å; I40-T43 PolarHBondContact O-OG1 3.24Å; I40-L44 VanDerWaalsContact O-CB 3.28Å; I40-L44 WeakPolarHBondContact O-CB 3.34Å; I40-L44 PolarHBondContact O-N 3.08Å
41	E	71.5	Confident	67.6	Low	8 Å²	8	52.8 Å²	52.8	4%	0.037	30%	0.298	C	S	.	.	H	α-helix	trans	-58.5	-45.5	175.2	-169.4	-177.8	170.5	0	0	111.6	L23 G37 L44 R45 V94 A95	L23-E41 HydrophobicContact CD1-CG 4.32Å; G37-E41 WeakPolarHBondContact O-CB 3.44Å; G37-E41 PolarHBondContact O-N 3.38Å; E41-L44 PolarHBondContact O-N 3.43Å; E41-R45 VanDerWaalsContact O-CG 3.3Å; E41-R45 WeakPolarHBondContact O-CG 3.37Å; E41-R45 PolarHBondContact O-N 3Å; E41-V94 PolarHBondContact OE2-N 3.32Å; E41-A95 PolarHBondContact OE1-N 2.84Å
42	G	68	Low	67.9	Low	4 Å²	4	56 Å²	56	4%	0.041	31%	0.314	C	S	.	.	H	α-helix	trans	-65.7	-41.2	177.6	0	0	0	0	0	113.9	L38 W39 I40 L46 C70	L38-G42 PolarHBondContact O-N 3.02Å; W39-G42 PolarHBondContact O-N 2.61Å; I40-G42 PolarHBondContact O-N 3.42Å; G42-L46 WeakPolarHBondContact O-CB 3.31Å; G42-L46 PolarHBondContact O-N 3.39Å; G42-C70 WeakPolarHBondContact CA-O 3Å; G42-C70 WeakPolarHBondContact O-CB 3.35Å
43	T	68.5	Low	68.2	Low	74 Å²	74	53.7 Å²	53.7	45%	0.454	30%	0.298	S	S	.	.	H	α-helix	trans	-70.3	-34.3	177.5	53.1	0	0	0	0	112.9	W39 I40 L46 G47 L71	W39-T43 WeakPolarHBondContact O-CB 3.39Å; W39-T43 VanDerWaalsContact O-CG2 3.3Å; W39-T43 WeakPolarHBondContact O-CG2 3.5Å; W39-T43 PolarHBondContact O-N 2.77Å; W39-T43 PolarHBondContact O-OG1 3.33Å; I40-T43 WeakPolarHBondContact CA-OG1 3.36Å; I40-T43 PolarHBondContact O-N 2.98Å; I40-T43 PolarHBondContact O-OG1 3.24Å; T43-L46 PolarHBondContact O-N 3.24Å; T43-G47 PolarHBondContact O-N 3.46Å; T43-L71 HydrophobicContact CG2-CD2 4.39Å
44	L	73.1	Confident	68.7	Low	80 Å²	80	52.5 Å²	52.5	42%	0.419	29%	0.29	S	S	.	.	H	α-helix	trans	-71.2	-41.6	177.9	-144.2	146.6	0	0	0	111.2	I40 E41 L46 G47 V48	I40-L44 VanDerWaalsContact O-CB 3.28Å; I40-L44 WeakPolarHBondContact O-CB 3.34Å; I40-L44 PolarHBondContact O-N 3.08Å; E41-L44 PolarHBondContact O-N 3.43Å; L44-L46 VanDerWaalsContact C-N 3.35Å; L44-L46 PolarHBondContact O-N 3.48Å; L44-G47 PolarHBondContact O-N 2.88Å; L44-V48 HydrophobicContact CD2-CG2 4.32Å; L44-V48 WeakPolarHBondContact O-CG2 3.38Å; L44-V48 PolarHBondContact O-N 3.16Å; L44-V48 VanDerWaalsContact O-N 3.09Å
45	R	73.6	Confident	68.9	Low	10 Å²	10	57.8 Å²	57.8	4%	0.038	32%	0.317	C	S	.	.	H	α-helix	trans	-58.8	-45.7	170.4	-73.2	175.8	76.7	-177.5	2	111.8	D16 L19 L20 L23 E41 G47 L49 C70	D16-R45 IonicContact OD1-CZ 2.68Å; D16-R45 VanDerWaalsContact OD1-CZ 3.29Å; D16-R45 IonicContact OD1-NE 3.71Å; D16-R45 PolarHBondContact OD1-NE 3.06Å; D16-R45 IonicContact OD1-NH2 2.71Å; D16-R45 PolarHBondContact OD1-NH2 2.91Å; D16-R45 IonicContact OD2-CZ 3.59Å; D16-R45 IonicContact OD2-NH2 3.41Å; D16-R45 PolarHBondContact OD2-NH2 3.16Å; L19-R45 HydrophobicContact CD2-CB 4.22Å; L19-R45 HydrophobicContact CD2-CG 3.55Å; L20-R45 VanDerWaalsContact CD1-NH2 3.33Å; L23-R45 HydrophobicContact CD1-CG 3.79Å; E41-R45 VanDerWaalsContact O-CG 3.3Å; E41-R45 WeakPolarHBondContact O-CG 3.37Å; E41-R45 PolarHBondContact O-N 3Å; R45-G47 PolarHBondContact O-N 3.37Å; R45-L49 VanDerWaalsContact O-CB 3.29Å; R45-L49 WeakPolarHBondContact O-CB 3.26Å; R45-L49 VanDerWaalsContact O-CG 3.31Å; R45-L49 WeakPolarHBondContact O-CG 3.48Å; R45-L49 PolarHBondContact O-N 2.04Å; R45-C70 HydrophobicContact CB-CB 4.42Å
46	L	75	Confident	68.9	Low	29 Å²	29	57 Å²	57	15%	0.152	33%	0.325	C	S	.	.	H	α-helix	trans	-60.7	-45.8	178	-172.6	153	0	0	0	111.6	G42 T43 L44 W50 L66 P67 C70 L71	G42-L46 WeakPolarHBondContact O-CB 3.31Å; G42-L46 PolarHBondContact O-N 3.39Å; T43-L46 PolarHBondContact O-N 3.24Å; L44-L46 VanDerWaalsContact C-N 3.35Å; L44-L46 PolarHBondContact O-N 3.48Å; L46-W50 HydrophobicContact CD2-CE3 3.74Å; L46-W50 HydrophobicContact CD2-CZ3 4.2Å; L46-W50 WeakPolarHBondContact O-CB 3.49Å; L46-W50 PolarHBondContact O-N 3.02Å; L46-L66 HydrophobicContact CG-CD2 4.46Å; L46-L66 VanDerWaalsContact O-CD2 3.25Å; L46-L66 WeakPolarHBondContact O-CD2 3.37Å; L46-P67 HydrophobicContact CD1-CB 4.02Å; L46-P67 HydrophobicContact CD1-CG 4.35Å; L46-C70 HydrophobicContact CB-CB 3.98Å; L46-L71 HydrophobicContact CD1-CD1 3.7Å; L46-L71 HydrophobicContact CD1-CG 4.01Å
47	G	70.3	Confident	68.5	Low	43 Å²	43	56.3 Å²	56.3	44%	0.443	33%	0.333	S	S	.	.	H	α-helix	trans	-63.8	-46	-179.9	0	0	0	0	0	113.5	T43 L44 R45 W50 G51	T43-G47 PolarHBondContact O-N 3.46Å; L44-G47 PolarHBondContact O-N 2.88Å; R45-G47 PolarHBondContact O-N 3.37Å; G47-W50 PolarHBondContact O-N 3.48Å; G47-G51 PolarHBondContact O-N 3.13Å
48	V	72.9	Confident	68.2	Low	63 Å²	63	59.2 Å²	59.2	38%	0.382	35%	0.347	S	S	.	.	H	α-helix	trans	-72.1	-43.8	-177.3	-179.9	0	0	0	0	111.7	L19 L44 W50 G51 L52	L19-V48 HydrophobicContact CD1-CB 3.58Å; L19-V48 HydrophobicContact CD1-CG1 3.24Å; L19-V48 HydrophobicContact CD1-CG2 4.3Å; L44-V48 HydrophobicContact CD2-CG2 4.32Å; L44-V48 WeakPolarHBondContact O-CG2 3.38Å; L44-V48 PolarHBondContact O-N 3.16Å; L44-V48 VanDerWaalsContact O-N 3.09Å; V48-W50 VanDerWaalsContact C-N 3.29Å; V48-W50 PolarHBondContact O-N 3.07Å; V48-G51 PolarHBondContact O-N 3.45Å; V48-L52 HydrophobicContact CG1-CD1 4.03Å; V48-L52 WeakPolarHBondContact O-CG 3.17Å; V48-L52 PolarHBondContact O-N 3.46Å
49	L	71.4	Confident	67.6	Low	3 Å²	3	61.8 Å²	61.8	2%	0.016	36%	0.36	C	S	.	.	H	α-helix	trans	-65.6	-34	177.2	-69.9	170.4	0	0	0	111.5	A15 D16 R45 L52 L53 L66	A15-L49 HydrophobicContact CB-CD2 4.07Å; D16-L49 HydrophobicContact CB-CD1 4.09Å; D16-L49 HydrophobicContact CB-CD2 4.31Å; R45-L49 VanDerWaalsContact O-CB 3.29Å; R45-L49 WeakPolarHBondContact O-CB 3.26Å; R45-L49 VanDerWaalsContact O-CG 3.31Å; R45-L49 WeakPolarHBondContact O-CG 3.48Å; R45-L49 PolarHBondContact O-N 2.04Å; L49-L52 PolarHBondContact O-N 2.7Å; L49-L53 WeakPolarHBondContact O-CB 3.46Å; L49-L53 WeakPolarHBondContact O-CD1 3.46Å; L49-L53 WeakPolarHBondContact O-CG 3.38Å; L49-L53 PolarHBondContact O-N 3.3Å; L49-L66 HydrophobicContact CB-CD1 4Å; L49-L66 HydrophobicContact CB-CD2 3.8Å; L49-L66 HydrophobicContact CB-CG 4.1Å
50	W	71.9	Confident	66.9	Low	130 Å²	130	61.1 Å²	61.1	49%	0.492	38%	0.382	S	S	.	.	H	α-helix	trans	-64.5	-48.2	174.9	-170.8	-37.5	0	0	0	110.1	L46 G47 V48 L52 L53 K54 L66	L46-W50 HydrophobicContact CD2-CE3 3.74Å; L46-W50 HydrophobicContact CD2-CZ3 4.2Å; L46-W50 WeakPolarHBondContact O-CB 3.49Å; L46-W50 PolarHBondContact O-N 3.02Å; G47-W50 PolarHBondContact O-N 3.48Å; V48-W50 VanDerWaalsContact C-N 3.29Å; V48-W50 PolarHBondContact O-N 3.07Å; W50-L52 VanDerWaalsContact C-N 3.34Å; W50-L52 PolarHBondContact O-N 2.86Å; W50-L53 PolarHBondContact O-N 3.36Å; W50-K54 WeakPolarHBondContact O-CB 3.39Å; W50-K54 PolarHBondContact O-N 2.67Å; W50-L66 HydrophobicContact CB-CD2 3.7Å; W50-L66 VanDerWaalsContact N-CD2 3.26Å
51	G	66.9	Low	66	Low	37 Å²	37	62.9 Å²	62.9	38%	0.381	39%	0.392	S	S	.	.	H	α-helix	trans	-55.5	-47.3	176.6	0	0	0	0	0	112.6	G47 V48 K54 V55	G47-G51 PolarHBondContact O-N 3.13Å; V48-G51 PolarHBondContact O-N 3.45Å; G51-K54 PolarHBondContact O-N 3.06Å; G51-V55 WeakPolarHBondContact O-CG2 3.4Å; G51-V55 PolarHBondContact O-N 3.17Å; G51-V55 VanDerWaalsContact O-N 3.15Å
52	L	68.5	Low	65.2	Low	100 Å²	100	62.8 Å²	62.8	52%	0.524	39%	0.392	S	S	.	.	H	α-helix	trans	-63.8	-42.4	179	-72.2	168	0	0	0	112.8	V48 L49 W50 K54 V55 G56	V48-L52 HydrophobicContact CG1-CD1 4.03Å; V48-L52 WeakPolarHBondContact O-CG 3.17Å; V48-L52 PolarHBondContact O-N 3.46Å; L49-L52 PolarHBondContact O-N 2.7Å; W50-L52 VanDerWaalsContact C-N 3.34Å; W50-L52 PolarHBondContact O-N 2.86Å; L52-K54 VanDerWaalsContact C-N 3.33Å; L52-K54 PolarHBondContact O-N 2.84Å; L52-V55 PolarHBondContact O-N 3.06Å; L52-G56 PolarHBondContact O-N 2.67Å
53	L	66.7	Low	64.7	Low	20 Å²	20	63.9 Å²	63.9	11%	0.105	40%	0.403	C	S	.	.	H	α-helix	trans	-69.5	-29.3	177.3	-78.7	156.2	0	0	0	113.3	L12 L49 W50 G57 L58 L59 V62 L66	L12-L53 HydrophobicContact CD1-CD1 3.65Å; L12-L53 HydrophobicContact CD1-CD2 4.3Å; L12-L53 HydrophobicContact CD1-CG 4.5Å; L49-L53 WeakPolarHBondContact O-CB 3.46Å; L49-L53 WeakPolarHBondContact O-CD1 3.46Å; L49-L53 WeakPolarHBondContact O-CG 3.38Å; L49-L53 PolarHBondContact O-N 3.3Å; W50-L53 PolarHBondContact O-N 3.36Å; L53-G57 PolarHBondContact O-N 2.98Å; L53-L58 HydrophobicContact CD2-CB 3.9Å; L53-L58 PolarHBondContact O-N 2.92Å; L53-L59 HydrophobicContact CB-CD1 4.21Å; L53-V62 HydrophobicContact CD2-CB 4.4Å; L53-L66 HydrophobicContact CD1-CD1 3.17Å; L53-L66 HydrophobicContact CD1-CG 4.45Å
54	K	66.4	Low	64.2	Low	153 Å²	153	63.4 Å²	63.4	67%	0.665	40%	0.4	S	S	*	.	H	α-helix	trans	-69.2	-41.3	175.5	-168	177.6	178.8	-177.9	0	111.3	W50 G51 L52 L59	W50-K54 WeakPolarHBondContact O-CB 3.39Å; W50-K54 PolarHBondContact O-N 2.67Å; G51-K54 PolarHBondContact O-N 3.06Å; L52-K54 VanDerWaalsContact C-N 3.33Å; L52-K54 PolarHBondContact O-N 2.84Å; K54-L59 HydrophobicContact CB-CD1 3.66Å; K54-L59 HydrophobicContact CG-CD1 4.23Å
55	V	68.1	Low	63.3	Low	136 Å²	136	60 Å²	60	82%	0.824	38%	0.382	S	S	*	.	H	α-helix	trans	-69.2	-35.4	175.9	176.3	0	0	0	0	111.2	G51 L52 G57	G51-V55 WeakPolarHBondContact O-CG2 3.4Å; G51-V55 PolarHBondContact O-N 3.17Å; G51-V55 VanDerWaalsContact O-N 3.15Å; L52-V55 PolarHBondContact O-N 3.06Å; V55-G57 PolarHBondContact O-N 2.89Å
56	G	59.7	Low	62.8	Low	50 Å²	50	59.7 Å²	59.7	52%	0.515	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	1.2	179	0	0	0	0	0	116.4	L52 L58	L52-G56 PolarHBondContact O-N 2.67Å; G56-L58 PolarHBondContact O-N 3.28Å; G56-L58 VanDerWaalsContact O-N 3.15Å
57	G	54.8	Low	62.4	Low	68 Å²	68	60.8 Å²	60.8	70%	0.701	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	8.5	177.7	0	0	0	0	0	116.2	L53 V55	L53-G57 PolarHBondContact O-N 2.98Å; V55-G57 PolarHBondContact O-N 2.89Å
58	L	56.9	Low	61.9	Low	67 Å²	67	61.2 Å²	61.2	35%	0.351	38%	0.382	S	S	.	.			trans	-95.5	8.7	-175	-73.1	166.5	0	0	0	113.8	P8 L53 G56 G60 L61 V62	P8-L58 HydrophobicContact CB-CD1 4.31Å; P8-L58 HydrophobicContact CB-CD2 4.17Å; L53-L58 HydrophobicContact CD2-CB 3.9Å; L53-L58 PolarHBondContact O-N 2.92Å; G56-L58 PolarHBondContact O-N 3.28Å; G56-L58 VanDerWaalsContact O-N 3.15Å; L58-G60 VanDerWaalsContact C-N 3.25Å; L58-G60 PolarHBondContact O-N 2.66Å; L58-L61 PolarHBondContact O-N 3.37Å; L58-V62 PolarHBondContact O-N 3.12Å
59	L	55.9	Low	61.5	Low	64 Å²	64	59.3 Å²	59.3	34%	0.335	37%	0.369	S	S	.	.	H	α-helix	trans	-61.1	-30.7	-172.9	-144.4	109.4	0	0	0	113.4	L53 K54 G63	L53-L59 HydrophobicContact CB-CD1 4.21Å; K54-L59 HydrophobicContact CB-CD1 3.66Å; K54-L59 HydrophobicContact CG-CD1 4.23Å; L59-G63 VanDerWaalsContact O-CA 3.25Å; L59-G63 WeakPolarHBondContact O-CA 3.47Å; L59-G63 PolarHBondContact O-N 3.03Å
60	G	52.5	Low	61.1	Low	79 Å²	79	59.2 Å²	59.2	81%	0.814	37%	0.369	S	S	*	.	H	α-helix	trans	-71.4	-31.7	-176.2	0	0	0	0	0	115.1	L58	L58-G60 VanDerWaalsContact C-N 3.25Å; L58-G60 PolarHBondContact O-N 2.66Å
61	L	53	Low	60.9	Low	103 Å²	103	54.6 Å²	54.6	54%	0.539	35%	0.354	S	S	.	.	H	α-helix	trans	-95.7	-29.4	-178.2	-80.7	165.7	0	0	0	113.1	Y5 L58	Y5-L61 HydrophobicContact CE1-CD2 3.94Å; L58-L61 PolarHBondContact O-N 3.37Å
62	V	54.5	Low	60.9	Low	6 Å²	6	54.9 Å²	54.9	4%	0.036	35%	0.353	C	S	.	.	H	α-helix	trans	-122.5	-11.4	-169.3	-161.3	0	0	0	0	112.9	P8 L12 L53 L58 T64 L65	P8-V62 HydrophobicContact CB-CG2 3.99Å; L12-V62 HydrophobicContact CD1-CB 4.38Å; L12-V62 HydrophobicContact CD1-CG1 3.25Å; L53-V62 HydrophobicContact CD2-CB 4.4Å; L58-V62 PolarHBondContact O-N 3.12Å; V62-T64 VanDerWaalsContact C-N 3.25Å; V62-T64 PolarHBondContact O-N 3.42Å; V62-L65 HydrophobicContact CG1-CB 4.38Å; V62-L65 HydrophobicContact CG1-CD1 3.96Å; V62-L65 WeakPolarHBondContact O-CB 3.4Å; V62-L65 PolarHBondContact O-N 3.22Å; V62-L65 VanDerWaalsContact O-N 3.08Å
63	G	57.7	Low	60.6	Low	26 Å²	26	52.1 Å²	52.1	27%	0.268	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-27.2	-178.6	0	0	0	0	0	114.2	L59 L65	L59-G63 VanDerWaalsContact O-CA 3.25Å; L59-G63 WeakPolarHBondContact O-CA 3.47Å; L59-G63 PolarHBondContact O-N 3.03Å; G63-L65 VanDerWaalsContact C-N 3.27Å; G63-L65 PolarHBondContact O-N 2.99Å
64	T	57.6	Low	60.5	Low	64 Å²	64	51.2 Å²	51.2	39%	0.393	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-27.5	175.1	47.7	0	0	0	0	112.7	V62 P67 W116	V62-T64 VanDerWaalsContact C-N 3.25Å; V62-T64 PolarHBondContact O-N 3.42Å; T64-P67 WeakPolarHBondContact O-CD 3.43Å; T64-W116 VanDerWaalsContact CB-CH2 3.43Å; T64-W116 HydrophobicContact CG2-CH2 3.94Å; T64-W116 HydrophobicContact CG2-CZ2 3.89Å; T64-W116 WeakPolarHBondContact O-CH2 3.26Å; T64-W116 WeakPolarHBondContact O-CZ3 3.42Å
65	L	54.5	Low	60.4	Low	8 Å²	8	47.9 Å²	47.9	4%	0.042	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-26.4	-175.6	-81.9	164.6	0	0	0	114.8	V62 G63 L68 L69 W113	V62-L65 HydrophobicContact CG1-CB 4.38Å; V62-L65 HydrophobicContact CG1-CD1 3.96Å; V62-L65 WeakPolarHBondContact O-CB 3.4Å; V62-L65 PolarHBondContact O-N 3.22Å; V62-L65 VanDerWaalsContact O-N 3.08Å; G63-L65 VanDerWaalsContact C-N 3.27Å; G63-L65 PolarHBondContact O-N 2.99Å; L65-L68 PolarHBondContact O-N 2.94Å; L65-L69 WeakPolarHBondContact O-CB 3.49Å; L65-L69 PolarHBondContact O-N 3.41Å; L65-W113 VanDerWaalsContact CD1-CD1 3.44Å; L65-W113 HydrophobicContact CD1-CD2 4.34Å; L65-W113 HydrophobicContact CD1-CG 3.89Å; L65-W113 HydrophobicContact CD2-CB 3.31Å; L65-W113 HydrophobicContact CD2-CD2 4.48Å; L65-W113 HydrophobicContact CD2-CG 3.32Å; L65-W113 HydrophobicContact CG-CB 4.43Å; L65-W113 HydrophobicContact CG-CG 3.94Å
66	L	64.5	Low	60.3	Low	5 Å²	5	46.6 Å²	46.6	3%	0.026	31%	0.308	C	S	.	.	H	α-helix	trans	-57.9	-46.5	-172.2	-132.3	83.3	0	0	0	114.5	L12 L46 L49 W50 L53 L68 L69 C70	L12-L66 HydrophobicContact CD1-CD1 3.83Å; L46-L66 HydrophobicContact CG-CD2 4.46Å; L46-L66 VanDerWaalsContact O-CD2 3.25Å; L46-L66 WeakPolarHBondContact O-CD2 3.37Å; L49-L66 HydrophobicContact CB-CD1 4Å; L49-L66 HydrophobicContact CB-CD2 3.8Å; L49-L66 HydrophobicContact CB-CG 4.1Å; W50-L66 HydrophobicContact CB-CD2 3.7Å; W50-L66 VanDerWaalsContact N-CD2 3.26Å; L53-L66 HydrophobicContact CD1-CD1 3.17Å; L53-L66 HydrophobicContact CD1-CG 4.45Å; L66-L68 VanDerWaalsContact C-N 3.33Å; L66-L68 PolarHBondContact O-N 2.99Å; L66-L69 PolarHBondContact O-N 3.25Å; L66-C70 WeakPolarHBondContact O-CB 3.32Å; L66-C70 PolarHBondContact O-N 2.9Å; L66-C70 PolarHBondContact O-SG 2.85Å
67	P	65.1	Low	60.4	Low	51 Å²	51	47.6 Å²	47.6	33%	0.331	30%	0.298	S	S	.	.	H	α-helix	trans	-66.9	-37.5	-178.8	-19.3	33.2	0	0	0	111.9	L46 T64 L71	L46-P67 HydrophobicContact CD1-CB 4.02Å; L46-P67 HydrophobicContact CD1-CG 4.35Å; T64-P67 WeakPolarHBondContact O-CD 3.43Å; P67-L71 HydrophobicContact CB-CD1 4.4Å; P67-L71 WeakPolarHBondContact O-CA 3.38Å; P67-L71 WeakPolarHBondContact O-CB 3.4Å; P67-L71 WeakPolarHBondContact O-CG 3.37Å; P67-L71 PolarHBondContact O-N 3.16Å
68	L	60.2	Low	60.8	Low	53 Å²	53	45.6 Å²	45.6	28%	0.277	27%	0.273	S	S	.	.	H	α-helix	trans	-67.5	-42.4	179.1	-116.6	154.7	0	0	0	111.2	L65 L66 A72 S112 W116	L65-L68 PolarHBondContact O-N 2.94Å; L66-L68 VanDerWaalsContact C-N 3.33Å; L66-L68 PolarHBondContact O-N 2.99Å; L68-A72 HydrophobicContact CD2-CB 4.49Å; L68-A72 WeakPolarHBondContact O-CB 3.44Å; L68-A72 PolarHBondContact O-N 3.46Å; L68-S112 VanDerWaalsContact CD2-OG 3.28Å; L68-S112 WeakPolarHBondContact CD2-OG 3.4Å; L68-W116 HydrophobicContact CD1-CE3 3.74Å; L68-W116 HydrophobicContact CD1-CZ3 3.88Å
69	L	64	Low	60.6	Low	22 Å²	22	47.2 Å²	47.2	12%	0.115	28%	0.282	C	S	.	.	H	α-helix	trans	-70.2	-35.1	179.2	-166.8	138.3	0	0	0	112.6	L12 L65 L66 Y106 A109	L12-L69 HydrophobicContact CD2-CD1 4.33Å; L65-L69 WeakPolarHBondContact O-CB 3.49Å; L65-L69 PolarHBondContact O-N 3.41Å; L66-L69 PolarHBondContact O-N 3.25Å; L69-Y106 HydrophobicContact CD1-CD1 4.03Å; L69-Y106 HydrophobicContact CD1-CE1 4.16Å; L69-Y106 HydrophobicContact CD2-CE1 4.2Å; L69-Y106 HydrophobicContact CG-CD1 4.49Å; L69-Y106 HydrophobicContact CG-CE1 4.36Å; L69-A109 HydrophobicContact CD1-CB 4.3Å; L69-A109 HydrophobicContact CG-CB 4.49Å
70	C	64.5	Low	60.6	Low	1 Å²	1	51.6 Å²	51.6	1%	0.007	29%	0.294	C	S	.	.	H	α-helix	trans	-90.5	-27.3	-177.1	-59.4	0	0	0	0	114.2	G42 R45 L46 L66	G42-C70 WeakPolarHBondContact CA-O 3Å; G42-C70 WeakPolarHBondContact O-CB 3.35Å; R45-C70 HydrophobicContact CB-CB 4.42Å; L46-C70 HydrophobicContact CB-CB 3.98Å; L66-C70 WeakPolarHBondContact O-CB 3.32Å; L66-C70 PolarHBondContact O-N 2.9Å; L66-C70 PolarHBondContact O-SG 2.85Å
71	L	67.4	Low	60.8	Low	33 Å²	33	50.5 Å²	50.5	17%	0.173	28%	0.277	C	S	.	.	H	α-helix	trans	-113.2	-10.9	-171.5	-56	172.1	0	0	0	114.5	W39 T43 L46 P67 T73 P74 L75	W39-L71 HydrophobicContact CE3-CD2 4.26Å; W39-L71 HydrophobicContact CZ3-CD2 4.16Å; T43-L71 HydrophobicContact CG2-CD2 4.39Å; L46-L71 HydrophobicContact CD1-CD1 3.7Å; L46-L71 HydrophobicContact CD1-CG 4.01Å; P67-L71 HydrophobicContact CB-CD1 4.4Å; P67-L71 WeakPolarHBondContact O-CA 3.38Å; P67-L71 WeakPolarHBondContact O-CB 3.4Å; P67-L71 WeakPolarHBondContact O-CG 3.37Å; P67-L71 PolarHBondContact O-N 3.16Å; L71-T73 VanDerWaalsContact C-N 3.34Å; L71-T73 PolarHBondContact O-N 3.12Å; L71-P74 HydrophobicContact CB-CG 4.49Å; L71-P74 HydrophobicContact CD2-CG 4.45Å; L71-P74 VanDerWaalsContact O-CD 3.26Å; L71-P74 WeakPolarHBondContact O-CD 3.34Å; L71-P74 VanDerWaalsContact O-CG 3.29Å; L71-P74 WeakPolarHBondContact O-CG 3.35Å; L71-L75 VanDerWaalsContact O-CB 3.32Å; L71-L75 WeakPolarHBondContact O-CB 3.35Å; L71-L75 PolarHBondContact O-N 2.9Å
72	A	65.4	Low	60.6	Low	44 Å²	44	52.7 Å²	52.7	36%	0.364	29%	0.288	S	S	.	.	H	α-helix	trans	-63.7	-37.5	179.5	0	0	0	0	0	113.2	L68 F76	L68-A72 HydrophobicContact CD2-CB 4.49Å; L68-A72 WeakPolarHBondContact O-CB 3.44Å; L68-A72 PolarHBondContact O-N 3.46Å; A72-F76 VanDerWaalsContact O-CB 3.28Å; A72-F76 WeakPolarHBondContact O-CB 3.42Å; A72-F76 PolarHBondContact O-N 2.93Å
73	T	64.1	Low	60.2	Low	42 Å²	42	58 Å²	58	26%	0.258	32%	0.321	S	S	.	.	H	α-helix	trans	-67.8	-48.9	177.7	45.1	0	0	0	0	112.7	L71 L75 F76 F77	L71-T73 VanDerWaalsContact C-N 3.34Å; L71-T73 PolarHBondContact O-N 3.12Å; T73-L75 VanDerWaalsContact C-N 3.33Å; T73-L75 PolarHBondContact O-N 3.36Å; T73-F76 PolarHBondContact O-N 3.09Å; T73-F77 WeakPolarHBondContact O-CD2 3.38Å; T73-F77 PolarHBondContact O-N 3.33Å; T73-F77 VanDerWaalsContact O-N 3.17Å
74	P	64.6	Low	59.9	Low	1 Å²	1	58.9 Å²	58.9	1%	0.006	33%	0.329	C	S	.	.	H	α-helix	trans	-64.7	-34.1	173.6	20.8	-29.9	0	0	0	112.8	L38 W39 L71 S78	L38-P74 HydrophobicContact CB-CB 4.31Å; W39-P74 HydrophobicContact CD2-CB 4.07Å; W39-P74 HydrophobicContact CG-CB 4.15Å; L71-P74 HydrophobicContact CB-CG 4.49Å; L71-P74 HydrophobicContact CD2-CG 4.45Å; L71-P74 VanDerWaalsContact O-CD 3.26Å; L71-P74 WeakPolarHBondContact O-CD 3.34Å; L71-P74 VanDerWaalsContact O-CG 3.29Å; L71-P74 WeakPolarHBondContact O-CG 3.35Å; P74-S78 VanDerWaalsContact O-CB 3.28Å; P74-S78 WeakPolarHBondContact O-CB 3.39Å; P74-S78 PolarHBondContact O-N 3.29Å; P74-S78 PolarHBondContact O-OG 2.69Å
75	L	63.1	Low	59.3	Low	83 Å²	83	59.4 Å²	59.4	44%	0.435	35%	0.348	S	S	.	.	H	α-helix	trans	-63.8	-45.4	173.5	-101.1	155.9	0	0	0	112.7	W39 L71 T73 S78 L79	W39-L75 HydrophobicContact CH2-CG 4.12Å; W39-L75 HydrophobicContact CZ2-CG 4.27Å; L71-L75 VanDerWaalsContact O-CB 3.32Å; L71-L75 WeakPolarHBondContact O-CB 3.35Å; L71-L75 PolarHBondContact O-N 2.9Å; T73-L75 VanDerWaalsContact C-N 3.33Å; T73-L75 PolarHBondContact O-N 3.36Å; L75-S78 PolarHBondContact O-N 3.37Å; L75-L79 HydrophobicContact CD2-CD1 4.35Å; L75-L79 WeakPolarHBondContact O-CB 2.97Å; L75-L79 WeakPolarHBondContact O-CG 3.45Å; L75-L79 PolarHBondContact O-N 3.22Å
76	F	65.6	Low	58.6	Low	109 Å²	109	64.3 Å²	64.3	48%	0.478	38%	0.378	S	S	.	.	H	α-helix	trans	-62	-45.7	179.7	177	-101.1	0	0	0	112.1	A72 T73 L79 R80	A72-F76 VanDerWaalsContact O-CB 3.28Å; A72-F76 WeakPolarHBondContact O-CB 3.42Å; A72-F76 PolarHBondContact O-N 2.93Å; T73-F76 PolarHBondContact O-N 3.09Å; F76-L79 PolarHBondContact O-N 3.26Å; F76-R80 VanDerWaalsContact O-CB 3.32Å; F76-R80 WeakPolarHBondContact O-CB 3.12Å; F76-R80 PolarHBondContact O-N 2.85Å
77	F	63.1	Low	57.6	Low	70 Å²	70	69.5 Å²	69.5	31%	0.307	42%	0.422	S	S	.	.	H	α-helix	trans	-69.2	-32.6	176.7	-80.2	-74.7	0	0	0	112.7	L35 T73 A81 W101	L35-F77 HydrophobicContact CD2-CB 4.28Å; T73-F77 WeakPolarHBondContact O-CD2 3.38Å; T73-F77 PolarHBondContact O-N 3.33Å; T73-F77 VanDerWaalsContact O-N 3.17Å; F77-A81 WeakPolarHBondContact O-CB 3.35Å; F77-A81 PolarHBondContact O-N 3.44Å; F77-W101 HydrophobicContact CZ-CH2 4.43Å; F77-W101 HydrophobicContact CZ-CZ3 4.42Å
78	S	62.7	Low	56.5	Low	26 Å²	26	71.9 Å²	71.9	18%	0.182	44%	0.439	C	S	.	.	H	α-helix	trans	-67.8	-42.7	174	-56.5	0	0	0	0	111.9	W39 P74 L75 A81 L82	W39-S78 PolarHBondContact NE1-OG 2.87Å; W39-S78 VanDerWaalsContact NE1-OG 3.14Å; P74-S78 VanDerWaalsContact O-CB 3.28Å; P74-S78 WeakPolarHBondContact O-CB 3.39Å; P74-S78 PolarHBondContact O-N 3.29Å; P74-S78 PolarHBondContact O-OG 2.69Å; L75-S78 PolarHBondContact O-N 3.37Å; S78-A81 PolarHBondContact O-N 3.26Å; S78-L82 PolarHBondContact O-N 3.18Å; S78-L82 VanDerWaalsContact O-N 3.11Å
79	L	52.7	Low	55.5	Low	102 Å²	102	74.9 Å²	74.9	53%	0.534	46%	0.46	S	S	.	.	H	α-helix	trans	-67	-40.1	176	-78.8	162.4	0	0	0	112	L75 F76 L82 V83	L75-L79 HydrophobicContact CD2-CD1 4.35Å; L75-L79 WeakPolarHBondContact O-CB 2.97Å; L75-L79 WeakPolarHBondContact O-CG 3.45Å; L75-L79 PolarHBondContact O-N 3.22Å; F76-L79 PolarHBondContact O-N 3.26Å; L79-L82 PolarHBondContact O-N 3.35Å; L79-V83 VanDerWaalsContact O-CG2 3.31Å; L79-V83 WeakPolarHBondContact O-CG2 3.3Å; L79-V83 PolarHBondContact O-N 3.03Å
80	R	56	Low	54.5	Low	156 Å²	156	79.1 Å²	79.1	59%	0.589	49%	0.492	S	S	*	.	H	α-helix	trans	-65.2	-38.9	175.5	-172.6	176.4	178.3	166.3	0.1	112.2	F76 L82 V83 G84	F76-R80 VanDerWaalsContact O-CB 3.32Å; F76-R80 WeakPolarHBondContact O-CB 3.12Å; F76-R80 PolarHBondContact O-N 2.85Å; R80-L82 VanDerWaalsContact C-N 3.3Å; R80-L82 PolarHBondContact O-N 2.87Å; R80-V83 PolarHBondContact O-N 3.28Å; R80-G84 PolarHBondContact O-N 3.44Å
81	A	55.6	Low	53.7	Low	55 Å²	55	82.4 Å²	82.4	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-35.1	174.2	0	0	0	0	0	112.2	L35 F77 S78	L35-A81 HydrophobicContact CD1-CB 4.46Å; F77-A81 WeakPolarHBondContact O-CB 3.35Å; F77-A81 PolarHBondContact O-N 3.44Å; S78-A81 PolarHBondContact O-N 3.26Å
82	L	49.8	Very low	53.1	Low	149 Å²	149	85 Å²	85	78%	0.78	53%	0.529	S	S	*	.	H	α-helix	trans	-72.1	-32.5	176.2	-114.9	131.3	0	0	0	113.5	S78 L79 R80	S78-L82 PolarHBondContact O-N 3.18Å; S78-L82 VanDerWaalsContact O-N 3.11Å; L79-L82 PolarHBondContact O-N 3.35Å; R80-L82 VanDerWaalsContact C-N 3.3Å; R80-L82 PolarHBondContact O-N 2.87Å
83	V	46.9	Very low	52.8	Low	118 Å²	118	86.3 Å²	86.3	72%	0.715	52%	0.524	S	S	*	.	H	α-helix	trans	-90.7	-29.6	-177	174.4	0	0	0	0	112.9	L79 R80	L79-V83 VanDerWaalsContact O-CG2 3.31Å; L79-V83 WeakPolarHBondContact O-CG2 3.3Å; L79-V83 PolarHBondContact O-N 3.03Å; R80-V83 PolarHBondContact O-N 3.28Å
84	G	50.9	Low	52.3	Low	44 Å²	44	85.5 Å²	85.5	45%	0.454	52%	0.519	S	S	.	.	H	α-helix	trans	-101.4	-6.5	-167.4	0	0	0	0	0	117.6	R80 T86	R80-G84 PolarHBondContact O-N 3.44Å; G84-T86 PolarHBondContact O-N 2.91Å; G84-T86 PolarHBondContact O-OG1 3.31Å; G84-T86 VanDerWaalsContact O-OG1 3.07Å
85	G	45.1	Very low	51.9	Low	75 Å²	75	86 Å²	86	77%	0.773	52%	0.523	S	S	*	.			trans	58.8	1.4	174.5	0	0	0	0	0	117.6
86	T	39.7	Very low	51.5	Low	112 Å²	112	85 Å²	85	69%	0.687	52%	0.524	S	S	*	.			trans	-126.6	108.7	-174.7	44.2	0	0	0	0	110.5	G84 S88	G84-T86 PolarHBondContact O-N 2.91Å; G84-T86 PolarHBondContact O-OG1 3.31Å; G84-T86 VanDerWaalsContact O-OG1 3.07Å; T86-S88 VanDerWaalsContact C-N 3.29Å; T86-S88 PolarHBondContact O-N 3.19Å
87	A	43.4	Very low	51.2	Low	114 Å²	114	81.3 Å²	81.3	94%	0.942	51%	0.513	S	S	*	.			trans	-89.8	39.4	-179.5	0	0	0	0	0	112.9
88	S	41.8	Very low	51	Low	100 Å²	100	81.6 Å²	81.6	70%	0.699	52%	0.524	S	S	*	.			trans	-126.9	63.4	-172.3	66.6	0	0	0	0	113.5	T86	T86-S88 VanDerWaalsContact C-N 3.29Å; T86-S88 PolarHBondContact O-N 3.19Å
89	T	39.3	Very low	50.6	Low	117 Å²	117	88.8 Å²	88.8	72%	0.718	55%	0.547	S	S	*	.	S	Bend	trans	-138.8	131.7	149.7	50.4	0	0	0	0	107.6	V91	T89-V91 PolarHBondContact O-N 3.21Å; T89-V91 VanDerWaalsContact O-N 3.11Å
90	S	42.2	Very low	50.5	Low	111 Å²	111	86.3 Å²	86.3	78%	0.776	55%	0.546	S	S	*	.			trans	-50	116.1	178.3	41.9	0	0	0	0	110.5	V92	S90-V92 PolarHBondContact O-N 3.29Å
91	V	48.9	Very low	50.7	Low	70 Å²	70	86.1 Å²	86.1	42%	0.424	55%	0.545	S	S	.	.			trans	-73.5	99.4	-178	179.7	0	0	0	0	108.2	L38 T89	L38-V91 HydrophobicContact CD1-CG1 3.31Å; L38-V91 HydrophobicContact CG-CG1 3.96Å; T89-V91 PolarHBondContact O-N 3.21Å; T89-V91 VanDerWaalsContact O-N 3.11Å
92	V	54.1	Low	50.8	Low	88 Å²	88	84.7 Å²	84.7	53%	0.533	53%	0.53	S	S	.	.			trans	-73.9	130.4	177	179.3	0	0	0	0	109	S90 S96	S90-V92 PolarHBondContact O-N 3.29Å; V92-S96 WeakPolarHBondContact CG1-OG 3.37Å
93	R	58.8	Low	51.1	Low	71 Å²	71	82.6 Å²	82.6	27%	0.268	52%	0.519	S	S	.	.			trans	-57.3	146.2	174.5	-68.6	176.7	178.3	161.7	-2.5	110.1	G28 N29 L31 A95 S96 A97	G28-R93 PolarHBondContact O-NH1 3.17Å; G28-R93 VanDerWaalsContact O-NH1 3.13Å; G28-R93 PolarHBondContact O-NH2 3.27Å; N29-R93 PolarHBondContact OD1-NH1 2.99Å; L31-R93 PolarHBondContact O-NH2 3.49Å; R93-A95 PolarHBondContact O-N 2.9Å; R93-S96 PolarHBondContact N-OG 3.18Å; R93-S96 PolarHBondContact O-N 3.06Å; R93-S96 PolarHBondContact O-OG 3.11Å; R93-A97 PolarHBondContact O-N 3.26Å
94	V	55	Low	51.6	Low	25 Å²	25	79.9 Å²	79.9	15%	0.152	51%	0.509	C	S	.	.	G	3₁₀ helix	trans	-62.7	-36.1	179.2	-179.5	0	0	0	0	110.5	L38 E41 S96 A97 L102	L38-V94 HydrophobicContact CD2-CG2 3.79Å; E41-V94 PolarHBondContact OE2-N 3.32Å; V94-S96 PolarHBondContact O-N 3.31Å; V94-A97 WeakPolarHBondContact O-CB 3.35Å; V94-A97 PolarHBondContact O-N 3.37Å; V94-L102 HydrophobicContact CG1-CD2 4.15Å
95	A	54.3	Low	52	Low	11 Å²	11	79.4 Å²	79.4	9%	0.091	50%	0.504	C	S	.	.	G	3₁₀ helix	trans	-62.4	-15.1	172.8	0	0	0	0	0	115.7	L20 L23 Q24 E41 R93	L20-A95 HydrophobicContact CD2-CB 4.16Å; L23-A95 HydrophobicContact CB-CB 4.43Å; Q24-A95 HydrophobicContact CB-CB 4.38Å; Q24-A95 PolarHBondContact NE2-O 3.37Å; E41-A95 PolarHBondContact OE1-N 2.84Å; R93-A95 PolarHBondContact O-N 2.9Å
96	S	54.8	Low	52.8	Low	63 Å²	63	77.1 Å²	77.1	44%	0.441	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-108.2	6.4	177.7	54.3	0	0	0	0	113.8	V92 R93 V94	V92-S96 WeakPolarHBondContact CG1-OG 3.37Å; R93-S96 PolarHBondContact N-OG 3.18Å; R93-S96 PolarHBondContact O-N 3.06Å; R93-S96 PolarHBondContact O-OG 3.11Å; V94-S96 PolarHBondContact O-N 3.31Å
97	A	59.9	Low	53.5	Low	30 Å²	30	73.3 Å²	73.3	25%	0.248	46%	0.455	C	S	.	.			trans	-70.4	145.2	180	0	0	0	0	0	111.8	R93 V94 W101 L102	R93-A97 PolarHBondContact O-N 3.26Å; V94-A97 WeakPolarHBondContact O-CB 3.35Å; V94-A97 PolarHBondContact O-N 3.37Å; A97-W101 HydrophobicContact CB-CB 4.26Å; A97-L102 HydrophobicContact CB-CG 4.27Å
98	S	58.4	Low	54.2	Low	77 Å²	77	70.7 Å²	70.7	54%	0.538	43%	0.434	S	S	.	.			trans	-63.3	149.8	174.7	63.5	0	0	0	0	111	G100 W101 L102	S98-G100 PolarHBondContact O-N 3.14Å; S98-W101 PolarHBondContact O-N 2.84Å; S98-L102 PolarHBondContact O-N 3.41Å
99	W	55.1	Low	54.8	Low	176 Å²	176	66.3 Å²	66.3	67%	0.667	40%	0.403	S	S	*	.	H	α-helix	trans	-51.3	-33.3	-178.1	-96.1	81.2	0	0	0	113.7	M17 L102 L103	M17-W99 HydrophobicContact CE-CE3 4.45Å; M17-W99 HydrophobicContact CE-CH2 3.3Å; M17-W99 HydrophobicContact CE-CZ2 3.7Å; M17-W99 HydrophobicContact CE-CZ3 3.73Å; W99-L102 PolarHBondContact O-N 2.65Å; W99-L103 HydrophobicContact CE3-CD1 4.42Å; W99-L103 WeakPolarHBondContact O-CB 3.41Å; W99-L103 VanDerWaalsContact O-CG 3.32Å; W99-L103 WeakPolarHBondContact O-CG 3.47Å; W99-L103 PolarHBondContact O-N 3.35Å
100	G	51	Low	55.3	Low	50 Å²	50	62.4 Å²	62.4	52%	0.515	38%	0.383	S	S	.	.	H	α-helix	trans	-65.1	-35.8	175.9	0	0	0	0	0	114.2	S98 A104	S98-G100 PolarHBondContact O-N 3.14Å; G100-A104 WeakPolarHBondContact O-CB 3.28Å; G100-A104 PolarHBondContact O-N 2.79Å
101	W	59.1	Low	55.9	Low	152 Å²	152	62.8 Å²	62.8	58%	0.576	38%	0.375	S	S	*	.	H	α-helix	trans	-74.8	-36.8	177.3	-99.7	86.4	0	0	0	112.5	F77 A97 S98 A104 G105	F77-W101 HydrophobicContact CZ-CH2 4.43Å; F77-W101 HydrophobicContact CZ-CZ3 4.42Å; A97-W101 HydrophobicContact CB-CB 4.26Å; S98-W101 PolarHBondContact O-N 2.84Å; W101-A104 PolarHBondContact O-N 3.42Å; W101-G105 PolarHBondContact O-N 3.5Å
102	L	58.2	Low	56.1	Low	26 Å²	26	61.3 Å²	61.3	14%	0.136	37%	0.368	C	S	.	.	H	α-helix	trans	-64.8	-45.6	173.4	-71.1	170.4	0	0	0	110.8	L20 V94 A97 S98 W99 A104 G105 Y106	L20-L102 HydrophobicContact CD1-CD2 4.11Å; V94-L102 HydrophobicContact CG1-CD2 4.15Å; A97-L102 HydrophobicContact CB-CG 4.27Å; S98-L102 PolarHBondContact O-N 3.41Å; W99-L102 PolarHBondContact O-N 2.65Å; L102-A104 VanDerWaalsContact C-N 3.33Å; L102-A104 PolarHBondContact O-N 3.12Å; L102-G105 PolarHBondContact O-N 3.29Å; L102-Y106 HydrophobicContact CB-CD2 4.39Å; L102-Y106 HydrophobicContact CB-CE2 4.1Å; L102-Y106 WeakPolarHBondContact O-CD2 2.81Å; L102-Y106 PolarHBondContact O-N 2.74Å
103	L	57.3	Low	56.2	Low	105 Å²	105	60.7 Å²	60.7	55%	0.55	36%	0.357	S	S	.	.	H	α-helix	trans	-60.8	-39.2	175.1	-76.2	166.5	0	0	0	112.7	W99 G107	W99-L103 HydrophobicContact CE3-CD1 4.42Å; W99-L103 WeakPolarHBondContact O-CB 3.41Å; W99-L103 VanDerWaalsContact O-CG 3.32Å; W99-L103 WeakPolarHBondContact O-CG 3.47Å; W99-L103 PolarHBondContact O-N 3.35Å; L103-G107 PolarHBondContact O-N 3.3Å
104	A	56.8	Low	55.7	Low	61 Å²	61	59.3 Å²	59.3	50%	0.504	36%	0.36	S	S	.	.	H	α-helix	trans	-65.7	-39.9	174.3	0	0	0	0	0	112.4	G100 W101 L102 G107 A108	G100-A104 WeakPolarHBondContact O-CB 3.28Å; G100-A104 PolarHBondContact O-N 2.79Å; W101-A104 PolarHBondContact O-N 3.42Å; L102-A104 VanDerWaalsContact C-N 3.33Å; L102-A104 PolarHBondContact O-N 3.12Å; A104-G107 PolarHBondContact O-N 2.83Å; A104-A108 WeakPolarHBondContact O-CB 3.5Å; A104-A108 PolarHBondContact O-N 3.05Å
105	G	58.3	Low	55.5	Low	33 Å²	33	61.8 Å²	61.8	34%	0.34	38%	0.375	S	S	.	.	H	α-helix	trans	-64.6	-44.5	174.5	0	0	0	0	0	112.8	W101 L102 G107 A108 A109	W101-G105 PolarHBondContact O-N 3.5Å; L102-G105 PolarHBondContact O-N 3.29Å; G105-G107 VanDerWaalsContact C-N 3.34Å; G105-A108 PolarHBondContact O-N 3.32Å; G105-A109 WeakPolarHBondContact O-CB 3.47Å; G105-A109 PolarHBondContact O-N 3.41Å
106	Y	62.3	Low	55.3	Low	28 Å²	28	66 Å²	66	11%	0.11	39%	0.389	C	S	.	.	H	α-helix	trans	-65.1	-37.6	174	-68.6	-57	0	0	0	112	L13 D16 M17 L69 L102 A109 A110	L13-Y106 HydrophobicContact CD2-CD1 3.35Å; L13-Y106 HydrophobicContact CD2-CE1 3.46Å; L13-Y106 VanDerWaalsContact CD2-CE1 3.46Å; L13-Y106 HydrophobicContact CD2-CG 3.97Å; D16-Y106 WeakPolarHBondContact OD2-CE1 3.41Å; D16-Y106 PolarHBondContact OD2-OH 3.18Å; M17-Y106 HydrophobicContact SD-CE2 4.36Å; L69-Y106 HydrophobicContact CD1-CD1 4.03Å; L69-Y106 HydrophobicContact CD1-CE1 4.16Å; L69-Y106 HydrophobicContact CD2-CE1 4.2Å; L69-Y106 HydrophobicContact CG-CD1 4.49Å; L69-Y106 HydrophobicContact CG-CE1 4.36Å; L102-Y106 HydrophobicContact CB-CD2 4.39Å; L102-Y106 HydrophobicContact CB-CE2 4.1Å; L102-Y106 WeakPolarHBondContact O-CD2 2.81Å; L102-Y106 PolarHBondContact O-N 2.74Å; Y106-A109 PolarHBondContact O-N 3.11Å; Y106-A110 VanDerWaalsContact O-CB 3.24Å; Y106-A110 WeakPolarHBondContact O-CB 3.27Å; Y106-A110 PolarHBondContact O-N 2.95Å
107	G	55.5	Low	55	Low	32 Å²	32	65 Å²	65	33%	0.33	38%	0.384	S	S	.	.	H	α-helix	trans	-64.1	-42	173.1	0	0	0	0	0	112.9	L103 A104 G105 A110 L111	L103-G107 PolarHBondContact O-N 3.3Å; A104-G107 PolarHBondContact O-N 2.83Å; G105-G107 VanDerWaalsContact C-N 3.34Å; G107-A110 PolarHBondContact O-N 3.17Å; G107-L111 WeakPolarHBondContact O-CB 3.42Å; G107-L111 WeakPolarHBondContact O-CG 3.2Å; G107-L111 PolarHBondContact O-N 3.41Å
108	A	56.6	Low	54.4	Low	59 Å²	59	66.9 Å²	66.9	49%	0.488	39%	0.392	S	S	.	.	H	α-helix	trans	-68.3	-38.9	176.1	0	0	0	0	0	112.4	A104 G105 L111 S112	A104-A108 WeakPolarHBondContact O-CB 3.5Å; A104-A108 PolarHBondContact O-N 3.05Å; G105-A108 PolarHBondContact O-N 3.32Å; A108-L111 PolarHBondContact O-N 3.43Å; A108-S112 VanDerWaalsContact O-CB 3.27Å; A108-S112 WeakPolarHBondContact O-CB 3.35Å; A108-S112 PolarHBondContact O-N 3.47Å
109	A	54	Low	53.5	Low	8 Å²	8	66 Å²	66	7%	0.066	38%	0.382	C	S	.	.	H	α-helix	trans	-67.1	-38.7	173	0	0	0	0	0	111.8	L69 G105 Y106 S112 W113	L69-A109 HydrophobicContact CD1-CB 4.3Å; L69-A109 HydrophobicContact CG-CB 4.49Å; G105-A109 WeakPolarHBondContact O-CB 3.47Å; G105-A109 PolarHBondContact O-N 3.41Å; Y106-A109 PolarHBondContact O-N 3.11Å; A109-S112 PolarHBondContact O-N 3.04Å; A109-W113 VanDerWaalsContact O-CB 3.32Å; A109-W113 WeakPolarHBondContact O-CB 3.41Å; A109-W113 PolarHBondContact O-N 3.03Å
110	A	51.6	Low	52.9	Low	34 Å²	34	59.8 Å²	59.8	28%	0.281	37%	0.365	S	S	.	.	H	α-helix	trans	-65.8	-39.8	173.8	0	0	0	0	0	112.2	W9 Y106 G107 W113 A114	W9-A110 HydrophobicContact CH2-CB 3.73Å; W9-A110 HydrophobicContact CZ2-CB 4.12Å; Y106-A110 VanDerWaalsContact O-CB 3.24Å; Y106-A110 WeakPolarHBondContact O-CB 3.27Å; Y106-A110 PolarHBondContact O-N 2.95Å; G107-A110 PolarHBondContact O-N 3.17Å; A110-W113 PolarHBondContact O-N 3.44Å; A110-A114 WeakPolarHBondContact O-CB 3.31Å; A110-A114 PolarHBondContact O-N 2.99Å
111	L	53.5	Low	52.4	Low	119 Å²	119	62.4 Å²	62.4	62%	0.623	37%	0.373	S	S	*	.	H	α-helix	trans	-68	-43.9	173.8	-84.4	161.7	0	0	0	111.7	G107 A108 W113 A114 V115	G107-L111 WeakPolarHBondContact O-CB 3.42Å; G107-L111 WeakPolarHBondContact O-CG 3.2Å; G107-L111 PolarHBondContact O-N 3.41Å; A108-L111 PolarHBondContact O-N 3.43Å; L111-W113 VanDerWaalsContact C-N 3.27Å; L111-W113 PolarHBondContact O-N 2.94Å; L111-A114 PolarHBondContact O-N 2.83Å; L111-V115 WeakPolarHBondContact O-CB 3.44Å; L111-V115 WeakPolarHBondContact O-CG2 3.29Å; L111-V115 PolarHBondContact O-N 2.86Å
112	S	53.4	Low	51.4	Low	40 Å²	40	59.9 Å²	59.9	28%	0.28	38%	0.384	S	S	.	.	H	α-helix	trans	-64.2	-34.3	175.4	-176.2	0	0	0	0	111.6	L68 A108 A109 W116	L68-S112 VanDerWaalsContact CD2-OG 3.28Å; L68-S112 WeakPolarHBondContact CD2-OG 3.4Å; A108-S112 VanDerWaalsContact O-CB 3.27Å; A108-S112 WeakPolarHBondContact O-CB 3.35Å; A108-S112 PolarHBondContact O-N 3.47Å; A109-S112 PolarHBondContact O-N 3.04Å; S112-W116 VanDerWaalsContact O-CB 3.27Å; S112-W116 WeakPolarHBondContact O-CB 3.46Å; S112-W116 PolarHBondContact O-N 3.12Å
113	W	56	Low	50.3	Low	75 Å²	75	61 Å²	61	28%	0.284	40%	0.402	S	S	.	.	H	α-helix	trans	-70.5	-41.4	169.8	-177	65.1	0	0	0	113.1	L65 A109 A110 L111 V115 W116 A117	L65-W113 VanDerWaalsContact CD1-CD1 3.44Å; L65-W113 HydrophobicContact CD1-CD2 4.34Å; L65-W113 HydrophobicContact CD1-CG 3.89Å; L65-W113 HydrophobicContact CD2-CB 3.31Å; L65-W113 HydrophobicContact CD2-CD2 4.48Å; L65-W113 HydrophobicContact CD2-CG 3.32Å; L65-W113 HydrophobicContact CG-CB 4.43Å; L65-W113 HydrophobicContact CG-CG 3.94Å; A109-W113 VanDerWaalsContact O-CB 3.32Å; A109-W113 WeakPolarHBondContact O-CB 3.41Å; A109-W113 PolarHBondContact O-N 3.03Å; A110-W113 PolarHBondContact O-N 3.44Å; L111-W113 VanDerWaalsContact C-N 3.27Å; L111-W113 PolarHBondContact O-N 2.94Å; W113-V115 PolarHBondContact O-N 3.36Å; W113-W116 CarbonylContact O-C 3.55Å; W113-W116 PolarHBondContact O-N 3.44Å; W113-A117 HydrophobicContact CD2-CB 4.45Å; W113-A117 HydrophobicContact CZ2-CB 4.4Å; W113-A117 WeakPolarHBondContact O-CA 3.48Å; W113-A117 WeakPolarHBondContact O-CB 3.49Å; W113-A117 PolarHBondContact O-N 3.07Å
114	A	49.5	Very low	48.9	Very low	42 Å²	42	62.9 Å²	62.9	35%	0.347	42%	0.417	S	S	.	.	H	α-helix	trans	-60.7	-41.7	175.2	0	0	0	0	0	109.7	A110 L111 V118	A110-A114 WeakPolarHBondContact O-CB 3.31Å; A110-A114 PolarHBondContact O-N 2.99Å; L111-A114 PolarHBondContact O-N 2.83Å; A114-V118 WeakPolarHBondContact O-CB 3.32Å; A114-V118 WeakPolarHBondContact O-CG2 3.43Å; A114-V118 PolarHBondContact O-N 2.88Å
115	V	49.8	Very low	47.7	Very low	77 Å²	77	66.2 Å²	66.2	47%	0.467	42%	0.423	S	S	.	.	H	α-helix	trans	-65.8	-44.2	173.7	171.4	0	0	0	0	111.2	L111 W113 V118 L119	L111-V115 WeakPolarHBondContact O-CB 3.44Å; L111-V115 WeakPolarHBondContact O-CG2 3.29Å; L111-V115 PolarHBondContact O-N 2.86Å; W113-V115 PolarHBondContact O-N 3.36Å; V115-V118 CarbonylContact O-C 3.55Å; V115-V118 PolarHBondContact O-N 2.96Å; V115-L119 HydrophobicContact CG1-CD1 3.52Å; V115-L119 HydrophobicContact CG1-CG 4.24Å; V115-L119 VanDerWaalsContact O-CB 3.26Å; V115-L119 WeakPolarHBondContact O-CB 3.3Å; V115-L119 WeakPolarHBondContact O-CD1 3.4Å; V115-L119 WeakPolarHBondContact O-CG 3.47Å; V115-L119 PolarHBondContact O-N 2.8Å
116	W	51.2	Low	46.3	Very low	99 Å²	99	72.8 Å²	72.8	38%	0.375	45%	0.445	S	S	.	.	H	α-helix	trans	-69.5	-39.6	176.7	-174.5	7.7	0	0	0	112	T64 L68 S112 W113 V118 L119 S120	T64-W116 VanDerWaalsContact CB-CH2 3.43Å; T64-W116 HydrophobicContact CG2-CH2 3.94Å; T64-W116 HydrophobicContact CG2-CZ2 3.89Å; T64-W116 WeakPolarHBondContact O-CH2 3.26Å; T64-W116 WeakPolarHBondContact O-CZ3 3.42Å; L68-W116 HydrophobicContact CD1-CE3 3.74Å; L68-W116 HydrophobicContact CD1-CZ3 3.88Å; S112-W116 VanDerWaalsContact O-CB 3.27Å; S112-W116 WeakPolarHBondContact O-CB 3.46Å; S112-W116 PolarHBondContact O-N 3.12Å; W113-W116 CarbonylContact O-C 3.55Å; W113-W116 PolarHBondContact O-N 3.44Å; W116-V118 VanDerWaalsContact C-N 3.28Å; W116-V118 PolarHBondContact O-N 3.34Å; W116-L119 CarbonylContact O-C 3.49Å; W116-L119 PolarHBondContact O-N 3.31Å; W116-L119 VanDerWaalsContact O-N 3.13Å; W116-S120 WeakPolarHBondContact O-CA 3.3Å; W116-S120 WeakPolarHBondContact O-CB 3.44Å; W116-S120 PolarHBondContact O-N 3.31Å; W116-S120 PolarHBondContact O-OG 3.38Å
117	A	47.6	Very low	44.9	Very low	41 Å²	41	79.9 Å²	79.9	34%	0.339	48%	0.476	S	S	.	.	H	α-helix	trans	-63.7	-37.3	174.2	0	0	0	0	0	110.8	W113 S120	W113-A117 HydrophobicContact CD2-CB 4.45Å; W113-A117 HydrophobicContact CZ2-CB 4.4Å; W113-A117 WeakPolarHBondContact O-CA 3.48Å; W113-A117 WeakPolarHBondContact O-CB 3.49Å; W113-A117 PolarHBondContact O-N 3.07Å; A117-S120 WeakPolarHBondContact CA-OG 3.43Å; A117-S120 PolarHBondContact O-OG 3.17Å; A117-S120 VanDerWaalsContact O-OG 3.05Å
118	V	46.4	Very low	43.9	Very low	70 Å²	70	82.8 Å²	82.8	42%	0.424	48%	0.481	S	S	.	.	H	α-helix	trans	-70.2	-36	171.7	169.7	0	0	0	0	111.6	A114 V115 W116 A305 K308	A114-V118 WeakPolarHBondContact O-CB 3.32Å; A114-V118 WeakPolarHBondContact O-CG2 3.43Å; A114-V118 PolarHBondContact O-N 2.88Å; V115-V118 CarbonylContact O-C 3.55Å; V115-V118 PolarHBondContact O-N 2.96Å; W116-V118 VanDerWaalsContact C-N 3.28Å; W116-V118 PolarHBondContact O-N 3.34Å; V118-A305 HydrophobicContact CG1-CB 4.06Å; V118-K308 VanDerWaalsContact O-CD 3.27Å; V118-K308 WeakPolarHBondContact O-CD 3.28Å; V118-K308 WeakPolarHBondContact O-CE 3.46Å; V118-K308 PolarHBondContact O-NZ 2.84Å
119	L	40.6	Very low	42.9	Very low	60 Å²	60	86.4 Å²	86.4	31%	0.314	50%	0.5	S	S	.	.	H	α-helix	trans	-81.8	-30.1	178.5	-71.3	167.7	0	0	0	113.1	V115 W116 P301 I304 K308	V115-L119 HydrophobicContact CG1-CD1 3.52Å; V115-L119 HydrophobicContact CG1-CG 4.24Å; V115-L119 VanDerWaalsContact O-CB 3.26Å; V115-L119 WeakPolarHBondContact O-CB 3.3Å; V115-L119 WeakPolarHBondContact O-CD1 3.4Å; V115-L119 WeakPolarHBondContact O-CG 3.47Å; V115-L119 PolarHBondContact O-N 2.8Å; W116-L119 CarbonylContact O-C 3.49Å; W116-L119 PolarHBondContact O-N 3.31Å; W116-L119 VanDerWaalsContact O-N 3.13Å; L119-P301 HydrophobicContact CD1-CB 4.45Å; L119-I304 HydrophobicContact CD2-CB 4.45Å; L119-I304 HydrophobicContact CD2-CG2 3.98Å; L119-K308 PolarHBondContact O-NZ 2.87Å
120	S	42.2	Very low	42.4	Very low	45 Å²	45	87.1 Å²	87.1	32%	0.315	51%	0.507	S	S	.	.	S	Bend	trans	-69.2	122.6	-178	65.3	0	0	0	0	108.9	W116 A117 A122 K308	W116-S120 WeakPolarHBondContact O-CA 3.3Å; W116-S120 WeakPolarHBondContact O-CB 3.44Å; W116-S120 PolarHBondContact O-N 3.31Å; W116-S120 PolarHBondContact O-OG 3.38Å; A117-S120 WeakPolarHBondContact CA-OG 3.43Å; A117-S120 PolarHBondContact O-OG 3.17Å; A117-S120 VanDerWaalsContact O-OG 3.05Å; S120-A122 PolarHBondContact O-N 2.86Å; S120-K308 PolarHBondContact O-NZ 3.38Å
121	P	40.3	Very low	42.2	Very low	105 Å²	105	89.7 Å²	89.7	68%	0.682	51%	0.514	S	S	*	.			trans	-49.3	129.4	-171.8	17.7	-29.9	0	0	0	110.8	G123	P121-G123 PolarHBondContact O-N 3.12Å
122	A	38.1	Very low	42.1	Very low	98 Å²	98	92 Å²	92	81%	0.81	52%	0.521	S	S	*	.	S	Bend	trans	-65.1	111.2	171.4	0	0	0	0	0	106.6	S120	S120-A122 PolarHBondContact O-N 2.86Å
123	G	35.2	Very low	42.7	Very low	50 Å²	50	94.4 Å²	94.4	52%	0.515	53%	0.531	S	S	.	.			trans	88.5	111	-175.1	0	0	0	0	0	112	P121 Q125	P121-G123 PolarHBondContact O-N 3.12Å; G123-Q125 PolarHBondContact O-N 3.06Å
124	V	28.9	Very low	43.2	Very low	144 Å²	144	93.9 Å²	93.9	87%	0.873	53%	0.529	S	S	*	.				-51.2	98.4	129.4	175.4	0	0	0	0	104.1	E126	V124-E126 VanDerWaalsContact C-N 3.26Å; V124-E126 PolarHBondContact O-N 3.22Å
125	Q	31.5	Very low	44.2	Very low	132 Å²	132	95.7 Å²	95.7	62%	0.617	54%	0.536	S	S	*	.			trans	-53.2	109.9	153.9	-83.3	-178.5	-30.9	0	0	103	G123 K127	G123-Q125 PolarHBondContact O-N 3.06Å; Q125-K127 PolarHBondContact O-N 2.8Å; Q125-K127 VanDerWaalsContact O-N 3.15Å
126	E	28.8	Very low	45.5	Very low	171 Å²	171	96 Å²	96	80%	0.799	53%	0.534	S	S	*	.			trans	-37.2	128	150.5	-75.9	179	151.8	0	0	105.6	V124 E128	V124-E126 VanDerWaalsContact C-N 3.26Å; V124-E126 PolarHBondContact O-N 3.22Å; E126-E128 PolarHBondContact O-N 3.35Å
127	K	31.4	Very low	46.7	Very low	177 Å²	177	92 Å²	92	77%	0.77	52%	0.52	S	S	*	.			trans	-46.6	99.3	171.6	-90.4	179.7	166.7	178.3	0	106.3	Q125	Q125-K127 PolarHBondContact O-N 2.8Å; Q125-K127 VanDerWaalsContact O-N 3.15Å
128	E	34.8	Very low	48	Very low	92 Å²	92	93.3 Å²	93.3	43%	0.43	52%	0.52	S	S	.	.			trans	-56.2	134.3	174.4	-79.9	-174	157.5	0	0	104.5	E126 G130 Q131 R134	E126-E128 PolarHBondContact O-N 3.35Å; E128-G130 PolarHBondContact O-N 2.89Å; E128-Q131 PolarHBondContact O-N 2.79Å; E128-R134 IonicContact OE2-CZ 2.83Å; E128-R134 IonicContact OE2-NH1 3.04Å; E128-R134 IonicContact OE2-NH2 3.27Å; E128-R134 PolarHBondContact OE2-NH2 2.81Å
129	P	35.2	Very low	49.6	Very low	136 Å²	136	97.2 Å²	97.2	88%	0.883	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-1.5	-178.3	17.8	-29.3	0	0	0	114.3
130	G	45.6	Very low	51.5	Low	22 Å²	22	98.8 Å²	98.8	23%	0.227	53%	0.533	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-4.7	172.4	0	0	0	0	0	117.1	E128 E132 N133 R134	E128-G130 PolarHBondContact O-N 2.89Å; G130-E132 VanDerWaalsContact C-N 3.31Å; G130-E132 PolarHBondContact O-N 2.8Å; G130-N133 PolarHBondContact O-N 2.83Å; G130-R134 VanDerWaalsContact O-CG 3.3Å; G130-R134 WeakPolarHBondContact O-CG 3.49Å; G130-R134 PolarHBondContact O-N 3.29Å
131	Q	46.7	Very low	53.2	Low	89 Å²	89	97 Å²	97	42%	0.416	52%	0.52	S	S	.	.	H	α-helix	trans	-65.9	-33.3	-175.9	-145.3	178	18.8	0	0	112.9	E128 R134 T135	E128-Q131 PolarHBondContact O-N 2.79Å; Q131-R134 PolarHBondContact O-N 2.63Å; Q131-T135 PolarHBondContact O-N 2.86Å
132	E	50.5	Low	55	Low	166 Å²	166	96.5 Å²	96.5	78%	0.776	51%	0.511	S	S	*	.	H	α-helix	trans	-68.9	-42.9	174.8	-143.6	169.5	-169.9	0	0	111.2	G130 R134 T135 L136	G130-E132 VanDerWaalsContact C-N 3.31Å; G130-E132 PolarHBondContact O-N 2.8Å; E132-R134 VanDerWaalsContact C-N 3.35Å; E132-R134 PolarHBondContact O-N 2.83Å; E132-T135 PolarHBondContact O-N 2.83Å; E132-T135 PolarHBondContact O-OG1 3.1Å; E132-L136 PolarHBondContact O-N 3.31Å
133	N	65.9	Low	57.3	Low	92 Å²	92	98.4 Å²	98.4	49%	0.492	50%	0.501	S	S	.	.	H	α-helix	trans	-59.5	-41	172.3	-79.8	-11.7	0	0	0	112.2	G130 T135 L136 L137	G130-N133 PolarHBondContact O-N 2.83Å; N133-T135 PolarHBondContact O-N 3.19Å; N133-L136 WeakPolarHBondContact O-CB 3.33Å; N133-L136 PolarHBondContact O-N 3.43Å; N133-L136 VanDerWaalsContact O-N 3.14Å; N133-L137 VanDerWaalsContact O-CG 3.3Å; N133-L137 WeakPolarHBondContact O-CG 3.47Å; N133-L137 PolarHBondContact O-N 3.36Å
134	R	67.2	Low	59.4	Low	64 Å²	64	97.3 Å²	97.3	24%	0.242	48%	0.484	C	S	.	.	H	α-helix	trans	-59.6	-44	-179.7	-72.7	174	-173	163.5	9.8	112.8	E128 G130 Q131 E132 L136 L137 M138 V437	E128-R134 IonicContact OE2-CZ 2.83Å; E128-R134 IonicContact OE2-NH1 3.04Å; E128-R134 IonicContact OE2-NH2 3.27Å; E128-R134 PolarHBondContact OE2-NH2 2.81Å; G130-R134 VanDerWaalsContact O-CG 3.3Å; G130-R134 WeakPolarHBondContact O-CG 3.49Å; G130-R134 PolarHBondContact O-N 3.29Å; Q131-R134 PolarHBondContact O-N 2.63Å; E132-R134 VanDerWaalsContact C-N 3.35Å; E132-R134 PolarHBondContact O-N 2.83Å; R134-L136 VanDerWaalsContact C-N 3.28Å; R134-L136 PolarHBondContact O-N 3.08Å; R134-L137 PolarHBondContact O-N 3.31Å; R134-M138 PolarHBondContact O-N 3.42Å; R134-V437 HydrophobicContact CB-CG1 4.45Å; R134-V437 HydrophobicContact CG-CB 4.42Å; R134-V437 HydrophobicContact CG-CG1 3.82Å; R134-V437 HydrophobicContact CG-CG2 4.36Å
135	T	70.7	Confident	61.9	Low	79 Å²	79	90.7 Å²	90.7	49%	0.485	44%	0.444	S	S	.	.	H	α-helix	trans	-65.3	-35.5	177.9	66.8	0	0	0	0	112	Q131 E132 N133 M138 K139	Q131-T135 PolarHBondContact O-N 2.86Å; E132-T135 PolarHBondContact O-N 2.83Å; E132-T135 PolarHBondContact O-OG1 3.1Å; N133-T135 PolarHBondContact O-N 3.19Å; T135-M138 PolarHBondContact O-N 2.92Å; T135-K139 WeakPolarHBondContact O-CG 3.44Å; T135-K139 PolarHBondContact O-N 3.4Å
136	L	76.9	Confident	64.4	Low	84 Å²	84	92 Å²	92	44%	0.44	44%	0.443	S	S	.	.	H	α-helix	trans	-69.1	-41.5	177.1	-164.2	126.5	0	0	0	111.4	E132 N133 R134 K139 R140	E132-L136 PolarHBondContact O-N 3.31Å; N133-L136 WeakPolarHBondContact O-CB 3.33Å; N133-L136 PolarHBondContact O-N 3.43Å; N133-L136 VanDerWaalsContact O-N 3.14Å; R134-L136 VanDerWaalsContact C-N 3.28Å; R134-L136 PolarHBondContact O-N 3.08Å; L136-K139 PolarHBondContact O-N 2.75Å; L136-R140 WeakPolarHBondContact O-CG 3.13Å; L136-R140 PolarHBondContact O-N 3.21Å
137	L	76.6	Confident	67.1	Low	16 Å²	16	87.7 Å²	87.7	8%	0.084	43%	0.429	C	S	.	.	H	α-helix	trans	-61.3	-44	172.6	-67	178.8	0	0	0	111.6	N133 R134 K139 R140 L141 V437 E441 F444	N133-L137 VanDerWaalsContact O-CG 3.3Å; N133-L137 WeakPolarHBondContact O-CG 3.47Å; N133-L137 PolarHBondContact O-N 3.36Å; R134-L137 PolarHBondContact O-N 3.31Å; L137-K139 PolarHBondContact O-N 2.96Å; L137-R140 PolarHBondContact O-N 3.36Å; L137-L141 WeakPolarHBondContact O-CB 3.5Å; L137-L141 WeakPolarHBondContact O-CG 3.42Å; L137-L141 PolarHBondContact O-N 2.89Å; L137-V437 HydrophobicContact CD1-CG1 3.64Å; L137-E441 HydrophobicContact CD1-CB 3.84Å; L137-E441 HydrophobicContact CD1-CG 4.2Å; L137-F444 HydrophobicContact CD2-CB 4.3Å; L137-F444 HydrophobicContact CD2-CD2 3.64Å; L137-F444 HydrophobicContact CD2-CE2 4.28Å; L137-F444 HydrophobicContact CD2-CG 4.27Å
138	M	74.4	Confident	69.7	Low	68 Å²	68	79.3 Å²	79.3	34%	0.335	39%	0.393	S	S	.	.	H	α-helix	trans	-61.1	-43.8	176	-141.3	90.7	130.9	0	0	111.6	R134 T135 R140 L141 L142 W263	R134-M138 PolarHBondContact O-N 3.42Å; T135-M138 PolarHBondContact O-N 2.92Å; M138-R140 VanDerWaalsContact C-N 3.34Å; M138-R140 PolarHBondContact O-N 3.31Å; M138-L141 WeakPolarHBondContact O-CB 3.35Å; M138-L141 PolarHBondContact O-N 2.88Å; M138-L142 WeakPolarHBondContact O-CG 3.43Å; M138-L142 PolarHBondContact O-N 2.98Å; M138-W263 HydrophobicContact CE-CH2 4.17Å; M138-W263 HydrophobicContact SD-CH2 3.79Å; M138-W263 HydrophobicContact SD-CZ3 3.98Å
139	K	80.5	Confident	72.1	Confident	151 Å²	151	78.9 Å²	78.9	66%	0.657	39%	0.393	S	S	*	.	H	α-helix	trans	-62.6	-39.8	175.6	-77.3	176.9	-179.1	177	0	112	T135 L136 L137 L142 K143	T135-K139 WeakPolarHBondContact O-CG 3.44Å; T135-K139 PolarHBondContact O-N 3.4Å; L136-K139 PolarHBondContact O-N 2.75Å; L137-K139 PolarHBondContact O-N 2.96Å; K139-L142 PolarHBondContact O-N 3.09Å; K139-K143 WeakPolarHBondContact O-CB 3.45Å; K139-K143 PolarHBondContact O-N 3.33Å
140	R	81	Confident	74.6	Confident	93 Å²	93	76.2 Å²	76.2	35%	0.351	38%	0.376	S	S	.	.	H	α-helix	trans	-66.2	-43	176	-74.8	177.4	176.2	-166.1	-0.9	112	L136 L137 M138 L142 K143 L144 F444 D448	L136-R140 WeakPolarHBondContact O-CG 3.13Å; L136-R140 PolarHBondContact O-N 3.21Å; L137-R140 PolarHBondContact O-N 3.36Å; M138-R140 VanDerWaalsContact C-N 3.34Å; M138-R140 PolarHBondContact O-N 3.31Å; R140-L142 VanDerWaalsContact C-N 3.35Å; R140-L142 PolarHBondContact O-N 2.89Å; R140-K143 WeakPolarHBondContact O-CB 3.39Å; R140-K143 PolarHBondContact O-N 3Å; R140-K143 VanDerWaalsContact O-N 3.11Å; R140-L144 PolarHBondContact O-N 3.49Å; R140-F444 HydrophobicContact CB-CE1 4.27Å; R140-F444 HydrophobicContact CB-CE2 4.32Å; R140-F444 HydrophobicContact CB-CZ 3.85Å; R140-D448 IonicContact CZ-OD2 3.68Å; R140-D448 IonicContact NH1-OD1 3.92Å; R140-D448 IonicContact NH1-OD2 2.72Å; R140-D448 PolarHBondContact NH1-OD2 3.28Å; R140-D448 IonicContact NH2-OD2 3.66Å
141	L	77.8	Confident	76.6	Confident	8 Å²	8	78.8 Å²	78.8	4%	0.042	38%	0.381	C	S	.	.	H	α-helix	trans	-57.8	-45.4	172.6	-81.7	166.7	0	0	0	112.1	L137 M138 K143 L144 S145 M260 W263 L264 A440 F444	L137-L141 WeakPolarHBondContact O-CB 3.5Å; L137-L141 WeakPolarHBondContact O-CG 3.42Å; L137-L141 PolarHBondContact O-N 2.89Å; M138-L141 WeakPolarHBondContact O-CB 3.35Å; M138-L141 PolarHBondContact O-N 2.88Å; L141-K143 VanDerWaalsContact C-N 3.3Å; L141-K143 PolarHBondContact O-N 3.42Å; L141-L144 WeakPolarHBondContact O-CB 3.33Å; L141-L144 PolarHBondContact O-N 3.18Å; L141-S145 PolarHBondContact O-N 3.44Å; L141-M260 HydrophobicContact CD2-CE 3.35Å; L141-M260 HydrophobicContact CD2-CG 3.89Å; L141-M260 HydrophobicContact CD2-SD 4.46Å; L141-M260 HydrophobicContact CG-CE 4.25Å; L141-W263 HydrophobicContact CD1-CZ3 4.24Å; L141-L264 HydrophobicContact CB-CD1 4.41Å; L141-L264 HydrophobicContact CB-CD2 4.15Å; L141-A440 HydrophobicContact CD1-CB 4.08Å; L141-F444 HydrophobicContact CD2-CE2 4.26Å; L141-F444 HydrophobicContact CD2-CZ 4.29Å; L141-F444 HydrophobicContact CG-CE2 3.93Å; L141-F444 HydrophobicContact CG-CZ 4.16Å
142	L	78.6	Confident	78.5	Confident	95 Å²	95	76.4 Å²	76.4	50%	0.497	37%	0.371	S	S	.	.	H	α-helix	trans	-65.2	-32.3	174.6	-75.5	162.3	0	0	0	112.6	M138 K139 R140 L144 S145 R146	M138-L142 WeakPolarHBondContact O-CG 3.43Å; M138-L142 PolarHBondContact O-N 2.98Å; K139-L142 PolarHBondContact O-N 3.09Å; R140-L142 VanDerWaalsContact C-N 3.35Å; R140-L142 PolarHBondContact O-N 2.89Å; L142-L144 VanDerWaalsContact C-N 3.34Å; L142-S145 PolarHBondContact O-N 3.09Å; L142-S145 PolarHBondContact O-OG 3.45Å; L142-R146 PolarHBondContact O-N 2.95Å
143	K	84.5	Confident	80.4	Confident	138 Å²	138	73.8 Å²	73.8	60%	0.6	36%	0.361	S	S	*	.	H	α-helix	trans	-67.3	-37.8	174.3	-166.5	179.9	178.8	-175.9	0	111.2	K139 R140 L141 S145 R146	K139-K143 WeakPolarHBondContact O-CB 3.45Å; K139-K143 PolarHBondContact O-N 3.33Å; R140-K143 WeakPolarHBondContact O-CB 3.39Å; R140-K143 PolarHBondContact O-N 3Å; R140-K143 VanDerWaalsContact O-N 3.11Å; L141-K143 VanDerWaalsContact C-N 3.3Å; L141-K143 PolarHBondContact O-N 3.42Å; K143-S145 VanDerWaalsContact C-N 3.29Å; K143-S145 PolarHBondContact O-N 3.15Å; K143-R146 WeakPolarHBondContact O-CB 3.4Å; K143-R146 WeakPolarHBondContact O-CG 3.25Å; K143-R146 PolarHBondContact O-N 3.27Å
144	L	80.6	Confident	81.5	Confident	27 Å²	27	71 Å²	71	14%	0.141	35%	0.351	C	S	.	.	H	α-helix	trans	-64.6	-29.9	175.5	-92.7	147.3	0	0	0	113.2	R140 L141 L142 P147 R224 I225 F444	R140-L144 PolarHBondContact O-N 3.49Å; L141-L144 WeakPolarHBondContact O-CB 3.33Å; L141-L144 PolarHBondContact O-N 3.18Å; L142-L144 VanDerWaalsContact C-N 3.34Å; L144-P147 WeakPolarHBondContact O-CD 3.41Å; L144-R224 PolarHBondContact O-NH1 3.18Å; L144-I225 HydrophobicContact CD2-CG1 4.23Å; L144-F444 HydrophobicContact CD1-CE1 3.64Å; L144-F444 HydrophobicContact CD1-CZ 3.63Å
145	S	80.8	Confident	82.6	Confident	5 Å²	5	68 Å²	68	4%	0.035	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-4.9	177.8	64.5	0	0	0	0	114.6	L141 L142 K143 P147 D148 L149	L141-S145 PolarHBondContact O-N 3.44Å; L142-S145 PolarHBondContact O-N 3.09Å; L142-S145 PolarHBondContact O-OG 3.45Å; K143-S145 VanDerWaalsContact C-N 3.29Å; K143-S145 PolarHBondContact O-N 3.15Å; S145-P147 VanDerWaalsContact C-N 3.35Å; S145-D148 PolarHBondContact O-N 3.33Å; S145-L149 PolarHBondContact O-N 2.92Å
146	R	83.8	Confident	83.5	Confident	160 Å²	160	68.2 Å²	68.2	60%	0.604	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-50.4	-42	177.8	-76.9	-177.5	176.1	-175.2	-2.7	115	L142 K143 D148 L149	L142-R146 PolarHBondContact O-N 2.95Å; K143-R146 WeakPolarHBondContact O-CB 3.4Å; K143-R146 WeakPolarHBondContact O-CG 3.25Å; K143-R146 PolarHBondContact O-N 3.27Å; R146-D148 PolarHBondContact O-N 3.26Å; R146-L149 HydrophobicContact CB-CD1 4.35Å; R146-L149 HydrophobicContact CG-CD1 4.33Å; R146-L149 WeakPolarHBondContact O-CB 3.12Å; R146-L149 WeakPolarHBondContact O-CD1 3.16Å; R146-L149 WeakPolarHBondContact O-CG 3.23Å; R146-L149 PolarHBondContact O-N 3Å
147	P	86	Confident	84.1	Confident	79 Å²	79	70.4 Å²	70.4	51%	0.513	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-65.2	-22.8	-179.9	-19.2	33.2	0	0	0	113	L144 S145	L144-P147 WeakPolarHBondContact O-CD 3.41Å; S145-P147 VanDerWaalsContact C-N 3.35Å
148	D	86.3	Confident	84.9	Confident	2 Å²	2	72.3 Å²	72.3	1%	0.011	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-103.8	7.7	-174.2	-51.4	-70.3	0	0	0	112	S145 R146 F151 L152 T217 R224	S145-D148 PolarHBondContact O-N 3.33Å; R146-D148 PolarHBondContact O-N 3.26Å; D148-F151 PolarHBondContact O-N 3Å; D148-F151 VanDerWaalsContact O-N 3.17Å; D148-L152 PolarHBondContact O-N 3.44Å; D148-L152 VanDerWaalsContact O-N 3.14Å; D148-T217 HydrophobicContact CB-CG2 3.67Å; D148-R224 IonicContact OD1-NH2 3.56Å; D148-R224 IonicContact OD2-CZ 3.56Å; D148-R224 IonicContact OD2-NH1 3.37Å; D148-R224 PolarHBondContact OD2-NH1 3.19Å; D148-R224 IonicContact OD2-NH2 3.76Å; D148-R224 PolarHBondContact OD2-NH2 3.42Å; D148-R224 VanDerWaalsContact OD2-NH2 3.1Å
149	L	84.8	Confident	85.6	Confident	83 Å²	83	69.1 Å²	69.1	44%	0.435	33%	0.332	S	S	.	.	H	α-helix	trans	-47.8	-44.2	172	-87.7	165.1	0	0	0	115.1	S145 R146 F151 L152 I153	S145-L149 PolarHBondContact O-N 2.92Å; R146-L149 HydrophobicContact CB-CD1 4.35Å; R146-L149 HydrophobicContact CG-CD1 4.33Å; R146-L149 WeakPolarHBondContact O-CB 3.12Å; R146-L149 WeakPolarHBondContact O-CD1 3.16Å; R146-L149 WeakPolarHBondContact O-CG 3.23Å; R146-L149 PolarHBondContact O-N 3Å; L149-F151 VanDerWaalsContact C-N 3.28Å; L149-F151 PolarHBondContact O-N 2.94Å; L149-L152 PolarHBondContact O-N 3.13Å; L149-L152 VanDerWaalsContact O-N 3.16Å; L149-I153 VanDerWaalsContact O-CG1 3.28Å; L149-I153 WeakPolarHBondContact O-CG1 3.41Å; L149-I153 PolarHBondContact O-N 3.26Å
150	P	88.1	Confident	86.1	Confident	80 Å²	80	63.9 Å²	63.9	52%	0.519	31%	0.313	S	S	.	.	H	α-helix	trans	-61.2	-38.3	-179.5	22.4	-33.6	0	0	0	112.4	I153 A154	P150-I153 PolarHBondContact O-N 3.01Å; P150-A154 WeakPolarHBondContact O-CB 3.43Å; P150-A154 PolarHBondContact O-N 3.46Å
151	F	87.8	Confident	86.5	Confident	75 Å²	75	62.5 Å²	62.5	33%	0.329	32%	0.315	S	S	.	.	H	α-helix	trans	-70.2	-36.5	176.4	-63.7	-71.4	0	0	0	112.1	D148 L149 A154 A155 F216 T217	D148-F151 PolarHBondContact O-N 3Å; D148-F151 VanDerWaalsContact O-N 3.17Å; L149-F151 VanDerWaalsContact C-N 3.28Å; L149-F151 PolarHBondContact O-N 2.94Å; F151-A154 PolarHBondContact O-N 2.95Å; F151-A155 VanDerWaalsContact O-CB 3.27Å; F151-A155 WeakPolarHBondContact O-CB 3.42Å; F151-A155 PolarHBondContact O-N 3.21Å; F151-F216 HydrophobicContact CD1-CD1 4.22Å; F151-F216 HydrophobicContact CD2-CD1 4.39Å; F151-F216 HydrophobicContact CD2-CE1 4.37Å; F151-F216 HydrophobicContact CE1-CD1 4.16Å; F151-F216 HydrophobicContact CE1-CE1 4.05Å; F151-F216 HydrophobicContact CE2-CD1 4.34Å; F151-F216 AromaticContact CE2-CE1 3.9Å; F151-F216 HydrophobicContact CE2-CE1 3.9Å; F151-F216 HydrophobicContact CG-CD1 4.33Å; F151-F216 HydrophobicContact CZ-CD1 4.23Å; F151-F216 AromaticContact CZ-CE1 3.72Å; F151-F216 HydrophobicContact CZ-CE1 3.72Å; F151-T217 WeakPolarHBondContact CB-OG1 3.26Å
152	L	86.6	Confident	87.1	Confident	40 Å²	40	62.2 Å²	62.2	21%	0.209	31%	0.314	C	S	.	.	H	α-helix	trans	-66.6	-38.8	174.4	-69.6	173.2	0	0	0	112.3	D148 L149 A155 F156 F214 T217	D148-L152 PolarHBondContact O-N 3.44Å; D148-L152 VanDerWaalsContact O-N 3.14Å; L149-L152 PolarHBondContact O-N 3.13Å; L149-L152 VanDerWaalsContact O-N 3.16Å; L152-A155 PolarHBondContact O-N 3.19Å; L152-F156 PolarHBondContact O-N 3.14Å; L152-F214 HydrophobicContact CD2-CD1 4.12Å; L152-F214 HydrophobicContact CD2-CE1 3.78Å; L152-T217 HydrophobicContact CD1-CG2 4.43Å; L152-T217 HydrophobicContact CD2-CG2 3.87Å; L152-T217 HydrophobicContact CG-CG2 3.99Å
153	I	88.6	Confident	87.6	Confident	110 Å²	110	57.8 Å²	57.8	56%	0.564	29%	0.291	S	S	*	.	H	α-helix	trans	-66.1	-46.1	175.8	-67	163.7	0	0	0	110.1	L149 P150 A155 F156 F157	L149-I153 VanDerWaalsContact O-CG1 3.28Å; L149-I153 WeakPolarHBondContact O-CG1 3.41Å; L149-I153 PolarHBondContact O-N 3.26Å; P150-I153 PolarHBondContact O-N 3.01Å; I153-A155 VanDerWaalsContact C-N 3.31Å; I153-A155 PolarHBondContact O-N 2.7Å; I153-F156 PolarHBondContact O-N 2.99Å; I153-F157 PolarHBondContact O-N 3.18Å
154	A	90.2	Very high	87.7	Confident	35 Å²	35	58.1 Å²	58.1	29%	0.289	29%	0.288	S	S	.	.	H	α-helix	trans	-58.9	-43.7	174.1	0	0	0	0	0	111.4	P150 F151 F156 F157 F158	P150-A154 WeakPolarHBondContact O-CB 3.43Å; P150-A154 PolarHBondContact O-N 3.46Å; F151-A154 PolarHBondContact O-N 2.95Å; A154-F156 VanDerWaalsContact C-N 3.31Å; A154-F156 PolarHBondContact O-N 3.24Å; A154-F157 WeakPolarHBondContact O-CB 3.35Å; A154-F157 PolarHBondContact O-N 3.41Å; A154-F158 WeakPolarHBondContact O-CD2 3.42Å; A154-F158 PolarHBondContact O-N 3.02Å
155	A	89.9	Confident	88	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.2	-37.9	176.5	0	0	0	0	0	112.5	F151 L152 I153 L159 F214	F151-A155 VanDerWaalsContact O-CB 3.27Å; F151-A155 WeakPolarHBondContact O-CB 3.42Å; F151-A155 PolarHBondContact O-N 3.21Å; L152-A155 PolarHBondContact O-N 3.19Å; I153-A155 VanDerWaalsContact C-N 3.31Å; I153-A155 PolarHBondContact O-N 2.7Å; A155-L159 WeakPolarHBondContact O-CB 3.45Å; A155-L159 PolarHBondContact O-N 3.34Å; A155-F214 HydrophobicContact CB-CD2 3.67Å; A155-F214 HydrophobicContact CB-CE2 3.5Å; A155-F214 HydrophobicContact CB-CG 4.31Å; A155-F214 HydrophobicContact CB-CZ 4.02Å
156	F	88.9	Confident	88.4	Confident	84 Å²	84	58.6 Å²	58.6	37%	0.368	29%	0.291	S	S	.	.	H	α-helix	trans	-67.1	-42.2	174.8	179.6	-120.9	0	0	0	112.2	L152 I153 A154 L159 V160 L272 V276	L152-F156 PolarHBondContact O-N 3.14Å; I153-F156 PolarHBondContact O-N 2.99Å; A154-F156 VanDerWaalsContact C-N 3.31Å; A154-F156 PolarHBondContact O-N 3.24Å; F156-L159 HydrophobicContact CD2-CD2 4.1Å; F156-L159 HydrophobicContact CE2-CD2 4.2Å; F156-L159 WeakPolarHBondContact O-CB 3.4Å; F156-L159 PolarHBondContact O-N 3.05Å; F156-V160 HydrophobicContact CD2-CG2 4.22Å; F156-V160 HydrophobicContact CE1-CG2 4.24Å; F156-V160 HydrophobicContact CE2-CG2 3.8Å; F156-V160 HydrophobicContact CZ-CG2 3.82Å; F156-V160 WeakPolarHBondContact O-CG2 3.42Å; F156-V160 PolarHBondContact O-N 3.33Å; F156-L272 HydrophobicContact CB-CD2 4.33Å; F156-L272 HydrophobicContact CD2-CD1 3.97Å; F156-L272 HydrophobicContact CD2-CD2 3.14Å; F156-L272 HydrophobicContact CD2-CG 3.56Å; F156-L272 HydrophobicContact CE2-CD1 3.47Å; F156-L272 VanDerWaalsContact CE2-CD1 3.47Å; F156-L272 HydrophobicContact CE2-CD2 3.63Å; F156-L272 HydrophobicContact CE2-CG 3.53Å; F156-L272 HydrophobicContact CG-CD2 4.02Å; F156-L272 HydrophobicContact CZ-CD1 4.34Å; F156-V276 HydrophobicContact CE2-CG2 4.48Å
157	F	90.8	Very high	88.5	Confident	129 Å²	129	51.1 Å²	51.1	57%	0.566	26%	0.263	S	S	*	.	H	α-helix	trans	-58.2	-51.8	174.9	175.3	-98.4	0	0	0	111.4	I153 A154 L159 V160 V161	I153-F157 PolarHBondContact O-N 3.18Å; A154-F157 WeakPolarHBondContact O-CB 3.35Å; A154-F157 PolarHBondContact O-N 3.41Å; F157-L159 PolarHBondContact O-N 2.97Å; F157-V160 PolarHBondContact O-N 2.88Å; F157-V161 HydrophobicContact CE1-CG2 4.1Å; F157-V161 HydrophobicContact CE2-CG2 4.29Å; F157-V161 HydrophobicContact CZ-CG2 3.98Å; F157-V161 WeakPolarHBondContact O-CG2 3.38Å; F157-V161 PolarHBondContact O-N 3.12Å
158	F	92.5	Very high	88.7	Confident	57 Å²	57	48.7 Å²	48.7	25%	0.25	25%	0.246	C	C	.	.	H	α-helix	trans	-63.2	-30.3	176	-72	-58.8	0	0	0	113	A154 A162 S206 C209 R210	A154-F158 WeakPolarHBondContact O-CD2 3.42Å; A154-F158 PolarHBondContact O-N 3.02Å; F158-A162 WeakPolarHBondContact O-CB 3.48Å; F158-A162 PolarHBondContact O-N 3.38Å; F158-S206 WeakPolarHBondContact CA-OG 3.27Å; F158-S206 PolarHBondContact O-OG 3.12Å; F158-C209 HydrophobicContact CB-CB 4.43Å; F158-C209 HydrophobicContact CD1-CB 3.84Å; F158-C209 HydrophobicContact CD2-CB 3.74Å; F158-C209 HydrophobicContact CE1-CB 3.95Å; F158-C209 HydrophobicContact CE2-CB 3.86Å; F158-C209 HydrophobicContact CG-CB 3.75Å; F158-C209 HydrophobicContact CZ-CB 3.96Å; F158-R210 HydrophobicContact CB-CB 3.96Å
159	L	90.5	Very high	88.8	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.7	-46.7	173.7	174.3	152.4	0	0	0	111.5	A155 F156 F157 A162 V163 R210 L272 R273 V276	A155-L159 WeakPolarHBondContact O-CB 3.45Å; A155-L159 PolarHBondContact O-N 3.34Å; F156-L159 HydrophobicContact CD2-CD2 4.1Å; F156-L159 HydrophobicContact CE2-CD2 4.2Å; F156-L159 WeakPolarHBondContact O-CB 3.4Å; F156-L159 PolarHBondContact O-N 3.05Å; F157-L159 PolarHBondContact O-N 2.97Å; L159-A162 PolarHBondContact O-N 2.91Å; L159-V163 WeakPolarHBondContact O-CB 3.37Å; L159-V163 VanDerWaalsContact O-CG2 3.23Å; L159-V163 WeakPolarHBondContact O-CG2 3.41Å; L159-V163 PolarHBondContact O-N 3.47Å; L159-R210 HydrophobicContact CB-CG 4.39Å; L159-L272 HydrophobicContact CD1-CB 4.17Å; L159-L272 HydrophobicContact CD1-CD2 4.4Å; L159-L272 HydrophobicContact CD1-CG 4.18Å; L159-L272 HydrophobicContact CD2-CG 4.22Å; L159-R273 HydrophobicContact CD1-CB 4.1Å; L159-V276 HydrophobicContact CD2-CB 4.31Å; L159-V276 HydrophobicContact CD2-CG2 4.05Å
160	V	89.2	Confident	89.1	Confident	41 Å²	41	47.2 Å²	47.2	25%	0.248	24%	0.238	C	C	.	.	H	α-helix	trans	-63.7	-48.4	178.6	175.5	0	0	0	0	109.9	F156 F157 A162 V163 W164	F156-V160 HydrophobicContact CD2-CG2 4.22Å; F156-V160 HydrophobicContact CE1-CG2 4.24Å; F156-V160 HydrophobicContact CE2-CG2 3.8Å; F156-V160 HydrophobicContact CZ-CG2 3.82Å; F156-V160 WeakPolarHBondContact O-CG2 3.42Å; F156-V160 PolarHBondContact O-N 3.33Å; F157-V160 PolarHBondContact O-N 2.88Å; V160-A162 VanDerWaalsContact C-N 3.34Å; V160-A162 PolarHBondContact O-N 3.32Å; V160-V163 PolarHBondContact O-N 3.15Å; V160-W164 VanDerWaalsContact O-CD1 3.23Å; V160-W164 PolarHBondContact O-N 3.44Å
161	V	90	Very high	89.1	Confident	64 Å²	64	49.3 Å²	49.3	39%	0.388	24%	0.235	S	C	.	.	H	α-helix	trans	-59.5	-43.8	178.8	174.2	0	0	0	0	111.8	F157 W164 G165	F157-V161 HydrophobicContact CE1-CG2 4.1Å; F157-V161 HydrophobicContact CE2-CG2 4.29Å; F157-V161 HydrophobicContact CZ-CG2 3.98Å; F157-V161 WeakPolarHBondContact O-CG2 3.38Å; F157-V161 PolarHBondContact O-N 3.12Å; V161-W164 PolarHBondContact O-N 3.48Å; V161-G165 PolarHBondContact O-N 3.06Å
162	A	90.4	Very high	89.1	Confident	2 Å²	2	47.9 Å²	47.9	2%	0.017	23%	0.228	C	C	.	.	H	α-helix	trans	-62.5	-45.8	177.3	0	0	0	0	0	111.7	F158 L159 V160 G165 E166 S206 A207	F158-A162 WeakPolarHBondContact O-CB 3.48Å; F158-A162 PolarHBondContact O-N 3.38Å; L159-A162 PolarHBondContact O-N 2.91Å; V160-A162 VanDerWaalsContact C-N 3.34Å; V160-A162 PolarHBondContact O-N 3.32Å; A162-G165 PolarHBondContact O-N 3.44Å; A162-E166 WeakPolarHBondContact O-CB 3.41Å; A162-E166 WeakPolarHBondContact O-CG 3.48Å; A162-E166 PolarHBondContact O-N 3.13Å; A162-S206 PolarHBondContact N-OG 3.02Å; A162-A207 HydrophobicContact CB-CB 4.3Å
163	V	88.5	Confident	89.2	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-63.4	-45.8	-179.7	170.1	0	0	0	0	110.9	L159 V160 G165 E166 T167 R273 V276 K277	L159-V163 WeakPolarHBondContact O-CB 3.37Å; L159-V163 VanDerWaalsContact O-CG2 3.23Å; L159-V163 WeakPolarHBondContact O-CG2 3.41Å; L159-V163 PolarHBondContact O-N 3.47Å; V160-V163 PolarHBondContact O-N 3.15Å; V163-G165 PolarHBondContact O-N 3.27Å; V163-E166 PolarHBondContact O-N 3Å; V163-T167 HydrophobicContact CG1-CG2 4.18Å; V163-T167 VanDerWaalsContact O-CG2 3.28Å; V163-T167 WeakPolarHBondContact O-CG2 3.45Å; V163-T167 PolarHBondContact O-N 3.38Å; V163-T167 PolarHBondContact O-OG1 3.33Å; V163-T167 VanDerWaalsContact O-OG1 3.07Å; V163-R273 HydrophobicContact CG2-CG 4.41Å; V163-V276 HydrophobicContact CB-CG1 4.15Å; V163-V276 HydrophobicContact CG1-CG1 3.82Å; V163-V276 HydrophobicContact CG2-CG1 4.45Å; V163-K277 HydrophobicContact CB-CG 4.46Å; V163-K277 HydrophobicContact CG1-CB 4.49Å; V163-K277 HydrophobicContact CG1-CD 3.74Å; V163-K277 HydrophobicContact CG1-CG 3.74Å; V163-K277 HydrophobicContact CG2-CD 4.42Å; V163-K277 HydrophobicContact CG2-CG 3.89Å
164	W	87.1	Confident	89.2	Confident	145 Å²	145	42.2 Å²	42.2	55%	0.549	20%	0.202	S	C	.	.	H	α-helix	trans	-58.9	-48.2	177	-87	77.9	0	0	0	111.7	V160 V161 E166 T167 L168	V160-W164 VanDerWaalsContact O-CD1 3.23Å; V160-W164 PolarHBondContact O-N 3.44Å; V161-W164 PolarHBondContact O-N 3.48Å; W164-E166 PolarHBondContact O-N 3.36Å; W164-T167 WeakPolarHBondContact CA-OG1 3.48Å; W164-T167 PolarHBondContact O-N 3.28Å; W164-T167 PolarHBondContact O-OG1 2.94Å; W164-L168 WeakPolarHBondContact O-CG 3.15Å; W164-L168 PolarHBondContact O-N 2.94Å
165	G	87.4	Confident	89	Confident	6 Å²	6	47.4 Å²	47.4	6%	0.062	21%	0.214	C	C	.	.	H	α-helix	trans	-58.8	-47.1	176.6	0	0	0	0	0	112.8	V161 A162 V163 T167 L168	V161-G165 PolarHBondContact O-N 3.06Å; A162-G165 PolarHBondContact O-N 3.44Å; V163-G165 PolarHBondContact O-N 3.27Å; G165-T167 PolarHBondContact O-N 2.85Å; G165-L168 PolarHBondContact O-N 2.83Å
166	E	88.1	Confident	89	Confident	35 Å²	35	48.4 Å²	48.4	16%	0.164	22%	0.22	C	C	.	.	H	α-helix	trans	-61.8	-42.4	177.3	-72.7	174.1	-167.2	0	0	112	A162 V163 W164 L168 I169 P170 R273 K277	A162-E166 WeakPolarHBondContact O-CB 3.41Å; A162-E166 WeakPolarHBondContact O-CG 3.48Å; A162-E166 PolarHBondContact O-N 3.13Å; V163-E166 PolarHBondContact O-N 3Å; W164-E166 PolarHBondContact O-N 3.36Å; E166-L168 PolarHBondContact O-N 3.49Å; E166-I169 PolarHBondContact O-N 2.76Å; E166-P170 WeakPolarHBondContact O-CD 3.34Å; E166-R273 IonicContact OE1-NH2 3.05Å; E166-R273 IonicContact OE2-NH2 3.36Å; E166-K277 WeakPolarHBondContact OE2-CE 3.11Å; E166-K277 IonicContact OE2-NZ 3.6Å; E166-K277 PolarHBondContact OE2-NZ 3.42Å
167	T	87.8	Confident	89	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.018	22%	0.22	C	C	.	.	H	α-helix	trans	-68.4	-19.9	-179.4	54.1	0	0	0	0	113.8	V163 W164 G165 K277 L281 Y415	V163-T167 HydrophobicContact CG1-CG2 4.18Å; V163-T167 VanDerWaalsContact O-CG2 3.28Å; V163-T167 WeakPolarHBondContact O-CG2 3.45Å; V163-T167 PolarHBondContact O-N 3.38Å; V163-T167 PolarHBondContact O-OG1 3.33Å; V163-T167 VanDerWaalsContact O-OG1 3.07Å; W164-T167 WeakPolarHBondContact CA-OG1 3.48Å; W164-T167 PolarHBondContact O-N 3.28Å; W164-T167 PolarHBondContact O-OG1 2.94Å; G165-T167 PolarHBondContact O-N 2.85Å; T167-K277 HydrophobicContact CG2-CD 4.13Å; T167-L281 HydrophobicContact CG2-CD2 3.8Å; T167-L281 HydrophobicContact CG2-CG 4.09Å; T167-Y415 WeakPolarHBondContact O-CE1 3.25Å; T167-Y415 PolarHBondContact O-OH 3.43Å
168	L	88.8	Confident	88.8	Confident	29 Å²	29	44.2 Å²	44.2	15%	0.152	21%	0.206	C	C	.	.	H	α-helix	trans	-79.6	-24	176.6	-70.6	169.6	0	0	0	112.2	W164 G165 E166 R171 Y172 F199 F284	W164-L168 WeakPolarHBondContact O-CG 3.15Å; W164-L168 PolarHBondContact O-N 2.94Å; G165-L168 PolarHBondContact O-N 2.83Å; E166-L168 PolarHBondContact O-N 3.49Å; L168-R171 WeakPolarHBondContact O-CB 3.49Å; L168-R171 PolarHBondContact O-N 3.26Å; L168-R171 VanDerWaalsContact O-N 3.17Å; L168-Y172 HydrophobicContact CB-CD2 4.33Å; L168-Y172 HydrophobicContact CB-CE2 4.25Å; L168-Y172 VanDerWaalsContact O-CD2 3.29Å; L168-Y172 WeakPolarHBondContact O-CD2 2.93Å; L168-Y172 PolarHBondContact O-N 3.38Å; L168-F199 HydrophobicContact CB-CD2 4.08Å; L168-F199 HydrophobicContact CB-CE2 4.46Å; L168-F199 HydrophobicContact CB-CG 4.27Å; L168-F199 HydrophobicContact CD1-CD1 3.86Å; L168-F199 HydrophobicContact CD1-CD2 4.14Å; L168-F199 HydrophobicContact CD1-CE1 3.6Å; L168-F199 HydrophobicContact CD1-CE2 3.91Å; L168-F199 HydrophobicContact CD1-CG 4.14Å; L168-F199 HydrophobicContact CD1-CZ 3.64Å; L168-F284 HydrophobicContact CD2-CE1 4.39Å; L168-F284 HydrophobicContact CD2-CZ 4.12Å
169	I	89	Confident	88.5	Confident	48 Å²	48	42.5 Å²	42.5	25%	0.246	20%	0.2	C	C	.	.	H	α-helix	trans	-56.4	-52.4	-176.6	-60.5	169	0	0	0	111.5	E166 R171 Y172 S173 M196	E166-I169 PolarHBondContact O-N 2.76Å; I169-R171 VanDerWaalsContact C-N 3.27Å; I169-R171 PolarHBondContact O-N 3.42Å; I169-Y172 PolarHBondContact O-N 2.82Å; I169-Y172 VanDerWaalsContact O-N 3.17Å; I169-S173 PolarHBondContact O-N 3.02Å; I169-S173 PolarHBondContact O-OG 2.87Å; I169-S173 VanDerWaalsContact O-OG 3.11Å; I169-M196 HydrophobicContact CG2-CG 4.38Å
170	P	90.2	Very high	88.3	Confident	6 Å²	6	47.5 Å²	47.5	4%	0.039	23%	0.226	C	C	.	.	H	α-helix	trans	-62.6	-29.6	-179.5	-24.6	36.1	0	0	0	114.4	E166 S173 G174 S411 L414 Y415	E166-P170 WeakPolarHBondContact O-CD 3.34Å; P170-S173 PolarHBondContact O-N 3.3Å; P170-G174 PolarHBondContact O-N 3.12Å; P170-S411 WeakPolarHBondContact O-CB 3.22Å; P170-S411 PolarHBondContact O-OG 3.46Å; P170-L414 HydrophobicContact CB-CB 3.78Å; P170-L414 HydrophobicContact CB-CD1 3.94Å; P170-L414 HydrophobicContact CG-CB 4.2Å; P170-Y415 HydrophobicContact CB-CD1 3.88Å; P170-Y415 HydrophobicContact CB-CE1 3.5Å; P170-Y415 HydrophobicContact CB-CE2 4.44Å; P170-Y415 HydrophobicContact CG-CD1 3.84Å; P170-Y415 HydrophobicContact CG-CE1 3.52Å
171	R	88.4	Confident	87.8	Confident	123 Å²	123	47.8 Å²	47.8	46%	0.464	24%	0.237	S	C	.	.	H	α-helix	trans	-66.4	-44.4	175.7	-177.6	176.4	-178.8	127.9	-0.1	111.5	L168 I169 G174 R175 Q287 Y415	L168-R171 WeakPolarHBondContact O-CB 3.49Å; L168-R171 PolarHBondContact O-N 3.26Å; L168-R171 VanDerWaalsContact O-N 3.17Å; I169-R171 VanDerWaalsContact C-N 3.27Å; I169-R171 PolarHBondContact O-N 3.42Å; R171-G174 PolarHBondContact O-N 2.99Å; R171-R175 PolarHBondContact O-N 3.45Å; R171-Q287 VanDerWaalsContact NH1-OE1 3.12Å; R171-Y415 WeakPolarHBondContact CB-OH 3.49Å; R171-Y415 PolarHBondContact N-OH 3.3Å
172	Y	88.6	Confident	87.2	Confident	46 Å²	46	47.1 Å²	47.1	18%	0.18	24%	0.243	C	C	.	.	H	α-helix	trans	-70.5	-35.2	176.6	-76	-79.5	0	0	0	111.7	L168 I169 G174 R175 V176 A192 F195 F199	L168-Y172 HydrophobicContact CB-CD2 4.33Å; L168-Y172 HydrophobicContact CB-CE2 4.25Å; L168-Y172 VanDerWaalsContact O-CD2 3.29Å; L168-Y172 WeakPolarHBondContact O-CD2 2.93Å; L168-Y172 PolarHBondContact O-N 3.38Å; I169-Y172 PolarHBondContact O-N 2.82Å; I169-Y172 VanDerWaalsContact O-N 3.17Å; Y172-G174 VanDerWaalsContact C-N 3.32Å; Y172-G174 PolarHBondContact O-N 3.04Å; Y172-R175 PolarHBondContact O-N 2.83Å; Y172-V176 VanDerWaalsContact O-CG2 3.3Å; Y172-V176 WeakPolarHBondContact O-CG2 3.27Å; Y172-V176 PolarHBondContact O-N 3.01Å; Y172-A192 HydrophobicContact CD1-CB 4.41Å; Y172-F195 HydrophobicContact CD1-CB 4.1Å; Y172-F195 HydrophobicContact CE1-CB 3.61Å; Y172-F195 HydrophobicContact CE1-CD2 4.16Å; Y172-F195 HydrophobicContact CE1-CG 4.15Å; Y172-F195 HydrophobicContact CE2-CB 4.26Å; Y172-F199 HydrophobicContact CD2-CD2 4.08Å; Y172-F199 HydrophobicContact CD2-CE2 4.27Å; Y172-F199 AromaticContact CE2-CD2 3.67Å; Y172-F199 HydrophobicContact CE2-CD2 3.67Å; Y172-F199 AromaticContact CE2-CE2 3.41Å; Y172-F199 HydrophobicContact CE2-CE2 3.41Å; Y172-F199 VanDerWaalsContact CE2-CE2 3.41Å; Y172-F199 AromaticContact CZ-CE2 3.85Å
173	S	88.5	Confident	86.5	Confident	30 Å²	30	54.8 Å²	54.8	21%	0.21	28%	0.284	C	S	.	.	H	α-helix	trans	-59.4	-42.1	171.2	-55.4	0	0	0	0	112.2	I169 P170 V176 I177	I169-S173 PolarHBondContact O-N 3.02Å; I169-S173 PolarHBondContact O-OG 2.87Å; I169-S173 VanDerWaalsContact O-OG 3.11Å; P170-S173 PolarHBondContact O-N 3.3Å; S173-V176 PolarHBondContact O-N 2.6Å; S173-I177 PolarHBondContact O-N 2.87Å
174	G	88	Confident	86.2	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-63	-46.6	172.9	0	0	0	0	0	112.6	P170 R171 Y172 V176 I177 D178 G407 S411	P170-G174 PolarHBondContact O-N 3.12Å; R171-G174 PolarHBondContact O-N 2.99Å; Y172-G174 VanDerWaalsContact C-N 3.32Å; Y172-G174 PolarHBondContact O-N 3.04Å; G174-V176 VanDerWaalsContact C-N 3.29Å; G174-V176 PolarHBondContact O-N 3.24Å; G174-I177 WeakPolarHBondContact O-CB 3.28Å; G174-I177 PolarHBondContact O-N 3.3Å; G174-D178 PolarHBondContact O-N 3.44Å; G174-G407 VanDerWaalsContact CA-O 3.27Å; G174-G407 WeakPolarHBondContact CA-O 3.3Å; G174-G407 VanDerWaalsContact O-CA 3.22Å; G174-G407 WeakPolarHBondContact O-CA 3.11Å; G174-S411 WeakPolarHBondContact CA-OG 3.4Å
175	R	87.6	Confident	86	Confident	144 Å²	144	57 Å²	57	54%	0.543	30%	0.301	S	S	.	.	H	α-helix	trans	-58.8	-39.1	177.6	-172.1	176.4	179.7	125.6	-0.9	112.6	R171 Y172 I177 D178 I179	R171-R175 PolarHBondContact O-N 3.45Å; Y172-R175 PolarHBondContact O-N 2.83Å; R175-I177 VanDerWaalsContact C-N 3.33Å; R175-D178 PolarHBondContact O-N 2.67Å; R175-I179 HydrophobicContact CG-CD1 4.07Å; R175-I179 WeakPolarHBondContact O-CD1 3.3Å; R175-I179 VanDerWaalsContact O-CG1 3.27Å; R175-I179 WeakPolarHBondContact O-CG1 3.46Å; R175-I179 PolarHBondContact O-N 3.28Å
176	V	88.9	Confident	85.9	Confident	21 Å²	21	60.3 Å²	60.3	13%	0.127	32%	0.321	C	S	.	.	H	α-helix	trans	-61.5	-42.1	175.2	168.6	0	0	0	0	111	Y172 S173 G174 I179 L180 F189 A192 I193	Y172-V176 VanDerWaalsContact O-CG2 3.3Å; Y172-V176 WeakPolarHBondContact O-CG2 3.27Å; Y172-V176 PolarHBondContact O-N 3.01Å; S173-V176 PolarHBondContact O-N 2.6Å; G174-V176 VanDerWaalsContact C-N 3.29Å; G174-V176 PolarHBondContact O-N 3.24Å; V176-I179 PolarHBondContact O-N 3.1Å; V176-L180 HydrophobicContact CG1-CD1 4.01Å; V176-L180 WeakPolarHBondContact O-CG 3.42Å; V176-L180 PolarHBondContact O-N 2.95Å; V176-F189 HydrophobicContact CG1-CD2 4.29Å; V176-F189 HydrophobicContact CG1-CE2 3.74Å; V176-A192 HydrophobicContact CG2-CB 3.87Å; V176-I193 HydrophobicContact CG2-CG1 4.41Å
177	I	88.1	Confident	85.7	Confident	70 Å²	70	64.8 Å²	64.8	36%	0.359	35%	0.346	S	S	.	.	H	α-helix	trans	-66.4	-40	175.7	-68.5	-161.3	0	0	0	111.9	S173 G174 R175 I179 L180 G181 L410	S173-I177 PolarHBondContact O-N 2.87Å; G174-I177 WeakPolarHBondContact O-CB 3.28Å; G174-I177 PolarHBondContact O-N 3.3Å; R175-I177 VanDerWaalsContact C-N 3.33Å; I177-I179 VanDerWaalsContact C-N 3.31Å; I177-I179 PolarHBondContact O-N 2.97Å; I177-L180 PolarHBondContact O-N 3.06Å; I177-G181 PolarHBondContact O-N 3.22Å; I177-L410 HydrophobicContact CD1-CB 4.43Å; I177-L410 HydrophobicContact CD1-CD2 3.18Å; I177-L410 HydrophobicContact CD1-CG 4.31Å; I177-L410 HydrophobicContact CG1-CD2 4.07Å
178	D	87.1	Confident	85.6	Confident	54 Å²	54	65.6 Å²	65.6	29%	0.289	35%	0.353	S	S	.	.	H	α-helix	trans	-62.4	-39.7	177	-76.3	-28.2	0	0	0	111.6	G174 R175 G181 G182 T405 R406 G407	G174-D178 PolarHBondContact O-N 3.44Å; R175-D178 PolarHBondContact O-N 2.67Å; D178-G181 PolarHBondContact O-N 3.08Å; D178-G182 PolarHBondContact O-N 2.66Å; D178-T405 VanDerWaalsContact OD1-CB 3.27Å; D178-T405 WeakPolarHBondContact OD1-CB 3.33Å; D178-T405 PolarHBondContact OD1-OG1 3Å; D178-T405 WeakPolarHBondContact OD2-CB 3.47Å; D178-T405 PolarHBondContact OD2-OG1 3.22Å; D178-R406 PolarHBondContact OD1-N 3.37Å; D178-G407 VanDerWaalsContact OD1-CA 3.29Å; D178-G407 WeakPolarHBondContact OD1-CA 3.5Å; D178-G407 PolarHBondContact OD1-N 3.49Å
179	I	87	Confident	85.5	Confident	21 Å²	21	66.8 Å²	66.8	11%	0.108	36%	0.357	C	S	.	.	H	α-helix	trans	-67.2	-41.5	175.7	-64.4	161.9	0	0	0	111.6	R175 V176 I177 G181 F184 A188 F189 A192	R175-I179 HydrophobicContact CG-CD1 4.07Å; R175-I179 WeakPolarHBondContact O-CD1 3.3Å; R175-I179 VanDerWaalsContact O-CG1 3.27Å; R175-I179 WeakPolarHBondContact O-CG1 3.46Å; R175-I179 PolarHBondContact O-N 3.28Å; V176-I179 PolarHBondContact O-N 3.1Å; I177-I179 VanDerWaalsContact C-N 3.31Å; I177-I179 PolarHBondContact O-N 2.97Å; I179-G181 VanDerWaalsContact C-N 3.28Å; I179-G181 PolarHBondContact O-N 3.03Å; I179-F184 HydrophobicContact CG2-CD2 4.43Å; I179-A188 HydrophobicContact CD1-CB 4.05Å; I179-F189 HydrophobicContact CG2-CB 4.17Å; I179-F189 HydrophobicContact CG2-CD2 4.42Å; I179-A192 HydrophobicContact CD1-CB 4.33Å
180	L	85.3	Confident	85.5	Confident	106 Å²	106	67.2 Å²	67.2	56%	0.555	37%	0.368	S	S	*	.	H	α-helix	trans	-69.7	-25.3	177.2	-72.1	171.6	0	0	0	113.2	V176 I177 F184 F189	V176-L180 HydrophobicContact CG1-CD1 4.01Å; V176-L180 WeakPolarHBondContact O-CG 3.42Å; V176-L180 PolarHBondContact O-N 2.95Å; I177-L180 PolarHBondContact O-N 3.06Å; L180-F184 HydrophobicContact CD2-CD2 4.29Å; L180-F184 HydrophobicContact CD2-CE2 4.09Å; L180-F189 HydrophobicContact CD1-CE2 4.23Å; L180-F189 HydrophobicContact CD2-CD2 4.41Å; L180-F189 HydrophobicContact CD2-CE2 3.91Å; L180-F189 HydrophobicContact CG-CD2 4.49Å; L180-F189 HydrophobicContact CG-CE2 4.03Å
181	G	78.8	Confident	85.4	Confident	46 Å²	46	69 Å²	69	47%	0.474	38%	0.381	S	S	.	.	H	α-helix	trans	-91.2	-7.2	-179.1	0	0	0	0	0	115.1	I177 D178 I179	I177-G181 PolarHBondContact O-N 3.22Å; D178-G181 PolarHBondContact O-N 3.08Å; I179-G181 VanDerWaalsContact C-N 3.28Å; I179-G181 PolarHBondContact O-N 3.03Å
182	G	77.4	Confident	85.4	Confident	50 Å²	50	63.2 Å²	63.2	52%	0.515	36%	0.359	S	S	.	.	S	Bend	trans	-120.2	-152.3	179.9	0	0	0	0	0	112.7	D178 F184	D178-G182 PolarHBondContact O-N 2.66Å; G182-F184 PolarHBondContact O-N 3.43Å
183	D	75.2	Confident	85.4	Confident	163 Å²	163	64.4 Å²	64.4	87%	0.872	37%	0.368	S	S	*	.	S	Bend	trans	-69.2	116	173.4	-67	-35	0	0	0	109.7	D185	D183-D185 PolarHBondContact O-N 3.39Å; D183-D185 VanDerWaalsContact O-N 3.12Å
184	F	82.1	Confident	85.6	Confident	119 Å²	119	69.2 Å²	69.2	52%	0.522	39%	0.385	S	S	.	.			trans	-70.6	109.8	-173.3	-177.4	-101.6	0	0	0	111.3	I179 L180 G182 P186 F189	I179-F184 HydrophobicContact CG2-CD2 4.43Å; L180-F184 HydrophobicContact CD2-CD2 4.29Å; L180-F184 HydrophobicContact CD2-CE2 4.09Å; G182-F184 PolarHBondContact O-N 3.43Å; F184-P186 HydrophobicContact CD1-CG 4.19Å; F184-P186 HydrophobicContact CE1-CB 4.24Å; F184-P186 HydrophobicContact CE1-CG 3.89Å; F184-F189 HydrophobicContact CE2-CB 4.24Å; F184-F189 HydrophobicContact CE2-CD2 4.13Å; F184-F189 HydrophobicContact CE2-CG 4.08Å; F184-F189 HydrophobicContact CZ-CB 4.43Å; F184-F189 HydrophobicContact CZ-CD1 4.49Å; F184-F189 HydrophobicContact CZ-CG 4.37Å
185	D	84.1	Confident	85.7	Confident	77 Å²	77	73.1 Å²	73.1	41%	0.412	40%	0.402	S	S	.	.			trans	-102.7	109.1	171.8	-177.8	3.6	0	0	0	110.2	D183 D187 A188 F189	D183-D185 PolarHBondContact O-N 3.39Å; D183-D185 VanDerWaalsContact O-N 3.12Å; D185-D187 VanDerWaalsContact C-N 3.27Å; D185-D187 PolarHBondContact O-N 2.89Å; D185-D187 PolarHBondContact OD1-N 2.88Å; D185-A188 HydrophobicContact CB-CB 3.92Å; D185-A188 PolarHBondContact O-N 3.41Å; D185-A188 WeakPolarHBondContact OD2-CB 3.1Å; D185-F189 WeakPolarHBondContact O-CB 3.47Å; D185-F189 PolarHBondContact O-N 2.99Å
186	P	84.3	Confident	85.7	Confident	74 Å²	74	69.2 Å²	69.2	48%	0.481	39%	0.391	S	S	.	.	H	α-helix	trans	-58.7	-35.3	-178.5	-21.2	30.9	0	0	0	113.6	F184 F189 A190	F184-P186 HydrophobicContact CD1-CG 4.19Å; F184-P186 HydrophobicContact CE1-CB 4.24Å; F184-P186 HydrophobicContact CE1-CG 3.89Å; P186-F189 PolarHBondContact O-N 3.14Å; P186-A190 WeakPolarHBondContact O-CB 3.3Å; P186-A190 PolarHBondContact O-N 2.89Å
187	D	85.6	Confident	85.8	Confident	129 Å²	129	71.7 Å²	71.7	69%	0.69	41%	0.408	S	S	*	.	H	α-helix	trans	-76.8	-39.1	-175.5	-68.7	-26.7	0	0	0	111.1	D185 F189 S191	D185-D187 VanDerWaalsContact C-N 3.27Å; D185-D187 PolarHBondContact O-N 2.89Å; D185-D187 PolarHBondContact OD1-N 2.88Å; D187-F189 VanDerWaalsContact C-N 3.32Å; D187-S191 WeakPolarHBondContact O-CB 3.36Å; D187-S191 PolarHBondContact O-N 3.31Å; D187-S191 PolarHBondContact O-OG 2.96Å
188	A	84.3	Confident	86	Confident	20 Å²	20	72.7 Å²	72.7	17%	0.165	41%	0.414	C	S	.	.	H	α-helix	trans	-65.2	-36.2	172	0	0	0	0	0	112.1	I179 D185 S191 A192	I179-A188 HydrophobicContact CD1-CB 4.05Å; D185-A188 HydrophobicContact CB-CB 3.92Å; D185-A188 PolarHBondContact O-N 3.41Å; D185-A188 WeakPolarHBondContact OD2-CB 3.1Å; A188-S191 WeakPolarHBondContact CA-OG 3.4Å; A188-S191 PolarHBondContact O-OG 2.9Å; A188-A192 WeakPolarHBondContact O-CB 3.33Å; A188-A192 PolarHBondContact O-N 3.11Å; A188-A192 VanDerWaalsContact O-N 3.1Å
189	F	87.8	Confident	86.3	Confident	54 Å²	54	72.8 Å²	72.8	24%	0.237	41%	0.412	C	S	.	.	H	α-helix	trans	-68.6	-47.9	176	-176.5	-98	0	0	0	111.8	V176 I179 L180 F184 D185 P186 D187 S191 A192 I193	V176-F189 HydrophobicContact CG1-CD2 4.29Å; V176-F189 HydrophobicContact CG1-CE2 3.74Å; I179-F189 HydrophobicContact CG2-CB 4.17Å; I179-F189 HydrophobicContact CG2-CD2 4.42Å; L180-F189 HydrophobicContact CD1-CE2 4.23Å; L180-F189 HydrophobicContact CD2-CD2 4.41Å; L180-F189 HydrophobicContact CD2-CE2 3.91Å; L180-F189 HydrophobicContact CG-CD2 4.49Å; L180-F189 HydrophobicContact CG-CE2 4.03Å; F184-F189 HydrophobicContact CE2-CB 4.24Å; F184-F189 HydrophobicContact CE2-CD2 4.13Å; F184-F189 HydrophobicContact CE2-CG 4.08Å; F184-F189 HydrophobicContact CZ-CB 4.43Å; F184-F189 HydrophobicContact CZ-CD1 4.49Å; F184-F189 HydrophobicContact CZ-CG 4.37Å; D185-F189 WeakPolarHBondContact O-CB 3.47Å; D185-F189 PolarHBondContact O-N 2.99Å; P186-F189 PolarHBondContact O-N 3.14Å; D187-F189 VanDerWaalsContact C-N 3.32Å; F189-S191 PolarHBondContact O-N 2.97Å; F189-A192 PolarHBondContact O-N 3.17Å; F189-I193 HydrophobicContact CD1-CD1 3.83Å; F189-I193 HydrophobicContact CE1-CD1 3.23Å; F189-I193 HydrophobicContact CE1-CG1 4.36Å; F189-I193 HydrophobicContact CE2-CD1 4.17Å; F189-I193 HydrophobicContact CZ-CD1 3.44Å; F189-I193 VanDerWaalsContact CZ-CD1 3.44Å; F189-I193 HydrophobicContact CZ-CG1 4.47Å; F189-I193 PolarHBondContact O-N 3.19Å
190	A	88.6	Confident	86.4	Confident	57 Å²	57	74.2 Å²	74.2	47%	0.471	42%	0.423	S	S	.	.	H	α-helix	trans	-60.9	-43.3	178.3	0	0	0	0	0	112	P186 I193 F194	P186-A190 WeakPolarHBondContact O-CB 3.3Å; P186-A190 PolarHBondContact O-N 2.89Å; A190-I193 PolarHBondContact O-N 3.05Å; A190-F194 VanDerWaalsContact O-CB 3.3Å; A190-F194 WeakPolarHBondContact O-CB 3.39Å; A190-F194 PolarHBondContact O-N 3Å
191	S	88.6	Confident	86.7	Confident	45 Å²	45	73.7 Å²	73.7	32%	0.315	43%	0.425	S	S	.	.	H	α-helix	trans	-65.4	-40.9	176.4	57.6	0	0	0	0	112.5	D187 A188 F189 I193 F194 F195	D187-S191 WeakPolarHBondContact O-CB 3.36Å; D187-S191 PolarHBondContact O-N 3.31Å; D187-S191 PolarHBondContact O-OG 2.96Å; A188-S191 WeakPolarHBondContact CA-OG 3.4Å; A188-S191 PolarHBondContact O-OG 2.9Å; F189-S191 PolarHBondContact O-N 2.97Å; S191-I193 PolarHBondContact O-N 3.5Å; S191-F194 PolarHBondContact O-N 3.25Å; S191-F195 WeakPolarHBondContact O-CD2 3.17Å; S191-F195 PolarHBondContact O-N 3.49Å
192	A	87.2	Confident	87.4	Confident	1 Å²	1	73.2 Å²	73.2	1%	0.008	42%	0.42	C	S	.	.	H	α-helix	trans	-62.3	-42.8	176.4	0	0	0	0	0	112.5	Y172 V176 I179 A188 F189 M196	Y172-A192 HydrophobicContact CD1-CB 4.41Å; V176-A192 HydrophobicContact CG2-CB 3.87Å; I179-A192 HydrophobicContact CD1-CB 4.33Å; A188-A192 WeakPolarHBondContact O-CB 3.33Å; A188-A192 PolarHBondContact O-N 3.11Å; A188-A192 VanDerWaalsContact O-N 3.1Å; F189-A192 PolarHBondContact O-N 3.17Å; A192-M196 WeakPolarHBondContact O-CB 3.47Å; A192-M196 PolarHBondContact O-N 3.09Å
193	I	89.9	Confident	88.1	Confident	71 Å²	71	71.1 Å²	71.1	36%	0.364	40%	0.397	S	S	.	.	H	α-helix	trans	-67.1	-42	175.2	-69.6	-178.6	0	0	0	111.3	V176 F189 A190 S191 F195 M196 C197	V176-I193 HydrophobicContact CG2-CG1 4.41Å; F189-I193 HydrophobicContact CD1-CD1 3.83Å; F189-I193 HydrophobicContact CE1-CD1 3.23Å; F189-I193 HydrophobicContact CE1-CG1 4.36Å; F189-I193 HydrophobicContact CE2-CD1 4.17Å; F189-I193 HydrophobicContact CZ-CD1 3.44Å; F189-I193 VanDerWaalsContact CZ-CD1 3.44Å; F189-I193 HydrophobicContact CZ-CG1 4.47Å; F189-I193 PolarHBondContact O-N 3.19Å; A190-I193 PolarHBondContact O-N 3.05Å; S191-I193 PolarHBondContact O-N 3.5Å; I193-F195 PolarHBondContact O-N 3.26Å; I193-M196 WeakPolarHBondContact O-CB 3.43Å; I193-M196 PolarHBondContact O-N 3.08Å; I193-C197 WeakPolarHBondContact O-CB 3.3Å; I193-C197 PolarHBondContact O-N 3.03Å
194	F	91.4	Very high	88.9	Confident	131 Å²	131	66.8 Å²	66.8	58%	0.575	38%	0.379	S	S	*	.	H	α-helix	trans	-59.3	-48.5	177.7	177.6	-98.4	0	0	0	111.5	A190 S191 M196 C197 L198	A190-F194 VanDerWaalsContact O-CB 3.3Å; A190-F194 WeakPolarHBondContact O-CB 3.39Å; A190-F194 PolarHBondContact O-N 3Å; S191-F194 PolarHBondContact O-N 3.25Å; F194-M196 PolarHBondContact O-N 3.48Å; F194-C197 PolarHBondContact O-N 3.33Å; F194-L198 HydrophobicContact CE1-CD2 4.43Å; F194-L198 WeakPolarHBondContact O-CB 3.44Å; F194-L198 PolarHBondContact O-N 3.14Å
195	F	89.5	Confident	89.4	Confident	82 Å²	82	68 Å²	68	36%	0.36	39%	0.385	S	S	.	.	H	α-helix	trans	-64	-39.4	175.8	-75.4	-61.1	0	0	0	112.1	Y172 S191 I193 C197 L198 F199	Y172-F195 HydrophobicContact CD1-CB 4.1Å; Y172-F195 HydrophobicContact CE1-CB 3.61Å; Y172-F195 HydrophobicContact CE1-CD2 4.16Å; Y172-F195 HydrophobicContact CE1-CG 4.15Å; Y172-F195 HydrophobicContact CE2-CB 4.26Å; S191-F195 WeakPolarHBondContact O-CD2 3.17Å; S191-F195 PolarHBondContact O-N 3.49Å; I193-F195 PolarHBondContact O-N 3.26Å; F195-C197 VanDerWaalsContact C-N 3.34Å; F195-C197 PolarHBondContact O-N 2.78Å; F195-L198 HydrophobicContact CD1-CD2 4.41Å; F195-L198 PolarHBondContact O-N 3.17Å; F195-F199 HydrophobicContact CB-CD2 4.28Å; F195-F199 HydrophobicContact CB-CE2 4.04Å; F195-F199 HydrophobicContact CD1-CE2 4.25Å; F195-F199 WeakPolarHBondContact O-CB 3.4Å; F195-F199 WeakPolarHBondContact O-CD2 3.19Å; F195-F199 WeakPolarHBondContact O-CG 3.41Å; F195-F199 PolarHBondContact O-N 3.05Å
196	M	89.2	Confident	89.9	Confident	62 Å²	62	64.6 Å²	64.6	31%	0.305	37%	0.367	S	S	.	.	H	α-helix	trans	-60	-43.9	174.9	-168.4	-177	78.9	0	0	111.7	I169 A192 I193 F194 S200	I169-M196 HydrophobicContact CG2-CG 4.38Å; A192-M196 WeakPolarHBondContact O-CB 3.47Å; A192-M196 PolarHBondContact O-N 3.09Å; I193-M196 WeakPolarHBondContact O-CB 3.43Å; I193-M196 PolarHBondContact O-N 3.08Å; F194-M196 PolarHBondContact O-N 3.48Å; M196-S200 VanDerWaalsContact O-CB 3.24Å; M196-S200 WeakPolarHBondContact O-CB 3.4Å; M196-S200 PolarHBondContact O-N 3.27Å
197	C	91.3	Very high	90.1	Very high	73 Å²	73	62.6 Å²	62.6	49%	0.493	36%	0.357	S	S	.	.	H	α-helix	trans	-65.2	-46.5	176.2	-172.9	0	0	0	0	111.5	I193 F194 F195 F199 S200 V201	I193-C197 WeakPolarHBondContact O-CB 3.3Å; I193-C197 PolarHBondContact O-N 3.03Å; F194-C197 PolarHBondContact O-N 3.33Å; F195-C197 VanDerWaalsContact C-N 3.34Å; F195-C197 PolarHBondContact O-N 2.78Å; C197-F199 PolarHBondContact O-N 3.39Å; C197-S200 PolarHBondContact O-N 2.88Å; C197-V201 WeakPolarHBondContact O-CG2 3.19Å; C197-V201 PolarHBondContact O-N 3.47Å
198	L	91.9	Very high	90.4	Very high	92 Å²	92	58.8 Å²	58.8	48%	0.482	35%	0.348	S	S	.	.	H	α-helix	trans	-58.4	-47.6	178.5	-178.4	65.3	0	0	0	111.8	F194 F195 G202	F194-L198 HydrophobicContact CE1-CD2 4.43Å; F194-L198 WeakPolarHBondContact O-CB 3.44Å; F194-L198 PolarHBondContact O-N 3.14Å; F195-L198 HydrophobicContact CD1-CD2 4.41Å; F195-L198 PolarHBondContact O-N 3.17Å; L198-G202 PolarHBondContact O-N 3.1Å
199	F	92	Very high	90.8	Very high	55 Å²	55	59.4 Å²	59.4	24%	0.241	35%	0.351	C	S	.	.	H	α-helix	trans	-68.2	-36.7	178.1	-69.8	-53.6	0	0	0	112.4	L168 Y172 F195 C197 S203	L168-F199 HydrophobicContact CB-CD2 4.08Å; L168-F199 HydrophobicContact CB-CE2 4.46Å; L168-F199 HydrophobicContact CB-CG 4.27Å; L168-F199 HydrophobicContact CD1-CD1 3.86Å; L168-F199 HydrophobicContact CD1-CD2 4.14Å; L168-F199 HydrophobicContact CD1-CE1 3.6Å; L168-F199 HydrophobicContact CD1-CE2 3.91Å; L168-F199 HydrophobicContact CD1-CG 4.14Å; L168-F199 HydrophobicContact CD1-CZ 3.64Å; Y172-F199 HydrophobicContact CD2-CD2 4.08Å; Y172-F199 HydrophobicContact CD2-CE2 4.27Å; Y172-F199 AromaticContact CE2-CD2 3.67Å; Y172-F199 HydrophobicContact CE2-CD2 3.67Å; Y172-F199 AromaticContact CE2-CE2 3.41Å; Y172-F199 HydrophobicContact CE2-CE2 3.41Å; Y172-F199 VanDerWaalsContact CE2-CE2 3.41Å; Y172-F199 AromaticContact CZ-CE2 3.85Å; F195-F199 HydrophobicContact CB-CD2 4.28Å; F195-F199 HydrophobicContact CB-CE2 4.04Å; F195-F199 HydrophobicContact CD1-CE2 4.25Å; F195-F199 WeakPolarHBondContact O-CB 3.4Å; F195-F199 WeakPolarHBondContact O-CD2 3.19Å; F195-F199 WeakPolarHBondContact O-CG 3.41Å; F195-F199 PolarHBondContact O-N 3.05Å; C197-F199 PolarHBondContact O-N 3.39Å; F199-S203 WeakPolarHBondContact O-CB 3.45Å; F199-S203 PolarHBondContact O-N 2.78Å; F199-S203 PolarHBondContact O-OG 3.2Å
200	S	90	Very high	90.9	Very high	51 Å²	51	57.7 Å²	57.7	36%	0.357	34%	0.342	S	S	.	.	H	α-helix	trans	-65.9	-45.9	176.9	-178	0	0	0	0	112.6	M196 C197 S203 S204	M196-S200 VanDerWaalsContact O-CB 3.24Å; M196-S200 WeakPolarHBondContact O-CB 3.4Å; M196-S200 PolarHBondContact O-N 3.27Å; C197-S200 PolarHBondContact O-N 2.88Å; S200-S203 PolarHBondContact O-OG 2.87Å; S200-S203 VanDerWaalsContact O-OG 3.13Å; S200-S204 VanDerWaalsContact O-CB 3.29Å; S200-S204 WeakPolarHBondContact O-CB 3.23Å; S200-S204 PolarHBondContact O-N 3.35Å; S200-S204 PolarHBondContact O-OG 2.82Å
201	V	92.4	Very high	90.9	Very high	96 Å²	96	56.7 Å²	56.7	58%	0.582	34%	0.338	S	S	*	.	H	α-helix	trans	-68.5	-45.6	177.4	174.9	0	0	0	0	110.3	C197 S204 F205	C197-V201 WeakPolarHBondContact O-CG2 3.19Å; C197-V201 PolarHBondContact O-N 3.47Å; V201-S204 PolarHBondContact O-N 2.73Å; V201-F205 WeakPolarHBondContact O-CB 3.48Å; V201-F205 PolarHBondContact O-N 3.25Å
202	G	92.3	Very high	90.9	Very high	36 Å²	36	56.4 Å²	56.4	37%	0.371	34%	0.342	S	S	.	.	H	α-helix	trans	-62	-43.7	178.6	0	0	0	0	0	112.8	L198 S206	L198-G202 PolarHBondContact O-N 3.1Å; G202-S206 VanDerWaalsContact O-CB 3.3Å; G202-S206 WeakPolarHBondContact O-CB 3.49Å; G202-S206 PolarHBondContact O-N 2.92Å
203	S	92	Very high	91	Very high	5 Å²	5	57.4 Å²	57.4	4%	0.035	35%	0.349	C	S	.	.	H	α-helix	trans	-67.4	-39.2	177.6	71	0	0	0	0	111.9	F199 S200 S206 A207	F199-S203 WeakPolarHBondContact O-CB 3.45Å; F199-S203 PolarHBondContact O-N 2.78Å; F199-S203 PolarHBondContact O-OG 3.2Å; S200-S203 PolarHBondContact O-OG 2.87Å; S200-S203 VanDerWaalsContact O-OG 3.13Å; S203-S206 PolarHBondContact O-N 2.91Å; S203-A207 VanDerWaalsContact O-CB 3.25Å; S203-A207 WeakPolarHBondContact O-CB 3.2Å; S203-A207 PolarHBondContact O-N 3.04Å
204	S	92.3	Very high	91	Very high	72 Å²	72	54.7 Å²	54.7	50%	0.503	34%	0.335	S	S	.	.	H	α-helix	trans	-64.3	-45.3	177.4	-61.5	0	0	0	0	111.8	S200 V201 A207 G208	S200-S204 VanDerWaalsContact O-CB 3.29Å; S200-S204 WeakPolarHBondContact O-CB 3.23Å; S200-S204 PolarHBondContact O-N 3.35Å; S200-S204 PolarHBondContact O-OG 2.82Å; V201-S204 PolarHBondContact O-N 2.73Å; S204-A207 PolarHBondContact O-N 3.16Å; S204-G208 PolarHBondContact O-N 2.78Å
205	F	93.9	Very high	90.8	Very high	146 Å²	146	54 Å²	54	64%	0.64	34%	0.336	S	S	*	.	H	α-helix	trans	-61.2	-48	175.1	-178.7	-102.1	0	0	0	111.3	V201 A207 G208 C209	V201-F205 WeakPolarHBondContact O-CB 3.48Å; V201-F205 PolarHBondContact O-N 3.25Å; F205-A207 VanDerWaalsContact C-N 3.33Å; F205-A207 PolarHBondContact O-N 3.21Å; F205-G208 WeakPolarHBondContact O-CA 3.41Å; F205-G208 PolarHBondContact O-N 3.44Å; F205-G208 VanDerWaalsContact O-N 3.12Å; F205-C209 PolarHBondContact O-N 2.86Å; F205-C209 PolarHBondContact O-SG 3.45Å
206	S	92.9	Very high	90.8	Very high	4 Å²	4	54.3 Å²	54.3	3%	0.028	34%	0.338	C	S	.	.	H	α-helix	trans	-62.2	-39	178.3	-165	0	0	0	0	112.3	F158 A162 G202 S203 G208 C209 R210	F158-S206 WeakPolarHBondContact CA-OG 3.27Å; F158-S206 PolarHBondContact O-OG 3.12Å; A162-S206 PolarHBondContact N-OG 3.02Å; G202-S206 VanDerWaalsContact O-CB 3.3Å; G202-S206 WeakPolarHBondContact O-CB 3.49Å; G202-S206 PolarHBondContact O-N 2.92Å; S203-S206 PolarHBondContact O-N 2.91Å; S206-G208 VanDerWaalsContact C-N 3.33Å; S206-G208 PolarHBondContact O-N 3Å; S206-C209 PolarHBondContact O-N 3.12Å; S206-R210 VanDerWaalsContact O-CB 3.31Å; S206-R210 WeakPolarHBondContact O-CB 3.22Å; S206-R210 PolarHBondContact O-N 3.33Å
207	A	89.8	Confident	90.8	Very high	33 Å²	33	51.3 Å²	51.3	27%	0.273	32%	0.323	S	S	.	.	H	α-helix	trans	-63.3	-38.9	174.6	0	0	0	0	0	111.9	A162 S203 S204 F205 G211	A162-A207 HydrophobicContact CB-CB 4.3Å; S203-A207 VanDerWaalsContact O-CB 3.25Å; S203-A207 WeakPolarHBondContact O-CB 3.2Å; S203-A207 PolarHBondContact O-N 3.04Å; S204-A207 PolarHBondContact O-N 3.16Å; F205-A207 VanDerWaalsContact C-N 3.33Å; F205-A207 PolarHBondContact O-N 3.21Å; A207-G211 PolarHBondContact O-N 3.23Å
208	G	91	Very high	90.6	Very high	48 Å²	48	49.6 Å²	49.6	50%	0.495	31%	0.308	S	S	.	.	H	α-helix	trans	-61.6	-51.2	172.1	0	0	0	0	0	112.6	S204 F205 S206 R210 G211 G212	S204-G208 PolarHBondContact O-N 2.78Å; F205-G208 WeakPolarHBondContact O-CA 3.41Å; F205-G208 PolarHBondContact O-N 3.44Å; F205-G208 VanDerWaalsContact O-N 3.12Å; S206-G208 VanDerWaalsContact C-N 3.33Å; S206-G208 PolarHBondContact O-N 3Å; G208-R210 VanDerWaalsContact C-N 3.34Å; G208-R210 PolarHBondContact O-N 3.29Å; G208-G211 PolarHBondContact O-N 2.87Å; G208-G211 VanDerWaalsContact O-N 3.12Å; G208-G212 PolarHBondContact O-N 2.93Å
209	C	92.4	Very high	90.4	Very high	34 Å²	34	48.3 Å²	48.3	23%	0.23	31%	0.307	C	S	.	.	H	α-helix	trans	-60.3	-41.6	178.1	-67.9	0	0	0	0	112.6	F158 F205 S206 S213	F158-C209 HydrophobicContact CB-CB 4.43Å; F158-C209 HydrophobicContact CD1-CB 3.84Å; F158-C209 HydrophobicContact CD2-CB 3.74Å; F158-C209 HydrophobicContact CE1-CB 3.95Å; F158-C209 HydrophobicContact CE2-CB 3.86Å; F158-C209 HydrophobicContact CG-CB 3.75Å; F158-C209 HydrophobicContact CZ-CB 3.96Å; F205-C209 PolarHBondContact O-N 2.86Å; F205-C209 PolarHBondContact O-SG 3.45Å; S206-C209 PolarHBondContact O-N 3.12Å; C209-S213 WeakPolarHBondContact O-CB 3.42Å; C209-S213 PolarHBondContact O-N 3.07Å; C209-S213 PolarHBondContact O-OG 2.74Å
210	R	90.2	Very high	90.3	Very high	17 Å²	17	51.3 Å²	51.3	6%	0.064	32%	0.317	C	S	.	.	H	α-helix	trans	-55.9	-53.7	170.2	161.4	-160.2	160.3	129.8	7.4	111	F158 L159 S206 G208 G212 S213 F214 N269 R273	F158-R210 HydrophobicContact CB-CB 3.96Å; L159-R210 HydrophobicContact CB-CG 4.39Å; S206-R210 VanDerWaalsContact O-CB 3.31Å; S206-R210 WeakPolarHBondContact O-CB 3.22Å; S206-R210 PolarHBondContact O-N 3.33Å; G208-R210 VanDerWaalsContact C-N 3.34Å; G208-R210 PolarHBondContact O-N 3.29Å; R210-G212 PolarHBondContact O-N 3.47Å; R210-S213 PolarHBondContact O-N 3.04Å; R210-F214 HydrophobicContact CG-CD2 4.07Å; R210-F214 HydrophobicContact CG-CE2 4.26Å; R210-F214 WeakPolarHBondContact O-CD2 3.35Å; R210-F214 PolarHBondContact O-N 2.95Å; R210-F214 VanDerWaalsContact O-N 3.07Å; R210-N269 PolarHBondContact NE-OD1 2.88Å; R210-N269 PolarHBondContact NH2-ND2 3.07Å; R210-N269 PolarHBondContact NH2-O 3.42Å; R210-N269 VanDerWaalsContact NH2-O 3.15Å; R210-N269 PolarHBondContact NH2-OD1 3.3Å; R210-R273 VanDerWaalsContact NH1-CB 3.35Å; R210-R273 VanDerWaalsContact NH1-CG 3.28Å
211	G	88.3	Confident	90.2	Very high	36 Å²	36	49.3 Å²	49.3	37%	0.371	30%	0.302	S	S	.	.	H	α-helix	trans	-59.1	-46.4	-177.1	0	0	0	0	0	112.1	A207 G208 F214 L215	A207-G211 PolarHBondContact O-N 3.23Å; G208-G211 PolarHBondContact O-N 2.87Å; G208-G211 VanDerWaalsContact O-N 3.12Å; G211-F214 PolarHBondContact O-N 3.19Å; G211-L215 WeakPolarHBondContact O-CB 3.38Å; G211-L215 PolarHBondContact O-N 3.15Å
212	G	89.8	Confident	90	Very high	40 Å²	40	45.8 Å²	45.8	41%	0.412	28%	0.28	S	S	.	.	H	α-helix	trans	-61	-43.9	175.9	0	0	0	0	0	113	G208 R210 F214 L215 F216	G208-G212 PolarHBondContact O-N 2.93Å; R210-G212 PolarHBondContact O-N 3.47Å; G212-F214 PolarHBondContact O-N 3.49Å; G212-L215 PolarHBondContact O-N 3.13Å; G212-F216 WeakPolarHBondContact O-CB 3.39Å; G212-F216 PolarHBondContact O-N 2.87Å
213	S	89.3	Confident	89.9	Confident	21 Å²	21	49.4 Å²	49.4	15%	0.147	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-42.9	179.9	-59.1	0	0	0	0	112.5	C209 R210 T217	C209-S213 WeakPolarHBondContact O-CB 3.42Å; C209-S213 PolarHBondContact O-N 3.07Å; C209-S213 PolarHBondContact O-OG 2.74Å; R210-S213 PolarHBondContact O-N 3.04Å; S213-T217 WeakPolarHBondContact O-CB 3.02Å; S213-T217 PolarHBondContact O-N 3.31Å; S213-T217 VanDerWaalsContact O-N 3.07Å; S213-T217 PolarHBondContact O-OG1 2.89Å
214	F	88.1	Confident	89.8	Confident	14 Å²	14	51.9 Å²	51.9	6%	0.061	30%	0.299	C	S	.	.	H	α-helix	trans	-66.3	-41.8	174.7	-87.4	-70.6	0	0	0	112.2	L152 A155 R210 G211 G212 T217 M218 P265 N269	L152-F214 HydrophobicContact CD2-CD1 4.12Å; L152-F214 HydrophobicContact CD2-CE1 3.78Å; A155-F214 HydrophobicContact CB-CD2 3.67Å; A155-F214 HydrophobicContact CB-CE2 3.5Å; A155-F214 HydrophobicContact CB-CG 4.31Å; A155-F214 HydrophobicContact CB-CZ 4.02Å; R210-F214 HydrophobicContact CG-CD2 4.07Å; R210-F214 HydrophobicContact CG-CE2 4.26Å; R210-F214 WeakPolarHBondContact O-CD2 3.35Å; R210-F214 PolarHBondContact O-N 2.95Å; R210-F214 VanDerWaalsContact O-N 3.07Å; G211-F214 PolarHBondContact O-N 3.19Å; G212-F214 PolarHBondContact O-N 3.49Å; F214-T217 PolarHBondContact O-N 3.32Å; F214-M218 VanDerWaalsContact O-CB 3.22Å; F214-M218 WeakPolarHBondContact O-CB 3.46Å; F214-M218 PolarHBondContact O-N 3.01Å; F214-P265 HydrophobicContact CD1-CB 4.05Å; F214-N269 HydrophobicContact CD1-CB 3.95Å; F214-N269 HydrophobicContact CD2-CB 3.99Å; F214-N269 WeakPolarHBondContact CD2-OD1 3.45Å; F214-N269 HydrophobicContact CE1-CB 3.79Å; F214-N269 HydrophobicContact CE2-CB 3.83Å; F214-N269 WeakPolarHBondContact CE2-OD1 3.41Å; F214-N269 HydrophobicContact CG-CB 4.06Å; F214-N269 HydrophobicContact CZ-CB 3.73Å
215	L	88.5	Confident	89.6	Confident	117 Å²	117	48.6 Å²	48.6	61%	0.613	28%	0.275	S	S	*	.	H	α-helix	trans	-64	-41.7	178.4	-176	63.7	0	0	0	111.9	G211 G212 M218 S219	G211-L215 WeakPolarHBondContact O-CB 3.38Å; G211-L215 PolarHBondContact O-N 3.15Å; G212-L215 PolarHBondContact O-N 3.13Å; L215-M218 HydrophobicContact CD1-SD 4.29Å; L215-M218 PolarHBondContact O-N 2.78Å; L215-S219 PolarHBondContact O-N 3.49Å
216	F	89.1	Confident	89.5	Confident	88 Å²	88	45.4 Å²	45.4	39%	0.386	26%	0.259	S	S	.	.	H	α-helix	trans	-63.5	-47.1	176.7	-173.9	-104.2	0	0	0	111.7	F151 G212 M218 S219 R220	F151-F216 HydrophobicContact CD1-CD1 4.22Å; F151-F216 HydrophobicContact CD2-CD1 4.39Å; F151-F216 HydrophobicContact CD2-CE1 4.37Å; F151-F216 HydrophobicContact CE1-CD1 4.16Å; F151-F216 HydrophobicContact CE1-CE1 4.05Å; F151-F216 HydrophobicContact CE2-CD1 4.34Å; F151-F216 AromaticContact CE2-CE1 3.9Å; F151-F216 HydrophobicContact CE2-CE1 3.9Å; F151-F216 HydrophobicContact CG-CD1 4.33Å; F151-F216 HydrophobicContact CZ-CD1 4.23Å; F151-F216 AromaticContact CZ-CE1 3.72Å; F151-F216 HydrophobicContact CZ-CE1 3.72Å; G212-F216 WeakPolarHBondContact O-CB 3.39Å; G212-F216 PolarHBondContact O-N 2.87Å; F216-M218 VanDerWaalsContact C-N 3.32Å; F216-M218 PolarHBondContact O-N 3.16Å; F216-S219 PolarHBondContact O-N 3.34Å; F216-R220 HydrophobicContact CE1-CG 4.33Å; F216-R220 HydrophobicContact CZ-CG 4.42Å; F216-R220 PolarHBondContact O-N 2.86Å; F216-R220 VanDerWaalsContact O-N 3.08Å
217	T	88.6	Confident	89.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-58.4	-45.5	176.6	-55.1	0	0	0	0	111.1	D148 F151 L152 S213 F214 S219 R220 I221	D148-T217 HydrophobicContact CB-CG2 3.67Å; F151-T217 WeakPolarHBondContact CB-OG1 3.26Å; L152-T217 HydrophobicContact CD1-CG2 4.43Å; L152-T217 HydrophobicContact CD2-CG2 3.87Å; L152-T217 HydrophobicContact CG-CG2 3.99Å; S213-T217 WeakPolarHBondContact O-CB 3.02Å; S213-T217 PolarHBondContact O-N 3.31Å; S213-T217 VanDerWaalsContact O-N 3.07Å; S213-T217 PolarHBondContact O-OG1 2.89Å; F214-T217 PolarHBondContact O-N 3.32Å; T217-S219 PolarHBondContact O-N 3.22Å; T217-R220 PolarHBondContact O-N 2.98Å; T217-I221 HydrophobicContact CG2-CD1 3.8Å; T217-I221 VanDerWaalsContact O-CG1 3.31Å; T217-I221 WeakPolarHBondContact O-CG1 3.38Å; T217-I221 PolarHBondContact O-N 2.9Å
218	M	87.3	Confident	89.5	Confident	36 Å²	36	54.4 Å²	54.4	18%	0.177	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-43.3	178.1	176.5	-171.7	172.1	0	0	112.7	F214 L215 F216 I221 N222 R262 P265	F214-M218 VanDerWaalsContact O-CB 3.22Å; F214-M218 WeakPolarHBondContact O-CB 3.46Å; F214-M218 PolarHBondContact O-N 3.01Å; L215-M218 HydrophobicContact CD1-SD 4.29Å; L215-M218 PolarHBondContact O-N 2.78Å; F216-M218 VanDerWaalsContact C-N 3.32Å; F216-M218 PolarHBondContact O-N 3.16Å; M218-I221 PolarHBondContact O-N 3.46Å; M218-N222 WeakPolarHBondContact O-CB 3.46Å; M218-N222 PolarHBondContact O-N 3.46Å; M218-R262 HydrophobicContact CE-CB 3.52Å; M218-R262 HydrophobicContact CE-CG 3.14Å; M218-R262 VanDerWaalsContact CE-NE 3.27Å; M218-P265 HydrophobicContact CB-CB 4.43Å; M218-P265 HydrophobicContact CB-CG 4.23Å
219	S	88.6	Confident	89.5	Confident	66 Å²	66	52.1 Å²	52.1	46%	0.462	27%	0.271	S	S	.	.	H	α-helix	trans	-63.2	-43.7	176.8	-172.8	0	0	0	0	112	L215 F216 T217 N222 L223	L215-S219 PolarHBondContact O-N 3.49Å; F216-S219 PolarHBondContact O-N 3.34Å; T217-S219 PolarHBondContact O-N 3.22Å; S219-N222 WeakPolarHBondContact O-CB 3.46Å; S219-N222 PolarHBondContact O-N 2.85Å; S219-L223 PolarHBondContact O-N 3.05Å
220	R	89.1	Confident	89.6	Confident	117 Å²	117	55.6 Å²	55.6	44%	0.442	28%	0.283	S	S	.	.	H	α-helix	trans	-64.2	-42.7	177.4	-76.2	-160.9	156.3	179.5	-2.3	113.2	F216 T217 N222 L223 R224	F216-R220 HydrophobicContact CE1-CG 4.33Å; F216-R220 HydrophobicContact CZ-CG 4.42Å; F216-R220 PolarHBondContact O-N 2.86Å; F216-R220 VanDerWaalsContact O-N 3.08Å; T217-R220 PolarHBondContact O-N 2.98Å; R220-N222 VanDerWaalsContact C-N 3.3Å; R220-N222 PolarHBondContact O-N 3.45Å; R220-L223 PolarHBondContact O-N 3.26Å; R220-R224 WeakPolarHBondContact O-CB 3.36Å; R220-R224 PolarHBondContact O-N 3.31Å; R220-R224 VanDerWaalsContact O-N 3.08Å
221	I	88.1	Confident	89.6	Confident	10 Å²	10	57.2 Å²	57.2	5%	0.051	30%	0.296	C	S	.	.	H	α-helix	trans	-61.9	-41.6	175.1	-68.6	168.5	0	0	0	110.1	T217 M218 R224 I225 P265	T217-I221 HydrophobicContact CG2-CD1 3.8Å; T217-I221 VanDerWaalsContact O-CG1 3.31Å; T217-I221 WeakPolarHBondContact O-CG1 3.38Å; T217-I221 PolarHBondContact O-N 2.9Å; M218-I221 PolarHBondContact O-N 3.46Å; I221-R224 PolarHBondContact O-N 3.3Å; I221-I225 HydrophobicContact CG2-CD1 3.59Å; I221-I225 HydrophobicContact CG2-CG1 4.29Å; I221-I225 VanDerWaalsContact O-CG1 3.32Å; I221-I225 WeakPolarHBondContact O-CG1 3.28Å; I221-I225 PolarHBondContact O-N 2.82Å; I221-P265 HydrophobicContact CD1-CG 4.07Å
222	N	88.7	Confident	89.8	Confident	21 Å²	21	56.5 Å²	56.5	11%	0.112	29%	0.286	C	S	.	.	H	α-helix	trans	-60.2	-49	178.2	-173.3	-101.5	0	0	0	112.5	M218 S219 R220 R224 I225 R226 T257 S258 S261	M218-N222 WeakPolarHBondContact O-CB 3.46Å; M218-N222 PolarHBondContact O-N 3.46Å; S219-N222 WeakPolarHBondContact O-CB 3.46Å; S219-N222 PolarHBondContact O-N 2.85Å; R220-N222 VanDerWaalsContact C-N 3.3Å; R220-N222 PolarHBondContact O-N 3.45Å; N222-R224 PolarHBondContact O-N 3.27Å; N222-I225 PolarHBondContact O-N 3.38Å; N222-R226 WeakPolarHBondContact O-CB 3.36Å; N222-R226 WeakPolarHBondContact O-CG 3.27Å; N222-R226 PolarHBondContact O-N 3.07Å; N222-R226 WeakPolarHBondContact OD1-CD 3.4Å; N222-R226 PolarHBondContact OD1-NE 3.49Å; N222-T257 PolarHBondContact ND2-O 3.35Å; N222-S258 WeakPolarHBondContact ND2-CA 3.41Å; N222-S261 WeakPolarHBondContact CB-OG 3.44Å; N222-S261 PolarHBondContact ND2-OG 2.99Å
223	L	89.7	Confident	89.8	Confident	112 Å²	112	55.1 Å²	55.1	59%	0.586	27%	0.269	S	S	*	.	H	α-helix	trans	-59.3	-47.9	178.1	-71.6	171.8	0	0	0	111.5	S219 R220 I225 R226 E227	S219-L223 PolarHBondContact O-N 3.05Å; R220-L223 PolarHBondContact O-N 3.26Å; L223-I225 PolarHBondContact O-N 2.97Å; L223-R226 PolarHBondContact O-N 3.38Å; L223-E227 WeakPolarHBondContact O-CB 3.19Å; L223-E227 PolarHBondContact O-N 2.99Å
224	R	89.8	Confident	89.8	Confident	58 Å²	58	59.6 Å²	59.6	22%	0.219	29%	0.291	C	S	.	.	H	α-helix	trans	-60.8	-45.3	-179.7	-171.2	-176.3	-62.5	136.4	9.4	112.3	L144 D148 R220 I221 N222 Q228	L144-R224 PolarHBondContact O-NH1 3.18Å; D148-R224 IonicContact OD1-NH2 3.56Å; D148-R224 IonicContact OD2-CZ 3.56Å; D148-R224 IonicContact OD2-NH1 3.37Å; D148-R224 PolarHBondContact OD2-NH1 3.19Å; D148-R224 IonicContact OD2-NH2 3.76Å; D148-R224 PolarHBondContact OD2-NH2 3.42Å; D148-R224 VanDerWaalsContact OD2-NH2 3.1Å; R220-R224 WeakPolarHBondContact O-CB 3.36Å; R220-R224 PolarHBondContact O-N 3.31Å; R220-R224 VanDerWaalsContact O-N 3.08Å; I221-R224 PolarHBondContact O-N 3.3Å; N222-R224 PolarHBondContact O-N 3.27Å; R224-Q228 WeakPolarHBondContact O-CB 3.37Å; R224-Q228 VanDerWaalsContact O-CG 3.27Å; R224-Q228 WeakPolarHBondContact O-CG 3.49Å; R224-Q228 PolarHBondContact O-N 3Å
225	I	89.4	Confident	89.9	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-65.9	-42.3	178.8	-68.2	172.2	0	0	0	110.5	L144 I221 N222 L223 Q228 L229 T257 M260 V443	L144-I225 HydrophobicContact CD2-CG1 4.23Å; I221-I225 HydrophobicContact CG2-CD1 3.59Å; I221-I225 HydrophobicContact CG2-CG1 4.29Å; I221-I225 VanDerWaalsContact O-CG1 3.32Å; I221-I225 WeakPolarHBondContact O-CG1 3.28Å; I221-I225 PolarHBondContact O-N 2.82Å; N222-I225 PolarHBondContact O-N 3.38Å; L223-I225 PolarHBondContact O-N 2.97Å; I225-Q228 PolarHBondContact O-N 3.48Å; I225-L229 WeakPolarHBondContact O-CB 3.23Å; I225-L229 PolarHBondContact O-N 3.44Å; I225-T257 HydrophobicContact CG2-CG2 3.84Å; I225-M260 HydrophobicContact CD1-CE 4.23Å; I225-M260 HydrophobicContact CD1-CG 4.36Å; I225-M260 HydrophobicContact CD1-SD 4.18Å; I225-M260 HydrophobicContact CG2-SD 4.4Å; I225-V443 HydrophobicContact CG2-CG1 3.98Å
226	R	91.3	Very high	90	Very high	80 Å²	80	62.5 Å²	62.5	30%	0.302	29%	0.294	S	S	.	.	H	α-helix	trans	-63.7	-43.6	178.4	-77	-179.3	172.2	-175.5	-2.2	112.2	N222 L223 L229 F230 L253 S254 T257	N222-R226 WeakPolarHBondContact O-CB 3.36Å; N222-R226 WeakPolarHBondContact O-CG 3.27Å; N222-R226 PolarHBondContact O-N 3.07Å; N222-R226 WeakPolarHBondContact OD1-CD 3.4Å; N222-R226 PolarHBondContact OD1-NE 3.49Å; L223-R226 PolarHBondContact O-N 3.38Å; R226-L229 PolarHBondContact O-N 3Å; R226-F230 VanDerWaalsContact O-CB 3.23Å; R226-F230 WeakPolarHBondContact O-CB 3.42Å; R226-F230 PolarHBondContact O-N 3.2Å; R226-L253 PolarHBondContact NE-O 3.17Å; R226-S254 PolarHBondContact NH2-O 3.45Å; R226-T257 HydrophobicContact CG-CG2 4.1Å; R226-T257 WeakPolarHBondContact CG-OG1 3.43Å; R226-T257 PolarHBondContact NE-OG1 3.43Å; R226-T257 VanDerWaalsContact NE-OG1 3.09Å
227	E	91.7	Very high	90	Very high	140 Å²	140	59.1 Å²	59.1	65%	0.654	28%	0.28	S	S	*	.	H	α-helix	trans	-61.9	-49.8	176.5	-175	-173	175.5	0	0	111.4	L223 L229 F230 S231	L223-E227 WeakPolarHBondContact O-CB 3.19Å; L223-E227 PolarHBondContact O-N 2.99Å; E227-L229 PolarHBondContact O-N 3.45Å; E227-F230 PolarHBondContact O-N 3.14Å; E227-S231 VanDerWaalsContact O-CB 3.3Å; E227-S231 WeakPolarHBondContact O-CB 3.45Å; E227-S231 PolarHBondContact O-N 3.1Å
228	Q	90.9	Very high	89.9	Confident	85 Å²	85	62.4 Å²	62.4	40%	0.397	30%	0.297	S	S	.	.	H	α-helix	trans	-62.5	-42.2	178.6	-72.9	178	-2.9	0	0	112.1	R224 I225 S232 L447	R224-Q228 WeakPolarHBondContact O-CB 3.37Å; R224-Q228 VanDerWaalsContact O-CG 3.27Å; R224-Q228 WeakPolarHBondContact O-CG 3.49Å; R224-Q228 PolarHBondContact O-N 3Å; I225-Q228 PolarHBondContact O-N 3.48Å; Q228-S232 WeakPolarHBondContact O-CB 3.46Å; Q228-S232 PolarHBondContact O-N 3.08Å; Q228-L447 HydrophobicContact CB-CD2 3.97Å
229	L	91.5	Very high	89.7	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-66.6	-46.6	178.6	-179.5	61.7	0	0	0	110.7	I225 R226 E227 S231 S232 L233 L253 T257 V443 L447	I225-L229 WeakPolarHBondContact O-CB 3.23Å; I225-L229 PolarHBondContact O-N 3.44Å; R226-L229 PolarHBondContact O-N 3Å; E227-L229 PolarHBondContact O-N 3.45Å; L229-S231 VanDerWaalsContact C-N 3.34Å; L229-S231 PolarHBondContact O-N 3.49Å; L229-S232 PolarHBondContact O-N 2.99Å; L229-L233 HydrophobicContact CD1-CD1 4.32Å; L229-L233 HydrophobicContact CD1-CG 4.17Å; L229-L233 HydrophobicContact CG-CD1 4.05Å; L229-L233 HydrophobicContact CG-CG 4.35Å; L229-L233 WeakPolarHBondContact O-CB 3.28Å; L229-L233 VanDerWaalsContact O-CG 3.23Å; L229-L233 WeakPolarHBondContact O-CG 3.46Å; L229-L233 PolarHBondContact O-N 3.43Å; L229-L253 HydrophobicContact CB-CD1 4.16Å; L229-L253 HydrophobicContact CD2-CD1 3.95Å; L229-L253 HydrophobicContact CG-CD1 4.04Å; L229-T257 HydrophobicContact CD2-CG2 3.51Å; L229-V443 HydrophobicContact CD2-CG1 4.37Å; L229-L447 HydrophobicContact CB-CD2 4.16Å; L229-L447 HydrophobicContact CD1-CD2 4.33Å; L229-L447 HydrophobicContact CD1-CG 4.16Å
230	F	92.8	Very high	89.6	Confident	108 Å²	108	58 Å²	58	47%	0.474	27%	0.27	S	S	.	.	H	α-helix	trans	-60.6	-45	177.3	-173.2	-111	0	0	0	111.6	R226 E227 S232 L233 L234 L253	R226-F230 VanDerWaalsContact O-CB 3.23Å; R226-F230 WeakPolarHBondContact O-CB 3.42Å; R226-F230 PolarHBondContact O-N 3.2Å; E227-F230 PolarHBondContact O-N 3.14Å; F230-S232 PolarHBondContact O-N 3.48Å; F230-L233 PolarHBondContact O-N 3.45Å; F230-L234 HydrophobicContact CD1-CD1 3.99Å; F230-L234 HydrophobicContact CE1-CD1 3.49Å; F230-L234 VanDerWaalsContact CE1-CD1 3.49Å; F230-L234 HydrophobicContact CE1-CG 4.24Å; F230-L234 HydrophobicContact CE2-CG 4.47Å; F230-L234 HydrophobicContact CZ-CD1 3.78Å; F230-L234 HydrophobicContact CZ-CD2 4.32Å; F230-L234 HydrophobicContact CZ-CG 4.19Å; F230-L234 WeakPolarHBondContact O-CG 3.35Å; F230-L234 PolarHBondContact O-N 3.48Å; F230-L253 HydrophobicContact CB-CD1 4.07Å; F230-L253 HydrophobicContact CD2-CD2 3.92Å
231	S	91.9	Very high	89.4	Confident	50 Å²	50	55.9 Å²	55.9	35%	0.35	26%	0.264	S	S	.	.	H	α-helix	trans	-61	-42.6	176	-171	0	0	0	0	112.3	E227 L229 R235	E227-S231 VanDerWaalsContact O-CB 3.3Å; E227-S231 WeakPolarHBondContact O-CB 3.45Å; E227-S231 PolarHBondContact O-N 3.1Å; L229-S231 VanDerWaalsContact C-N 3.34Å; L229-S231 PolarHBondContact O-N 3.49Å; S231-R235 WeakPolarHBondContact O-CG 3.33Å
232	S	91.1	Very high	89.1	Confident	22 Å²	22	59.5 Å²	59.5	15%	0.154	28%	0.28	C	S	.	.	H	α-helix	trans	-66.6	-41.3	176.8	-173.9	0	0	0	0	112.1	Q228 L229 F230 L234 R235 Q236 L447	Q228-S232 WeakPolarHBondContact O-CB 3.46Å; Q228-S232 PolarHBondContact O-N 3.08Å; L229-S232 PolarHBondContact O-N 2.99Å; F230-S232 PolarHBondContact O-N 3.48Å; S232-L234 PolarHBondContact O-N 3.01Å; S232-R235 PolarHBondContact O-N 2.91Å; S232-Q236 WeakPolarHBondContact O-CG 3.23Å; S232-Q236 PolarHBondContact O-NE2 3.45Å; S232-Q236 VanDerWaalsContact O-NE2 3.07Å; S232-L447 PolarHBondContact OG-O 3.13Å
233	L	91.1	Very high	88.7	Confident	11 Å²	11	64.2 Å²	64.2	6%	0.058	30%	0.301	C	S	.	.	H	α-helix	trans	-60.4	-45	177.3	-73.6	173.4	0	0	0	111.7	L229 F230 R235 Q236 F240 F241 L249 Y446	L229-L233 HydrophobicContact CD1-CD1 4.32Å; L229-L233 HydrophobicContact CD1-CG 4.17Å; L229-L233 HydrophobicContact CG-CD1 4.05Å; L229-L233 HydrophobicContact CG-CG 4.35Å; L229-L233 WeakPolarHBondContact O-CB 3.28Å; L229-L233 VanDerWaalsContact O-CG 3.23Å; L229-L233 WeakPolarHBondContact O-CG 3.46Å; L229-L233 PolarHBondContact O-N 3.43Å; F230-L233 PolarHBondContact O-N 3.45Å; L233-R235 PolarHBondContact O-N 2.87Å; L233-Q236 WeakPolarHBondContact O-CB 3.42Å; L233-Q236 WeakPolarHBondContact O-CG 3.2Å; L233-Q236 PolarHBondContact O-N 3.28Å; L233-Q236 VanDerWaalsContact O-N 3.07Å; L233-F240 HydrophobicContact CD2-CE1 3.76Å; L233-F240 HydrophobicContact CD2-CZ 3.81Å; L233-F241 WeakPolarHBondContact O-CZ 3.47Å; L233-L249 HydrophobicContact CD2-CD2 3.98Å; L233-Y446 HydrophobicContact CD2-CD1 4.04Å
234	L	89.6	Confident	88.2	Confident	115 Å²	115	59.7 Å²	59.7	60%	0.602	28%	0.278	S	S	*	.	H	α-helix	trans	-64.8	-17.6	179.1	-70.5	-179.8	0	0	0	114.2	F230 S232	F230-L234 HydrophobicContact CD1-CD1 3.99Å; F230-L234 HydrophobicContact CE1-CD1 3.49Å; F230-L234 VanDerWaalsContact CE1-CD1 3.49Å; F230-L234 HydrophobicContact CE1-CG 4.24Å; F230-L234 HydrophobicContact CE2-CG 4.47Å; F230-L234 HydrophobicContact CZ-CD1 3.78Å; F230-L234 HydrophobicContact CZ-CD2 4.32Å; F230-L234 HydrophobicContact CZ-CG 4.19Å; F230-L234 WeakPolarHBondContact O-CG 3.35Å; F230-L234 PolarHBondContact O-N 3.48Å; S232-L234 PolarHBondContact O-N 3.01Å
235	R	88.8	Confident	87.8	Confident	180 Å²	180	64.8 Å²	64.8	68%	0.679	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-3.5	176.4	-66.1	175.8	-175.5	-169.3	0.5	113.3	S231 S232 L233 P451	S231-R235 WeakPolarHBondContact O-CG 3.33Å; S232-R235 PolarHBondContact O-N 2.91Å; L233-R235 PolarHBondContact O-N 2.87Å; R235-P451 VanDerWaalsContact O-CB 3.3Å; R235-P451 WeakPolarHBondContact O-CB 3.43Å; R235-P451 WeakPolarHBondContact O-CG 3.32Å
236	Q	90.3	Very high	87.3	Confident	12 Å²	12	70.3 Å²	70.3	6%	0.056	34%	0.336	C	S	.	.	S	Bend	trans	-74.2	152.4	179.2	-58.1	-55.9	-45.1	0	0	111.3	S232 L233 F240 F241 R449	S232-Q236 WeakPolarHBondContact O-CG 3.23Å; S232-Q236 PolarHBondContact O-NE2 3.45Å; S232-Q236 VanDerWaalsContact O-NE2 3.07Å; L233-Q236 WeakPolarHBondContact O-CB 3.42Å; L233-Q236 WeakPolarHBondContact O-CG 3.2Å; L233-Q236 PolarHBondContact O-N 3.28Å; L233-Q236 VanDerWaalsContact O-N 3.07Å; Q236-F240 HydrophobicContact CB-CB 4.25Å; Q236-F240 HydrophobicContact CB-CD1 3.73Å; Q236-F240 HydrophobicContact CB-CE1 4.36Å; Q236-F240 HydrophobicContact CB-CG 4.09Å; Q236-F240 HydrophobicContact CG-CD1 4.15Å; Q236-F240 HydrophobicContact CG-CE1 4.33Å; Q236-F241 HydrophobicContact CB-CE2 4.13Å; Q236-R449 PolarHBondContact NE2-O 3.17Å; Q236-R449 VanDerWaalsContact OE1-CG 3.32Å; Q236-R449 PolarHBondContact OE1-O 3.39Å
237	D	89.1	Confident	86.6	Confident	17 Å²	17	69 Å²	69	9%	0.091	35%	0.348	C	S	.	.			trans	-63.1	156.8	174.4	58.3	-86	0	0	0	112.6	G239 F240 F241 R449 N452 L453	D237-G239 PolarHBondContact O-N 3.18Å; D237-G239 WeakPolarHBondContact OD2-CA 3.44Å; D237-G239 PolarHBondContact OD2-N 3.27Å; D237-F240 VanDerWaalsContact O-CB 3.28Å; D237-F240 WeakPolarHBondContact O-CB 3.37Å; D237-F240 PolarHBondContact O-N 3.14Å; D237-F240 PolarHBondContact OD2-N 3.42Å; D237-F241 WeakPolarHBondContact O-CD2 3.3Å; D237-R449 IonicContact OD1-CZ 3.47Å; D237-R449 IonicContact OD1-NH1 3.36Å; D237-R449 PolarHBondContact OD1-NH1 3.42Å; D237-R449 IonicContact OD1-NH2 2.68Å; D237-R449 PolarHBondContact OD1-NH2 3.08Å; D237-R449 IonicContact OD2-NH2 3.33Å; D237-N452 PolarHBondContact OD1-N 3.32Å; D237-N452 VanDerWaalsContact OD1-N 3.16Å; D237-L453 HydrophobicContact CB-CD1 4.2Å; D237-L453 HydrophobicContact CB-CG 4.01Å
238	L	87.2	Confident	86.1	Confident	69 Å²	69	65.7 Å²	65.7	36%	0.361	33%	0.332	S	S	.	.	H	α-helix	trans	-66	-24	178.8	-68.3	-177.3	0	0	0	113.5	F240 F241 Q242 L519 Y520	L238-F240 VanDerWaalsContact C-N 3.29Å; L238-F240 PolarHBondContact O-N 3.05Å; L238-F241 PolarHBondContact O-N 3.32Å; L238-Q242 WeakPolarHBondContact O-CG 3.32Å; L238-Q242 PolarHBondContact O-N 2.62Å; L238-L519 HydrophobicContact CD1-CB 3.74Å; L238-L519 HydrophobicContact CD1-CD1 4.06Å; L238-L519 HydrophobicContact CD1-CD2 4.23Å; L238-L519 HydrophobicContact CD1-CG 4.22Å; L238-Y520 HydrophobicContact CB-CE1 4.15Å; L238-Y520 WeakPolarHBondContact CB-OH 3.38Å; L238-Y520 HydrophobicContact CD1-CE2 4.17Å
239	G	83.5	Confident	85.8	Confident	3 Å²	3	62.5 Å²	62.5	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-58.6	-42.8	175.9	0	0	0	0	0	111.7	D237 F241 Q242 E243	D237-G239 PolarHBondContact O-N 3.18Å; D237-G239 WeakPolarHBondContact OD2-CA 3.44Å; D237-G239 PolarHBondContact OD2-N 3.27Å; G239-F241 VanDerWaalsContact C-N 3.34Å; G239-F241 PolarHBondContact O-N 2.98Å; G239-Q242 WeakPolarHBondContact O-CB 3.4Å; G239-Q242 PolarHBondContact O-N 2.91Å; G239-Q242 VanDerWaalsContact O-N 3.1Å; G239-E243 PolarHBondContact O-N 3.44Å; G239-E243 VanDerWaalsContact O-N 3.11Å
240	F	86	Confident	85.5	Confident	7 Å²	7	67.8 Å²	67.8	3%	0.031	35%	0.346	C	S	.	.	H	α-helix	trans	-53.3	-45.5	172.9	172.9	-106.3	0	0	0	114	L233 Q236 D237 L238 Q242 E243 T244 L249 Y446	L233-F240 HydrophobicContact CD2-CE1 3.76Å; L233-F240 HydrophobicContact CD2-CZ 3.81Å; Q236-F240 HydrophobicContact CB-CB 4.25Å; Q236-F240 HydrophobicContact CB-CD1 3.73Å; Q236-F240 HydrophobicContact CB-CE1 4.36Å; Q236-F240 HydrophobicContact CB-CG 4.09Å; Q236-F240 HydrophobicContact CG-CD1 4.15Å; Q236-F240 HydrophobicContact CG-CE1 4.33Å; D237-F240 VanDerWaalsContact O-CB 3.28Å; D237-F240 WeakPolarHBondContact O-CB 3.37Å; D237-F240 PolarHBondContact O-N 3.14Å; D237-F240 PolarHBondContact OD2-N 3.42Å; L238-F240 VanDerWaalsContact C-N 3.29Å; L238-F240 PolarHBondContact O-N 3.05Å; F240-Q242 VanDerWaalsContact C-N 3.27Å; F240-Q242 PolarHBondContact O-N 3.17Å; F240-E243 PolarHBondContact O-N 3.04Å; F240-T244 WeakPolarHBondContact CE2-OG1 3.43Å; F240-T244 WeakPolarHBondContact O-CB 3.37Å; F240-T244 PolarHBondContact O-N 3.3Å; F240-T244 PolarHBondContact O-OG1 3.22Å; F240-L249 HydrophobicContact CE1-CD1 4.49Å; F240-L249 HydrophobicContact CE1-CD2 3.87Å; F240-L249 HydrophobicContact CZ-CD2 3.74Å; F240-Y446 AromaticContact CE2-CD1 3.77Å; F240-Y446 HydrophobicContact CE2-CD1 3.77Å; F240-Y446 AromaticContact CE2-CE1 3.48Å; F240-Y446 HydrophobicContact CE2-CE1 3.48Å; F240-Y446 VanDerWaalsContact CE2-CE1 3.48Å; F240-Y446 AromaticContact CZ-CD1 3.51Å; F240-Y446 HydrophobicContact CZ-CD1 3.51Å; F240-Y446 AromaticContact CZ-CE1 3.37Å; F240-Y446 HydrophobicContact CZ-CE1 3.37Å
241	F	85.9	Confident	85	Confident	72 Å²	72	65.4 Å²	65.4	32%	0.316	34%	0.343	S	S	.	.	H	α-helix	trans	-74.1	-18.8	-178.9	-70.4	-79.4	0	0	0	112.9	L233 Q236 D237 L238 G239 T244 L249	L233-F241 WeakPolarHBondContact O-CZ 3.47Å; Q236-F241 HydrophobicContact CB-CE2 4.13Å; D237-F241 WeakPolarHBondContact O-CD2 3.3Å; L238-F241 PolarHBondContact O-N 3.32Å; G239-F241 VanDerWaalsContact C-N 3.34Å; G239-F241 PolarHBondContact O-N 2.98Å; F241-T244 VanDerWaalsContact O-O 3.12Å; F241-L249 HydrophobicContact CD1-CD1 3.56Å; F241-L249 HydrophobicContact CE1-CD1 3.6Å
242	Q	81.8	Confident	84.5	Confident	86 Å²	86	65 Å²	65	40%	0.402	33%	0.333	S	S	.	.	H	α-helix	trans	-81.8	-28.8	172.4	-69.2	178.5	-20.8	0	0	112.6	L238 G239 F240 Y520	L238-Q242 WeakPolarHBondContact O-CG 3.32Å; L238-Q242 PolarHBondContact O-N 2.62Å; G239-Q242 WeakPolarHBondContact O-CB 3.4Å; G239-Q242 PolarHBondContact O-N 2.91Å; G239-Q242 VanDerWaalsContact O-N 3.1Å; F240-Q242 VanDerWaalsContact C-N 3.27Å; F240-Q242 PolarHBondContact O-N 3.17Å; Q242-Y520 VanDerWaalsContact CD-OH 3.23Å; Q242-Y520 PolarHBondContact NE2-OH 3.41Å; Q242-Y520 PolarHBondContact OE1-OH 3.24Å
243	E	79.5	Confident	84.3	Confident	119 Å²	119	65.8 Å²	65.8	56%	0.556	34%	0.336	S	S	*	.	H	α-helix	trans	-80.7	-40.9	174.9	-69.7	176.3	-176.9	0	0	111.8	G239 F240	G239-E243 PolarHBondContact O-N 3.44Å; G239-E243 VanDerWaalsContact O-N 3.11Å; F240-E243 PolarHBondContact O-N 3.04Å
244	T	79.6	Confident	84	Confident	17 Å²	17	68 Å²	68	10%	0.104	35%	0.353	C	S	.	.	S	Bend	trans	-96.7	124.7	-173	-45.4	0	0	0	0	111	F240 F241 E248 L249	F240-T244 WeakPolarHBondContact CE2-OG1 3.43Å; F240-T244 WeakPolarHBondContact O-CB 3.37Å; F240-T244 PolarHBondContact O-N 3.3Å; F240-T244 PolarHBondContact O-OG1 3.22Å; F241-T244 VanDerWaalsContact O-O 3.12Å; T244-E248 HydrophobicContact CG2-CB 4.28Å; T244-E248 HydrophobicContact CG2-CG 4.29Å; T244-L249 HydrophobicContact CG2-CD2 3.71Å; T244-L249 HydrophobicContact CG2-CG 3.93Å
245	K	80.5	Confident	83.7	Confident	165 Å²	165	65.1 Å²	65.1	72%	0.717	34%	0.342	S	S	*	.			trans	-66.6	138.8	178.4	-64.5	-179.9	-178.6	178.7	0	110.6	G247 E248 L249	K245-G247 PolarHBondContact O-N 3.11Å; K245-E248 HydrophobicContact CB-CB 4.43Å; K245-E248 WeakPolarHBondContact O-CA 3.49Å; K245-E248 VanDerWaalsContact O-CB 3.28Å; K245-E248 WeakPolarHBondContact O-CB 3.39Å; K245-E248 PolarHBondContact O-N 3.41Å; K245-L249 PolarHBondContact O-N 3.43Å
246	T	78.4	Confident	83.5	Confident	119 Å²	119	57.4 Å²	57.4	73%	0.73	31%	0.314	S	S	*	.	H	α-helix	trans	-56.1	-37.2	177	49.3	0	0	0	0	113.2	E248 L249 N250	T246-E248 VanDerWaalsContact C-N 3.29Å; T246-E248 PolarHBondContact O-N 2.97Å; T246-L249 PolarHBondContact O-N 3.48Å; T246-N250 PolarHBondContact O-N 3.24Å
247	G	77.7	Confident	83.3	Confident	52 Å²	52	56.8 Å²	56.8	54%	0.536	31%	0.311	S	S	.	.	H	α-helix	trans	-64.4	-31.3	174.1	0	0	0	0	0	113.6	K245 S251	K245-G247 PolarHBondContact O-N 3.11Å; G247-S251 PolarHBondContact O-N 2.83Å; G247-S251 VanDerWaalsContact O-N 3.13Å
248	E	80.2	Confident	83.1	Confident	70 Å²	70	57 Å²	57	33%	0.327	31%	0.314	S	S	.	.	H	α-helix	trans	-68	-48.1	172.4	-178.9	172.1	-179.4	0	0	110.4	T244 K245 T246 N250 S251 R252 Y446	T244-E248 HydrophobicContact CG2-CB 4.28Å; T244-E248 HydrophobicContact CG2-CG 4.29Å; K245-E248 HydrophobicContact CB-CB 4.43Å; K245-E248 WeakPolarHBondContact O-CA 3.49Å; K245-E248 VanDerWaalsContact O-CB 3.28Å; K245-E248 WeakPolarHBondContact O-CB 3.39Å; K245-E248 PolarHBondContact O-N 3.41Å; T246-E248 VanDerWaalsContact C-N 3.29Å; T246-E248 PolarHBondContact O-N 2.97Å; E248-N250 VanDerWaalsContact C-N 3.29Å; E248-N250 PolarHBondContact O-N 3.5Å; E248-S251 CarbonylContact O-C 3.58Å; E248-S251 WeakPolarHBondContact O-CA 3.3Å; E248-S251 WeakPolarHBondContact O-CB 3.47Å; E248-S251 PolarHBondContact O-N 3.2Å; E248-R252 HydrophobicContact CG-CG 4.3Å; E248-R252 WeakPolarHBondContact O-CG 3.36Å; E248-R252 PolarHBondContact O-N 3.35Å; E248-R252 IonicContact OE1-CZ 3.29Å; E248-R252 IonicContact OE1-NE 2.79Å; E248-R252 PolarHBondContact OE1-NE 3.22Å; E248-R252 IonicContact OE1-NH2 2.77Å; E248-R252 PolarHBondContact OE1-NH2 3.4Å; E248-Y446 PolarHBondContact OE1-OH 3.42Å
249	L	85.8	Confident	83	Confident	19 Å²	19	58.1 Å²	58.1	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-57	-41.6	177.8	-63.6	175.7	0	0	0	112.4	L233 F240 F241 T244 K245 T246 R252 L253 Y446	L233-L249 HydrophobicContact CD2-CD2 3.98Å; F240-L249 HydrophobicContact CE1-CD1 4.49Å; F240-L249 HydrophobicContact CE1-CD2 3.87Å; F240-L249 HydrophobicContact CZ-CD2 3.74Å; F241-L249 HydrophobicContact CD1-CD1 3.56Å; F241-L249 HydrophobicContact CE1-CD1 3.6Å; T244-L249 HydrophobicContact CG2-CD2 3.71Å; T244-L249 HydrophobicContact CG2-CG 3.93Å; K245-L249 PolarHBondContact O-N 3.43Å; T246-L249 PolarHBondContact O-N 3.48Å; L249-R252 PolarHBondContact O-N 3.47Å; L249-L253 WeakPolarHBondContact O-CB 3.43Å; L249-L253 PolarHBondContact O-N 2.99Å; L249-Y446 HydrophobicContact CD2-CE1 4.36Å
250	N	85.3	Confident	82.9	Confident	110 Å²	110	58.3 Å²	58.3	59%	0.588	32%	0.32	S	S	*	.	H	α-helix	trans	-64.8	-41.4	176.1	-168.5	25.5	0	0	0	111.9	T246 E248 L253 S254	T246-N250 PolarHBondContact O-N 3.24Å; E248-N250 VanDerWaalsContact C-N 3.29Å; E248-N250 PolarHBondContact O-N 3.5Å; N250-L253 PolarHBondContact O-N 3.36Å; N250-S254 VanDerWaalsContact O-CB 3.3Å; N250-S254 WeakPolarHBondContact O-CB 3.49Å; N250-S254 PolarHBondContact O-N 3.15Å
251	S	81.1	Confident	82.7	Confident	59 Å²	59	58 Å²	58	41%	0.413	32%	0.319	S	S	.	.	H	α-helix	trans	-62.9	-42.1	174.1	-172.6	0	0	0	0	111.9	G247 E248 S254 S255 D256	G247-S251 PolarHBondContact O-N 2.83Å; G247-S251 VanDerWaalsContact O-N 3.13Å; E248-S251 CarbonylContact O-C 3.58Å; E248-S251 WeakPolarHBondContact O-CA 3.3Å; E248-S251 WeakPolarHBondContact O-CB 3.47Å; E248-S251 PolarHBondContact O-N 3.2Å; S251-S254 PolarHBondContact O-N 3.01Å; S251-S255 WeakPolarHBondContact O-CA 3.37Å; S251-S255 VanDerWaalsContact O-CB 3.27Å; S251-S255 WeakPolarHBondContact O-CB 3.47Å; S251-S255 PolarHBondContact O-N 2.91Å; S251-D256 PolarHBondContact O-N 3.32Å
252	R	81.7	Confident	82.5	Confident	40 Å²	40	61.3 Å²	61.3	15%	0.151	33%	0.33	C	S	.	.	I	π-helix	trans	-60	-50.6	174.4	-62.6	-54.6	177.9	-153.8	-8.3	111	E248 L249 S254 D256 T257 K442 Y446	E248-R252 HydrophobicContact CG-CG 4.3Å; E248-R252 WeakPolarHBondContact O-CG 3.36Å; E248-R252 PolarHBondContact O-N 3.35Å; E248-R252 IonicContact OE1-CZ 3.29Å; E248-R252 IonicContact OE1-NE 2.79Å; E248-R252 PolarHBondContact OE1-NE 3.22Å; E248-R252 IonicContact OE1-NH2 2.77Å; E248-R252 PolarHBondContact OE1-NH2 3.4Å; L249-R252 PolarHBondContact O-N 3.47Å; R252-S254 VanDerWaalsContact C-N 3.34Å; R252-S254 PolarHBondContact O-N 3.02Å; R252-D256 WeakPolarHBondContact CD-OD2 3.09Å; R252-D256 IonicContact CZ-OD2 3.79Å; R252-D256 IonicContact NE-OD2 2.68Å; R252-D256 IonicContact NH1-OD2 3.56Å; R252-D256 PolarHBondContact NH1-OD2 3.1Å; R252-D256 PolarHBondContact O-N 2.9Å; R252-T257 WeakPolarHBondContact O-CG2 3.27Å; R252-T257 PolarHBondContact O-N 3.28Å; R252-K442 VanDerWaalsContact NH1-CD 3.27Å; R252-Y446 HydrophobicContact CG-CD2 4.43Å; R252-Y446 HydrophobicContact CG-CE2 3.9Å
253	L	87	Confident	82.3	Confident	39 Å²	39	58.5 Å²	58.5	20%	0.204	32%	0.315	C	S	.	.	I	π-helix	trans	-67.4	-33	-176.3	-167.8	69.1	0	0	0	112.5	R226 L229 F230 L249 N250 T257	R226-L253 PolarHBondContact NE-O 3.17Å; L229-L253 HydrophobicContact CB-CD1 4.16Å; L229-L253 HydrophobicContact CD2-CD1 3.95Å; L229-L253 HydrophobicContact CG-CD1 4.04Å; F230-L253 HydrophobicContact CB-CD1 4.07Å; F230-L253 HydrophobicContact CD2-CD2 3.92Å; L249-L253 WeakPolarHBondContact O-CB 3.43Å; L249-L253 PolarHBondContact O-N 2.99Å; N250-L253 PolarHBondContact O-N 3.36Å; L253-T257 WeakPolarHBondContact O-CG2 3.46Å; L253-T257 PolarHBondContact O-OG1 3.38Å
254	S	85.5	Confident	82.1	Confident	59 Å²	59	54.2 Å²	54.2	41%	0.413	30%	0.296	S	S	.	.	I	π-helix	trans	-95.4	-61.9	-178.4	-173	0	0	0	0	113.1	R226 N250 S251 R252 T257 S258	R226-S254 PolarHBondContact NH2-O 3.45Å; N250-S254 VanDerWaalsContact O-CB 3.3Å; N250-S254 WeakPolarHBondContact O-CB 3.49Å; N250-S254 PolarHBondContact O-N 3.15Å; S251-S254 PolarHBondContact O-N 3.01Å; R252-S254 VanDerWaalsContact C-N 3.34Å; R252-S254 PolarHBondContact O-N 3.02Å; S254-T257 PolarHBondContact O-OG1 2.87Å; S254-S258 WeakPolarHBondContact O-CB 3.31Å; S254-S258 PolarHBondContact O-N 3.4Å
255	S	83.1	Confident	82.1	Confident	54 Å²	54	53.7 Å²	53.7	38%	0.378	29%	0.293	S	S	.	.	I	π-helix	trans	-74.7	-53.7	-171.8	-177.9	0	0	0	0	111.8	S251 S258 L259	S251-S255 WeakPolarHBondContact O-CA 3.37Å; S251-S255 VanDerWaalsContact O-CB 3.27Å; S251-S255 WeakPolarHBondContact O-CB 3.47Å; S251-S255 PolarHBondContact O-N 2.91Å; S255-S258 WeakPolarHBondContact O-CB 3.22Å; S255-S258 PolarHBondContact O-N 2.99Å; S255-L259 WeakPolarHBondContact O-CG 3.49Å; S255-L259 PolarHBondContact O-N 3.18Å
256	D	83.6	Confident	82.1	Confident	17 Å²	17	51.3 Å²	51.3	9%	0.091	28%	0.283	C	S	.	.	I	π-helix	trans	-70.9	-38.6	-172.9	-68.4	-12.9	0	0	0	112.2	S251 R252 S258 L259 M260 V443	S251-D256 PolarHBondContact O-N 3.32Å; R252-D256 WeakPolarHBondContact CD-OD2 3.09Å; R252-D256 IonicContact CZ-OD2 3.79Å; R252-D256 IonicContact NE-OD2 2.68Å; R252-D256 IonicContact NH1-OD2 3.56Å; R252-D256 PolarHBondContact NH1-OD2 3.1Å; R252-D256 PolarHBondContact O-N 2.9Å; D256-S258 VanDerWaalsContact C-N 3.31Å; D256-S258 PolarHBondContact O-N 3.44Å; D256-L259 PolarHBondContact O-N 3.11Å; D256-M260 VanDerWaalsContact O-CB 3.24Å; D256-M260 WeakPolarHBondContact O-CB 3.47Å; D256-M260 PolarHBondContact O-N 2.77Å; D256-V443 HydrophobicContact CB-CG2 3.86Å
257	T	86.1	Confident	82.3	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.6	-38.1	171.9	65.2	0	0	0	0	112	N222 I225 R226 L229 R252 L253 S254 S261 V443	N222-T257 PolarHBondContact ND2-O 3.35Å; I225-T257 HydrophobicContact CG2-CG2 3.84Å; R226-T257 HydrophobicContact CG-CG2 4.1Å; R226-T257 WeakPolarHBondContact CG-OG1 3.43Å; R226-T257 PolarHBondContact NE-OG1 3.43Å; R226-T257 VanDerWaalsContact NE-OG1 3.09Å; L229-T257 HydrophobicContact CD2-CG2 3.51Å; R252-T257 WeakPolarHBondContact O-CG2 3.27Å; R252-T257 PolarHBondContact O-N 3.28Å; L253-T257 WeakPolarHBondContact O-CG2 3.46Å; L253-T257 PolarHBondContact O-OG1 3.38Å; S254-T257 PolarHBondContact O-OG1 2.87Å; T257-S261 WeakPolarHBondContact O-CB 3.38Å; T257-S261 PolarHBondContact O-N 3.25Å; T257-S261 PolarHBondContact O-OG 2.93Å; T257-V443 HydrophobicContact CG2-CG2 4.47Å
258	S	86.4	Confident	82.4	Confident	22 Å²	22	45.3 Å²	45.3	15%	0.154	24%	0.24	C	C	.	.	H	α-helix	trans	-59.9	-60.1	173.7	-176.7	0	0	0	0	108.9	N222 S254 S255 D256 M260 S261 R262	N222-S258 WeakPolarHBondContact ND2-CA 3.41Å; S254-S258 WeakPolarHBondContact O-CB 3.31Å; S254-S258 PolarHBondContact O-N 3.4Å; S255-S258 WeakPolarHBondContact O-CB 3.22Å; S255-S258 PolarHBondContact O-N 2.99Å; D256-S258 VanDerWaalsContact C-N 3.31Å; D256-S258 PolarHBondContact O-N 3.44Å; S258-M260 VanDerWaalsContact C-N 3.34Å; S258-M260 PolarHBondContact O-N 3.48Å; S258-S261 PolarHBondContact O-N 3.34Å; S258-S261 PolarHBondContact O-OG 2.93Å; S258-R262 WeakPolarHBondContact O-CG 3.46Å; S258-R262 PolarHBondContact O-N 2.94Å; S258-R262 PolarHBondContact OG-NE 3.49Å
259	L	83.5	Confident	82.6	Confident	92 Å²	92	43.1 Å²	43.1	48%	0.482	23%	0.23	S	C	.	.	H	α-helix	trans	-50.2	-51.6	179	-69.9	173.6	0	0	0	112	S255 D256 S261 R262 W263	S255-L259 WeakPolarHBondContact O-CG 3.49Å; S255-L259 PolarHBondContact O-N 3.18Å; D256-L259 PolarHBondContact O-N 3.11Å; L259-S261 PolarHBondContact O-N 3.23Å; L259-R262 PolarHBondContact O-N 2.9Å; L259-W263 WeakPolarHBondContact O-CB 3.46Å; L259-W263 PolarHBondContact O-N 3.43Å
260	M	82.6	Confident	82.6	Confident	6 Å²	6	44.1 Å²	44.1	3%	0.03	24%	0.235	C	C	.	.	H	α-helix	trans	-57.8	-45.9	178	-178.6	-176.9	178.2	0	0	112.7	L141 I225 D256 S258 W263 A440 V443 F444	L141-M260 HydrophobicContact CD2-CE 3.35Å; L141-M260 HydrophobicContact CD2-CG 3.89Å; L141-M260 HydrophobicContact CD2-SD 4.46Å; L141-M260 HydrophobicContact CG-CE 4.25Å; I225-M260 HydrophobicContact CD1-CE 4.23Å; I225-M260 HydrophobicContact CD1-CG 4.36Å; I225-M260 HydrophobicContact CD1-SD 4.18Å; I225-M260 HydrophobicContact CG2-SD 4.4Å; D256-M260 VanDerWaalsContact O-CB 3.24Å; D256-M260 WeakPolarHBondContact O-CB 3.47Å; D256-M260 PolarHBondContact O-N 2.77Å; S258-M260 VanDerWaalsContact C-N 3.34Å; S258-M260 PolarHBondContact O-N 3.48Å; M260-W263 PolarHBondContact O-N 3.43Å; M260-A440 HydrophobicContact CE-CB 4.3Å; M260-A440 HydrophobicContact CG-CB 4.06Å; M260-A440 HydrophobicContact SD-CB 4.3Å; M260-V443 HydrophobicContact CE-CG1 4.36Å; M260-V443 HydrophobicContact SD-CB 3.57Å; M260-V443 VanDerWaalsContact SD-CB 3.57Å; M260-V443 HydrophobicContact SD-CG1 3.54Å; M260-V443 VanDerWaalsContact SD-CG1 3.54Å; M260-V443 HydrophobicContact SD-CG2 3.98Å; M260-F444 HydrophobicContact CE-CD1 4.41Å; M260-F444 HydrophobicContact CE-CD2 3.86Å; M260-F444 HydrophobicContact CE-CE1 3.87Å; M260-F444 HydrophobicContact CE-CE2 3.28Å; M260-F444 HydrophobicContact CE-CG 4.41Å; M260-F444 HydrophobicContact CE-CZ 3.28Å
261	S	81.7	Confident	82.6	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.014	22%	0.223	C	C	.	.	H	α-helix	trans	-70.8	-30.8	179.6	67.8	0	0	0	0	113.7	N222 T257 S258 L259 P265	N222-S261 WeakPolarHBondContact CB-OG 3.44Å; N222-S261 PolarHBondContact ND2-OG 2.99Å; T257-S261 WeakPolarHBondContact O-CB 3.38Å; T257-S261 PolarHBondContact O-N 3.25Å; T257-S261 PolarHBondContact O-OG 2.93Å; S258-S261 PolarHBondContact O-N 3.34Å; S258-S261 PolarHBondContact O-OG 2.93Å; L259-S261 PolarHBondContact O-N 3.23Å; S261-P265 WeakPolarHBondContact O-CD 3.37Å; S261-P265 WeakPolarHBondContact O-CG 3.3Å
262	R	81.4	Confident	82.8	Confident	141 Å²	141	41.4 Å²	41.4	53%	0.532	22%	0.216	S	C	.	.	H	α-helix	trans	-72.3	-41.3	174.8	-54	-141.8	161.1	164.9	-5.6	110.5	M218 S258 L259 P265 F266	M218-R262 HydrophobicContact CE-CB 3.52Å; M218-R262 HydrophobicContact CE-CG 3.14Å; M218-R262 VanDerWaalsContact CE-NE 3.27Å; S258-R262 WeakPolarHBondContact O-CG 3.46Å; S258-R262 PolarHBondContact O-N 2.94Å; S258-R262 PolarHBondContact OG-NE 3.49Å; L259-R262 PolarHBondContact O-N 2.9Å; R262-P265 WeakPolarHBondContact O-CD 3.49Å; R262-F266 WeakPolarHBondContact O-CB 3.22Å; R262-F266 PolarHBondContact O-N 3.27Å; R262-F266 VanDerWaalsContact O-N 3.07Å
263	W	77.9	Confident	83.1	Confident	26 Å²	26	43.3 Å²	43.3	10%	0.098	22%	0.223	C	C	.	.	H	α-helix	trans	-63.8	-49.2	-165.7	-175	86.7	0	0	0	112.3	M138 L141 L259 M260 N267 M433 N436	M138-W263 HydrophobicContact CE-CH2 4.17Å; M138-W263 HydrophobicContact SD-CH2 3.79Å; M138-W263 HydrophobicContact SD-CZ3 3.98Å; L141-W263 HydrophobicContact CD1-CZ3 4.24Å; L259-W263 WeakPolarHBondContact O-CB 3.46Å; L259-W263 PolarHBondContact O-N 3.43Å; M260-W263 PolarHBondContact O-N 3.43Å; W263-N267 PolarHBondContact NE1-ND2 2.78Å; W263-N267 VanDerWaalsContact O-CB 3.27Å; W263-N267 WeakPolarHBondContact O-CB 3.37Å; W263-N267 PolarHBondContact O-N 3.07Å; W263-N267 PolarHBondContact O-ND2 3.47Å; W263-M433 HydrophobicContact CZ2-CB 4.29Å; W263-M433 HydrophobicContact CZ2-CG 4.25Å; W263-M433 WeakPolarHBondContact CZ2-O 3.41Å; W263-N436 VanDerWaalsContact CD1-CB 3.46Å; W263-N436 HydrophobicContact CD2-CB 4.48Å; W263-N436 HydrophobicContact CG-CB 4.32Å; W263-N436 HydrophobicContact CZ2-CB 4.26Å; W263-N436 PolarHBondContact NE1-ND2 3.23Å
264	L	75.4	Confident	83.2	Confident	29 Å²	29	41.6 Å²	41.6	15%	0.152	21%	0.214	C	C	.	.	H	α-helix	trans	-64	-53.4	-175.9	-174.9	77.5	0	0	0	112.7	L141 A268	L141-L264 HydrophobicContact CB-CD1 4.41Å; L141-L264 HydrophobicContact CB-CD2 4.15Å; L264-A268 WeakPolarHBondContact O-CB 3.36Å; L264-A268 PolarHBondContact O-N 3.49Å
265	P	79.3	Confident	83.4	Confident	6 Å²	6	42.9 Å²	42.9	4%	0.039	22%	0.216	C	C	.	.	H	α-helix	trans	-67.7	-37.5	-179.1	-19.1	34.2	0	0	0	112.6	F214 M218 I221 S261 R262 N269	F214-P265 HydrophobicContact CD1-CB 4.05Å; M218-P265 HydrophobicContact CB-CB 4.43Å; M218-P265 HydrophobicContact CB-CG 4.23Å; I221-P265 HydrophobicContact CD1-CG 4.07Å; S261-P265 WeakPolarHBondContact O-CD 3.37Å; S261-P265 WeakPolarHBondContact O-CG 3.3Å; R262-P265 WeakPolarHBondContact O-CD 3.49Å; P265-N269 WeakPolarHBondContact O-CB 3.37Å; P265-N269 PolarHBondContact O-N 3.17Å
266	F	81.5	Confident	83.7	Confident	116 Å²	116	41.7 Å²	41.7	51%	0.509	21%	0.206	S	C	.	.	H	α-helix	trans	-66.6	-47.9	-179.5	-177.4	-103.7	0	0	0	112.1	R262 N269 I270	R262-F266 WeakPolarHBondContact O-CB 3.22Å; R262-F266 PolarHBondContact O-N 3.27Å; R262-F266 VanDerWaalsContact O-N 3.07Å; F266-N269 WeakPolarHBondContact O-CB 3.43Å; F266-N269 PolarHBondContact O-N 3.01Å; F266-I270 HydrophobicContact CD1-CD1 3.71Å; F266-I270 HydrophobicContact CD2-CD1 4.38Å; F266-I270 HydrophobicContact CE1-CD1 3.22Å; F266-I270 HydrophobicContact CE1-CG1 4.49Å; F266-I270 HydrophobicContact CE2-CD1 3.95Å; F266-I270 HydrophobicContact CG-CD1 4.28Å; F266-I270 HydrophobicContact CZ-CD1 3.37Å; F266-I270 HydrophobicContact CZ-CG1 4.49Å; F266-I270 WeakPolarHBondContact O-CG1 3.47Å; F266-I270 PolarHBondContact O-N 2.99Å
267	N	81	Confident	84	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.016	20%	0.202	C	C	.	.	H	α-helix	trans	-69.7	-37.6	179.3	-69.6	-57.1	0	0	0	111.6	W263 N269 I270 L271 M429 M433	W263-N267 PolarHBondContact NE1-ND2 2.78Å; W263-N267 VanDerWaalsContact O-CB 3.27Å; W263-N267 WeakPolarHBondContact O-CB 3.37Å; W263-N267 PolarHBondContact O-N 3.07Å; W263-N267 PolarHBondContact O-ND2 3.47Å; N267-N269 VanDerWaalsContact C-N 3.34Å; N267-N269 PolarHBondContact O-N 3.47Å; N267-I270 PolarHBondContact O-N 2.94Å; N267-L271 WeakPolarHBondContact O-CB 3.48Å; N267-L271 PolarHBondContact O-N 3.5Å; N267-M429 HydrophobicContact CB-CE 4.32Å; N267-M429 HydrophobicContact CB-SD 3.59Å; N267-M429 VanDerWaalsContact CB-SD 3.59Å; N267-M429 VanDerWaalsContact CG-SD 3.53Å; N267-M429 WeakPolarHBondContact OD1-CE 3.45Å; N267-M429 PolarHBondContact OD1-SD 3.49Å; N267-M433 HydrophobicContact CB-CE 3.79Å
268	A	80.2	Confident	84.1	Confident	42 Å²	42	41.8 Å²	41.8	35%	0.347	21%	0.207	S	C	.	.	H	α-helix	trans	-59.3	-45.5	170.9	0	0	0	0	0	111.4	L264 I270 L272	L264-A268 WeakPolarHBondContact O-CB 3.36Å; L264-A268 PolarHBondContact O-N 3.49Å; A268-I270 PolarHBondContact O-N 3.28Å; A268-L272 WeakPolarHBondContact O-CB 3.48Å; A268-L272 PolarHBondContact O-N 3.42Å
269	N	85.3	Confident	84.3	Confident	24 Å²	24	45.3 Å²	45.3	13%	0.128	23%	0.228	C	C	.	.	H	α-helix	trans	-62	-41.1	178.8	179.5	53.6	0	0	0	113.1	R210 F214 P265 F266 N267 R273	R210-N269 PolarHBondContact NE-OD1 2.88Å; R210-N269 PolarHBondContact NH2-ND2 3.07Å; R210-N269 PolarHBondContact NH2-O 3.42Å; R210-N269 VanDerWaalsContact NH2-O 3.15Å; R210-N269 PolarHBondContact NH2-OD1 3.3Å; F214-N269 HydrophobicContact CD1-CB 3.95Å; F214-N269 HydrophobicContact CD2-CB 3.99Å; F214-N269 WeakPolarHBondContact CD2-OD1 3.45Å; F214-N269 HydrophobicContact CE1-CB 3.79Å; F214-N269 HydrophobicContact CE2-CB 3.83Å; F214-N269 WeakPolarHBondContact CE2-OD1 3.41Å; F214-N269 HydrophobicContact CG-CB 4.06Å; F214-N269 HydrophobicContact CZ-CB 3.73Å; P265-N269 WeakPolarHBondContact O-CB 3.37Å; P265-N269 PolarHBondContact O-N 3.17Å; F266-N269 WeakPolarHBondContact O-CB 3.43Å; F266-N269 PolarHBondContact O-N 3.01Å; N267-N269 VanDerWaalsContact C-N 3.34Å; N267-N269 PolarHBondContact O-N 3.47Å; N269-R273 WeakPolarHBondContact O-CB 3.49Å; N269-R273 PolarHBondContact O-N 3.24Å; N269-R273 VanDerWaalsContact O-N 3.15Å
270	I	85.6	Confident	84.5	Confident	39 Å²	39	41.9 Å²	41.9	20%	0.2	21%	0.214	C	C	.	.	H	α-helix	trans	-73.1	-49	177.4	-67.3	170.5	0	0	0	110.8	F266 N267 A268 L272 R273 S274 M429	F266-I270 HydrophobicContact CD1-CD1 3.71Å; F266-I270 HydrophobicContact CD2-CD1 4.38Å; F266-I270 HydrophobicContact CE1-CD1 3.22Å; F266-I270 HydrophobicContact CE1-CG1 4.49Å; F266-I270 HydrophobicContact CE2-CD1 3.95Å; F266-I270 HydrophobicContact CG-CD1 4.28Å; F266-I270 HydrophobicContact CZ-CD1 3.37Å; F266-I270 HydrophobicContact CZ-CG1 4.49Å; F266-I270 WeakPolarHBondContact O-CG1 3.47Å; F266-I270 PolarHBondContact O-N 2.99Å; N267-I270 PolarHBondContact O-N 2.94Å; A268-I270 PolarHBondContact O-N 3.28Å; I270-L272 VanDerWaalsContact C-N 3.34Å; I270-L272 PolarHBondContact O-N 2.88Å; I270-R273 PolarHBondContact O-N 3.09Å; I270-S274 VanDerWaalsContact O-CB 3.29Å; I270-S274 WeakPolarHBondContact O-CB 3.5Å; I270-S274 PolarHBondContact O-N 3.39Å; I270-S274 PolarHBondContact O-OG 3Å; I270-M429 HydrophobicContact CB-CE 3.7Å; I270-M429 HydrophobicContact CD1-CE 3.9Å; I270-M429 HydrophobicContact CG1-CE 4.41Å; I270-M429 HydrophobicContact CG2-CE 3.58Å
271	L	85.3	Confident	84.9	Confident	63 Å²	63	41.6 Å²	41.6	33%	0.33	21%	0.213	S	C	.	.	H	α-helix	trans	-58.4	-49.2	-178.4	-174.4	153.2	0	0	0	110.5	N267 S274 L275 M429 M433	N267-L271 WeakPolarHBondContact O-CB 3.48Å; N267-L271 PolarHBondContact O-N 3.5Å; L271-S274 PolarHBondContact O-N 2.58Å; L271-L275 WeakPolarHBondContact O-CB 3.47Å; L271-L275 PolarHBondContact O-N 3.29Å; L271-M429 HydrophobicContact CB-CG 4.34Å; L271-M429 HydrophobicContact CD1-CG 4.46Å; L271-M433 HydrophobicContact CB-CE 4.4Å; L271-M433 HydrophobicContact CD1-CE 3.54Å; L271-M433 HydrophobicContact CD1-SD 4.09Å
272	L	85.1	Confident	85.3	Confident	50 Å²	50	43.3 Å²	43.3	26%	0.262	22%	0.219	S	C	.	.	H	α-helix	trans	-65.9	-41.7	-178.6	-164.6	55.7	0	0	0	111.7	F156 L159 A268 I270 V276	F156-L272 HydrophobicContact CB-CD2 4.33Å; F156-L272 HydrophobicContact CD2-CD1 3.97Å; F156-L272 HydrophobicContact CD2-CD2 3.14Å; F156-L272 HydrophobicContact CD2-CG 3.56Å; F156-L272 HydrophobicContact CE2-CD1 3.47Å; F156-L272 VanDerWaalsContact CE2-CD1 3.47Å; F156-L272 HydrophobicContact CE2-CD2 3.63Å; F156-L272 HydrophobicContact CE2-CG 3.53Å; F156-L272 HydrophobicContact CG-CD2 4.02Å; F156-L272 HydrophobicContact CZ-CD1 4.34Å; L159-L272 HydrophobicContact CD1-CB 4.17Å; L159-L272 HydrophobicContact CD1-CD2 4.4Å; L159-L272 HydrophobicContact CD1-CG 4.18Å; L159-L272 HydrophobicContact CD2-CG 4.22Å; A268-L272 WeakPolarHBondContact O-CB 3.48Å; A268-L272 PolarHBondContact O-N 3.42Å; I270-L272 VanDerWaalsContact C-N 3.34Å; I270-L272 PolarHBondContact O-N 2.88Å; L272-V276 WeakPolarHBondContact O-CB 3.12Å; L272-V276 WeakPolarHBondContact O-CG2 3.45Å; L272-V276 PolarHBondContact O-N 2.72Å
273	R	87.7	Confident	85.7	Confident	80 Å²	80	41.9 Å²	41.9	30%	0.302	22%	0.217	S	C	.	.	H	α-helix	trans	-60.8	-53.8	175	-175.9	-171.5	-171.8	172.3	2.9	110.9	L159 V163 E166 R210 N269 I270 L275 V276 K277 Y422	L159-R273 HydrophobicContact CD1-CB 4.1Å; V163-R273 HydrophobicContact CG2-CG 4.41Å; E166-R273 IonicContact OE1-NH2 3.05Å; E166-R273 IonicContact OE2-NH2 3.36Å; R210-R273 VanDerWaalsContact NH1-CB 3.35Å; R210-R273 VanDerWaalsContact NH1-CG 3.28Å; N269-R273 WeakPolarHBondContact O-CB 3.49Å; N269-R273 PolarHBondContact O-N 3.24Å; N269-R273 VanDerWaalsContact O-N 3.15Å; I270-R273 PolarHBondContact O-N 3.09Å; R273-L275 VanDerWaalsContact C-N 3.3Å; R273-L275 PolarHBondContact O-N 2.89Å; R273-V276 PolarHBondContact O-N 2.88Å; R273-K277 HydrophobicContact CG-CG 4.44Å; R273-K277 VanDerWaalsContact O-CB 3.3Å; R273-K277 WeakPolarHBondContact O-CB 3.11Å; R273-K277 PolarHBondContact O-N 3.31Å; R273-Y422 HydrophobicContact CG-CE1 4.36Å; R273-Y422 PolarHBondContact NH2-OH 3.37Å
274	S	89.4	Confident	86.3	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-65.9	-37.5	-173.5	-58.9	0	0	0	0	110.4	I270 L271 K277 V278	I270-S274 VanDerWaalsContact O-CB 3.29Å; I270-S274 WeakPolarHBondContact O-CB 3.5Å; I270-S274 PolarHBondContact O-N 3.39Å; I270-S274 PolarHBondContact O-OG 3Å; L271-S274 PolarHBondContact O-N 2.58Å; S274-K277 PolarHBondContact O-N 3.03Å; S274-V278 VanDerWaalsContact O-CB 3.27Å; S274-V278 WeakPolarHBondContact O-CB 3.5Å; S274-V278 WeakPolarHBondContact O-CG2 3.41Å; S274-V278 PolarHBondContact O-N 2.9Å
275	L	88.9	Confident	86.9	Confident	86 Å²	86	40 Å²	40	45%	0.45	21%	0.209	S	C	.	.	H	α-helix	trans	-64.2	-49.5	175.2	-171.7	143.1	0	0	0	111.7	L271 R273 K277 V278 V279	L271-L275 WeakPolarHBondContact O-CB 3.47Å; L271-L275 PolarHBondContact O-N 3.29Å; R273-L275 VanDerWaalsContact C-N 3.3Å; R273-L275 PolarHBondContact O-N 2.89Å; L275-K277 VanDerWaalsContact C-N 3.35Å; L275-K277 PolarHBondContact O-N 3.31Å; L275-V278 PolarHBondContact O-N 3.5Å; L275-V279 VanDerWaalsContact O-CG2 3.31Å; L275-V279 WeakPolarHBondContact O-CG2 3.44Å; L275-V279 PolarHBondContact O-N 3.4Å
276	V	89.6	Confident	87.4	Confident	28 Å²	28	43.6 Å²	43.6	17%	0.17	23%	0.227	C	C	.	.	H	α-helix	trans	-63.7	-40.5	178.3	178.3	0	0	0	0	111.1	F156 L159 V163 L272 R273 G280	F156-V276 HydrophobicContact CE2-CG2 4.48Å; L159-V276 HydrophobicContact CD2-CB 4.31Å; L159-V276 HydrophobicContact CD2-CG2 4.05Å; V163-V276 HydrophobicContact CB-CG1 4.15Å; V163-V276 HydrophobicContact CG1-CG1 3.82Å; V163-V276 HydrophobicContact CG2-CG1 4.45Å; L272-V276 WeakPolarHBondContact O-CB 3.12Å; L272-V276 WeakPolarHBondContact O-CG2 3.45Å; L272-V276 PolarHBondContact O-N 2.72Å; R273-V276 PolarHBondContact O-N 2.88Å; V276-G280 PolarHBondContact O-N 3.48Å
277	K	89.6	Confident	87.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-48.9	175.8	-89	-78.8	-172.5	167	0	112.3	V163 E166 T167 R273 S274 L275 V279 G280 L281 E418 Y422	V163-K277 HydrophobicContact CB-CG 4.46Å; V163-K277 HydrophobicContact CG1-CB 4.49Å; V163-K277 HydrophobicContact CG1-CD 3.74Å; V163-K277 HydrophobicContact CG1-CG 3.74Å; V163-K277 HydrophobicContact CG2-CD 4.42Å; V163-K277 HydrophobicContact CG2-CG 3.89Å; E166-K277 WeakPolarHBondContact OE2-CE 3.11Å; E166-K277 IonicContact OE2-NZ 3.6Å; E166-K277 PolarHBondContact OE2-NZ 3.42Å; T167-K277 HydrophobicContact CG2-CD 4.13Å; R273-K277 HydrophobicContact CG-CG 4.44Å; R273-K277 VanDerWaalsContact O-CB 3.3Å; R273-K277 WeakPolarHBondContact O-CB 3.11Å; R273-K277 PolarHBondContact O-N 3.31Å; S274-K277 PolarHBondContact O-N 3.03Å; L275-K277 VanDerWaalsContact C-N 3.35Å; L275-K277 PolarHBondContact O-N 3.31Å; K277-V279 PolarHBondContact O-N 3.41Å; K277-G280 PolarHBondContact O-N 2.95Å; K277-L281 HydrophobicContact CB-CD1 4.42Å; K277-L281 HydrophobicContact CD-CD1 4.13Å; K277-L281 HydrophobicContact CD-CG 4.46Å; K277-L281 WeakPolarHBondContact O-CB 3.44Å; K277-L281 WeakPolarHBondContact O-CD1 3.2Å; K277-L281 WeakPolarHBondContact O-CG 3.35Å; K277-L281 PolarHBondContact O-N 3.37Å; K277-E418 IonicContact NZ-OE2 2.82Å; K277-E418 PolarHBondContact NZ-OE2 2.92Å; K277-Y422 HydrophobicContact CB-CD1 4.05Å; K277-Y422 HydrophobicContact CB-CD2 3.81Å; K277-Y422 HydrophobicContact CB-CE1 4.28Å; K277-Y422 HydrophobicContact CB-CE2 4.07Å; K277-Y422 HydrophobicContact CB-CG 3.81Å; K277-Y422 HydrophobicContact CD-CD2 4.18Å; K277-Y422 HydrophobicContact CD-CE2 3.64Å; K277-Y422 HydrophobicContact CG-CD1 4.25Å; K277-Y422 HydrophobicContact CG-CD2 4.1Å; K277-Y422 HydrophobicContact CG-CE1 3.96Å; K277-Y422 HydrophobicContact CG-CE2 3.83Å; K277-Y422 HydrophobicContact CG-CG 4.32Å
278	V	89.4	Confident	88	Confident	20 Å²	20	44.8 Å²	44.8	12%	0.121	24%	0.237	C	C	.	.	H	α-helix	trans	-61.1	-47.6	-179.2	167.4	0	0	0	0	110.5	S274 L275 Y282 V423 L426	S274-V278 VanDerWaalsContact O-CB 3.27Å; S274-V278 WeakPolarHBondContact O-CB 3.5Å; S274-V278 WeakPolarHBondContact O-CG2 3.41Å; S274-V278 PolarHBondContact O-N 2.9Å; L275-V278 PolarHBondContact O-N 3.5Å; V278-Y282 HydrophobicContact CG1-CD2 3.69Å; V278-Y282 HydrophobicContact CG1-CE2 3.76Å; V278-Y282 WeakPolarHBondContact O-CB 3.13Å; V278-Y282 VanDerWaalsContact O-CD2 3.26Å; V278-Y282 WeakPolarHBondContact O-CD2 3.05Å; V278-Y282 PolarHBondContact O-N 3.12Å; V278-V423 HydrophobicContact CG1-CG2 4.09Å; V278-V423 HydrophobicContact CG2-CG2 3.69Å; V278-L426 HydrophobicContact CB-CD1 4.34Å; V278-L426 HydrophobicContact CG2-CD1 3.91Å
279	V	89.6	Confident	88.4	Confident	96 Å²	96	43 Å²	43	58%	0.582	22%	0.222	S	C	*	.	H	α-helix	trans	-62.7	-47.3	177.8	174.7	0	0	0	0	111.1	L275 K277 F283	L275-V279 VanDerWaalsContact O-CG2 3.31Å; L275-V279 WeakPolarHBondContact O-CG2 3.44Å; L275-V279 PolarHBondContact O-N 3.4Å; K277-V279 PolarHBondContact O-N 3.41Å; V279-F283 WeakPolarHBondContact O-CB 3.28Å; V279-F283 PolarHBondContact O-N 2.91Å
280	G	89.3	Confident	88.5	Confident	19 Å²	19	45.3 Å²	45.3	20%	0.196	24%	0.238	C	C	.	.	H	α-helix	trans	-63.4	-46.5	-179.5	0	0	0	0	0	113	V276 K277 F283 F284	V276-G280 PolarHBondContact O-N 3.48Å; K277-G280 PolarHBondContact O-N 2.95Å; G280-F283 WeakPolarHBondContact O-CB 3.43Å; G280-F283 PolarHBondContact O-N 3.12Å; G280-F284 WeakPolarHBondContact O-CD2 3.48Å; G280-F284 PolarHBondContact O-N 3.33Å
281	L	90.6	Very high	88.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.7	-43.6	-179.4	-70.1	168.6	0	0	0	111.9	T167 K277 F283 F284 M285 Y415 E418 V419 Y422	T167-L281 HydrophobicContact CG2-CD2 3.8Å; T167-L281 HydrophobicContact CG2-CG 4.09Å; K277-L281 HydrophobicContact CB-CD1 4.42Å; K277-L281 HydrophobicContact CD-CD1 4.13Å; K277-L281 HydrophobicContact CD-CG 4.46Å; K277-L281 WeakPolarHBondContact O-CB 3.44Å; K277-L281 WeakPolarHBondContact O-CD1 3.2Å; K277-L281 WeakPolarHBondContact O-CG 3.35Å; K277-L281 PolarHBondContact O-N 3.37Å; L281-F283 VanDerWaalsContact C-N 3.29Å; L281-F283 PolarHBondContact O-N 2.88Å; L281-F284 PolarHBondContact O-N 3.2Å; L281-M285 VanDerWaalsContact O-CG 3.27Å; L281-M285 WeakPolarHBondContact O-CG 3.24Å; L281-M285 PolarHBondContact O-N 3.1Å; L281-Y415 HydrophobicContact CD2-CD1 3.44Å; L281-Y415 VanDerWaalsContact CD2-CD1 3.44Å; L281-Y415 HydrophobicContact CD2-CE1 3.98Å; L281-Y415 HydrophobicContact CD2-CG 4.28Å; L281-E418 HydrophobicContact CD1-CB 3.76Å; L281-E418 HydrophobicContact CD2-CB 4.48Å; L281-V419 HydrophobicContact CB-CG2 3.25Å; L281-V419 HydrophobicContact CD1-CB 4.47Å; L281-V419 HydrophobicContact CD1-CG2 3.6Å; L281-V419 HydrophobicContact CG-CG2 4.01Å; L281-Y422 HydrophobicContact CD1-CD2 4Å; L281-Y422 HydrophobicContact CD1-CE2 4.36Å
282	Y	89.4	Confident	88.5	Confident	39 Å²	39	47.3 Å²	47.3	15%	0.153	24%	0.239	C	C	.	.	H	α-helix	trans	-62.3	-38.1	174.4	-85.6	-57.6	0	0	0	112.2	V278 M285 L286 T293 L297 L300 V419 V423	V278-Y282 HydrophobicContact CG1-CD2 3.69Å; V278-Y282 HydrophobicContact CG1-CE2 3.76Å; V278-Y282 WeakPolarHBondContact O-CB 3.13Å; V278-Y282 VanDerWaalsContact O-CD2 3.26Å; V278-Y282 WeakPolarHBondContact O-CD2 3.05Å; V278-Y282 PolarHBondContact O-N 3.12Å; Y282-M285 HydrophobicContact CD1-SD 4.41Å; Y282-M285 PolarHBondContact O-N 2.94Å; Y282-L286 WeakPolarHBondContact O-CB 3.02Å; Y282-L286 VanDerWaalsContact O-CG 3.29Å; Y282-L286 WeakPolarHBondContact O-CG 3.35Å; Y282-L286 PolarHBondContact O-N 3.4Å; Y282-T293 HydrophobicContact CD1-CG2 4.08Å; Y282-T293 HydrophobicContact CE1-CG2 4.49Å; Y282-L297 HydrophobicContact CE1-CD2 4.13Å; Y282-L297 HydrophobicContact CE1-CG 4.24Å; Y282-L300 WeakPolarHBondContact OH-CD1 3.29Å; Y282-V419 HydrophobicContact CD2-CG1 4.4Å; Y282-V419 HydrophobicContact CE1-CG1 4.15Å; Y282-V419 HydrophobicContact CE2-CG1 3.7Å; Y282-V419 WeakPolarHBondContact OH-CG1 3.34Å; Y282-V423 HydrophobicContact CE2-CG2 4.39Å
283	F	90.4	Very high	88.6	Confident	111 Å²	111	45 Å²	45	49%	0.487	23%	0.227	S	C	.	.	H	α-helix	trans	-59.2	-46.3	174.2	176.1	-99.8	0	0	0	111.8	V279 G280 L281 L286 Q287	V279-F283 WeakPolarHBondContact O-CB 3.28Å; V279-F283 PolarHBondContact O-N 2.91Å; G280-F283 WeakPolarHBondContact O-CB 3.43Å; G280-F283 PolarHBondContact O-N 3.12Å; L281-F283 VanDerWaalsContact C-N 3.29Å; L281-F283 PolarHBondContact O-N 2.88Å; F283-L286 PolarHBondContact O-N 3.34Å; F283-Q287 PolarHBondContact O-N 2.95Å
284	F	89.2	Confident	88.5	Confident	15 Å²	15	47.8 Å²	47.8	7%	0.066	24%	0.241	C	C	.	.	H	α-helix	trans	-67.4	-38.6	175.9	-75.6	-66.8	0	0	0	113.1	L168 G280 L281 L286 Q287 V288 Y415	L168-F284 HydrophobicContact CD2-CE1 4.39Å; L168-F284 HydrophobicContact CD2-CZ 4.12Å; G280-F284 WeakPolarHBondContact O-CD2 3.48Å; G280-F284 PolarHBondContact O-N 3.33Å; L281-F284 PolarHBondContact O-N 3.2Å; F284-L286 VanDerWaalsContact C-N 3.35Å; F284-L286 PolarHBondContact O-N 3.47Å; F284-Q287 WeakPolarHBondContact O-CB 3.31Å; F284-Q287 PolarHBondContact O-N 3.36Å; F284-V288 PolarHBondContact O-N 2.9Å; F284-Y415 HydrophobicContact CB-CD2 4.4Å; F284-Y415 HydrophobicContact CB-CE2 3.92Å
285	M	89.4	Confident	88.3	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-62.4	-41.6	176	-71.2	175.2	76	0	0	111.9	L281 Y282 Q287 V288 S289 T293 F412 Y415 Q416 V419	L281-M285 VanDerWaalsContact O-CG 3.27Å; L281-M285 WeakPolarHBondContact O-CG 3.24Å; L281-M285 PolarHBondContact O-N 3.1Å; Y282-M285 HydrophobicContact CD1-SD 4.41Å; Y282-M285 PolarHBondContact O-N 2.94Å; M285-Q287 VanDerWaalsContact C-N 3.3Å; M285-Q287 PolarHBondContact O-N 3.48Å; M285-V288 PolarHBondContact O-N 3.23Å; M285-V288 VanDerWaalsContact O-N 3.15Å; M285-S289 PolarHBondContact O-N 2.94Å; M285-T293 HydrophobicContact CB-CG2 4.22Å; M285-T293 PolarHBondContact O-OG1 3.13Å; M285-T293 VanDerWaalsContact O-OG1 3.09Å; M285-F412 HydrophobicContact CB-CD2 4.36Å; M285-F412 HydrophobicContact CB-CE2 4.01Å; M285-F412 HydrophobicContact CE-CD2 4.2Å; M285-F412 HydrophobicContact CE-CE1 3.95Å; M285-F412 HydrophobicContact CE-CE2 3.49Å; M285-F412 VanDerWaalsContact CE-CE2 3.49Å; M285-F412 HydrophobicContact CE-CZ 3.31Å; M285-F412 HydrophobicContact CG-CD2 4.36Å; M285-F412 HydrophobicContact CG-CE2 4.23Å; M285-Y415 HydrophobicContact CG-CD2 4.28Å; M285-Y415 HydrophobicContact CG-CG 4.29Å; M285-Q416 HydrophobicContact CE-CB 4.07Å; M285-V419 HydrophobicContact SD-CG2 3.8Å
286	L	89.8	Confident	88	Confident	80 Å²	80	45.6 Å²	45.6	42%	0.419	23%	0.23	S	C	.	.	H	α-helix	trans	-63.3	-34.2	175.5	-74.1	171.5	0	0	0	112.6	Y282 F283 F284 V288 T293	Y282-L286 WeakPolarHBondContact O-CB 3.02Å; Y282-L286 VanDerWaalsContact O-CG 3.29Å; Y282-L286 WeakPolarHBondContact O-CG 3.35Å; Y282-L286 PolarHBondContact O-N 3.4Å; F283-L286 PolarHBondContact O-N 3.34Å; F284-L286 VanDerWaalsContact C-N 3.35Å; F284-L286 PolarHBondContact O-N 3.47Å; L286-V288 VanDerWaalsContact C-N 3.35Å; L286-T293 HydrophobicContact CD2-CG2 3.72Å; L286-T293 HydrophobicContact CG-CG2 4.02Å; L286-T293 PolarHBondContact N-OG1 3.42Å
287	Q	88.1	Confident	87.7	Confident	101 Å²	101	47.3 Å²	47.3	47%	0.472	24%	0.238	S	C	.	.	H	α-helix	trans	-67.4	-33.5	174.1	-72.2	-170.5	1	0	0	112.8	R171 F283 F284 M285	R171-Q287 VanDerWaalsContact NH1-OE1 3.12Å; F283-Q287 PolarHBondContact O-N 2.95Å; F284-Q287 WeakPolarHBondContact O-CB 3.31Å; F284-Q287 PolarHBondContact O-N 3.36Å; M285-Q287 VanDerWaalsContact C-N 3.3Å; M285-Q287 PolarHBondContact O-N 3.48Å
288	V	87.1	Confident	87.3	Confident	43 Å²	43	52.2 Å²	52.2	26%	0.261	26%	0.264	S	S	.	.	H	α-helix	trans	-75.7	-58.1	179.6	175.6	0	0	0	0	110.5	F284 M285 L286 V404 G408 F412	F284-V288 PolarHBondContact O-N 2.9Å; M285-V288 PolarHBondContact O-N 3.23Å; M285-V288 VanDerWaalsContact O-N 3.15Å; L286-V288 VanDerWaalsContact C-N 3.35Å; V288-V404 HydrophobicContact CG1-CG1 4.35Å; V288-G408 WeakPolarHBondContact CG1-O 3.2Å; V288-F412 HydrophobicContact CG1-CB 4.32Å; V288-F412 HydrophobicContact CG1-CD2 4.49Å
289	S	88.3	Confident	86.8	Confident	6 Å²	6	52.4 Å²	52.4	4%	0.042	26%	0.264	C	S	.	.			trans	-157	123.6	169.9	74.8	0	0	0	0	112.6	M285 R291 L292 T293 Q398	M285-S289 PolarHBondContact O-N 2.94Å; S289-R291 VanDerWaalsContact C-N 3.28Å; S289-R291 PolarHBondContact O-N 3.13Å; S289-L292 WeakPolarHBondContact OG-CB 3.16Å; S289-L292 VanDerWaalsContact OG-CD1 3.28Å; S289-L292 WeakPolarHBondContact OG-CD1 3.02Å; S289-L292 WeakPolarHBondContact OG-CG 3.05Å; S289-L292 PolarHBondContact OG-N 3.47Å; S289-T293 PolarHBondContact O-N 2.77Å; S289-T293 PolarHBondContact O-OG1 3.31Å; S289-Q398 PolarHBondContact OG-OE1 2.85Å
290	P	86.9	Confident	86.3	Confident	71 Å²	71	49.6 Å²	49.6	46%	0.461	25%	0.246	S	C	.	.	H	α-helix	trans	-61.4	-36.9	175.4	-25.4	34.4	0	0	0	112.6	T293 F294	P290-T293 WeakPolarHBondContact O-CB 3.38Å; P290-T293 PolarHBondContact O-N 3.28Å; P290-F294 HydrophobicContact CB-CE2 4.41Å; P290-F294 WeakPolarHBondContact O-CD2 3.15Å; P290-F294 PolarHBondContact O-N 3.39Å
291	R	84.4	Confident	85.8	Confident	145 Å²	145	51 Å²	51	55%	0.547	25%	0.251	S	S	.	.	H	α-helix	trans	-64.2	-47.1	-176.9	-68.9	-179.8	178.9	165.6	-0.1	112.7	S289 T293 L295 E403	S289-R291 VanDerWaalsContact C-N 3.28Å; S289-R291 PolarHBondContact O-N 3.13Å; R291-T293 VanDerWaalsContact C-N 3.3Å; R291-L295 PolarHBondContact O-N 3.42Å; R291-E403 IonicContact CZ-OE1 3.15Å; R291-E403 IonicContact CZ-OE2 3.9Å; R291-E403 IonicContact NH1-OE1 3.88Å; R291-E403 PolarHBondContact NH1-OE1 3.13Å; R291-E403 IonicContact NH1-OE2 3.97Å; R291-E403 PolarHBondContact NH1-OE2 2.66Å; R291-E403 IonicContact NH2-OE1 3.29Å
292	L	85.6	Confident	85.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-69.9	-32	176.1	-58.2	175	0	0	0	111	S289 L295 S296 C394 L409 F412	S289-L292 WeakPolarHBondContact OG-CB 3.16Å; S289-L292 VanDerWaalsContact OG-CD1 3.28Å; S289-L292 WeakPolarHBondContact OG-CD1 3.02Å; S289-L292 WeakPolarHBondContact OG-CG 3.05Å; S289-L292 PolarHBondContact OG-N 3.47Å; L292-L295 WeakPolarHBondContact O-CB 3.16Å; L292-L295 PolarHBondContact O-N 2.92Å; L292-S296 PolarHBondContact O-N 3.35Å; L292-C394 HydrophobicContact CD2-CB 3.85Å; L292-L409 HydrophobicContact CD1-CD1 3.99Å; L292-F412 HydrophobicContact CB-CD1 4.26Å; L292-F412 HydrophobicContact CB-CD2 4.22Å; L292-F412 HydrophobicContact CB-CE1 3.71Å; L292-F412 HydrophobicContact CB-CE2 3.65Å; L292-F412 HydrophobicContact CB-CZ 3.38Å; L292-F412 HydrophobicContact CD1-CD1 4.3Å; L292-F412 HydrophobicContact CD1-CG 4.34Å; L292-F412 WeakPolarHBondContact O-CZ 3.01Å
293	T	87.8	Confident	84.7	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.012	28%	0.275	C	S	.	.	H	α-helix	trans	-63.2	-46.8	176.5	-53.8	0	0	0	0	112	Y282 M285 L286 S289 P290 R291 L295 S296 L297	Y282-T293 HydrophobicContact CD1-CG2 4.08Å; Y282-T293 HydrophobicContact CE1-CG2 4.49Å; M285-T293 HydrophobicContact CB-CG2 4.22Å; M285-T293 PolarHBondContact O-OG1 3.13Å; M285-T293 VanDerWaalsContact O-OG1 3.09Å; L286-T293 HydrophobicContact CD2-CG2 3.72Å; L286-T293 HydrophobicContact CG-CG2 4.02Å; L286-T293 PolarHBondContact N-OG1 3.42Å; S289-T293 PolarHBondContact O-N 2.77Å; S289-T293 PolarHBondContact O-OG1 3.31Å; P290-T293 WeakPolarHBondContact O-CB 3.38Å; P290-T293 PolarHBondContact O-N 3.28Å; R291-T293 VanDerWaalsContact C-N 3.3Å; T293-L295 VanDerWaalsContact C-N 3.28Å; T293-L295 PolarHBondContact O-N 3.4Å; T293-S296 PolarHBondContact O-N 2.96Å; T293-S296 PolarHBondContact O-OG 3.17Å; T293-L297 PolarHBondContact O-N 3.07Å
294	F	85.3	Confident	84.1	Confident	137 Å²	137	52.4 Å²	52.4	60%	0.601	27%	0.267	S	S	*	.	H	α-helix	trans	-62.7	-34.9	174.5	-74.6	-62.9	0	0	0	113	P290 L297	P290-F294 HydrophobicContact CB-CE2 4.41Å; P290-F294 WeakPolarHBondContact O-CD2 3.15Å; P290-F294 PolarHBondContact O-N 3.39Å; F294-L297 HydrophobicContact CD1-CD1 3.97Å; F294-L297 HydrophobicContact CE1-CD1 4.46Å; F294-L297 WeakPolarHBondContact O-CB 3.4Å; F294-L297 PolarHBondContact O-N 2.9Å
295	L	84.9	Confident	83.6	Confident	34 Å²	34	52.9 Å²	52.9	18%	0.178	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-51.5	172.2	-166.4	61.4	0	0	0	110	R291 L292 T293 L297 L298 M387 L390 I391 C394	R291-L295 PolarHBondContact O-N 3.42Å; L292-L295 WeakPolarHBondContact O-CB 3.16Å; L292-L295 PolarHBondContact O-N 2.92Å; T293-L295 VanDerWaalsContact C-N 3.28Å; T293-L295 PolarHBondContact O-N 3.4Å; L295-L297 PolarHBondContact O-N 3.03Å; L295-L298 HydrophobicContact CD1-CD1 4.22Å; L295-L298 VanDerWaalsContact O-CB 3.28Å; L295-L298 WeakPolarHBondContact O-CB 3.35Å; L295-L298 PolarHBondContact O-N 3.18Å; L295-M387 VanDerWaalsContact C-CE 3.41Å; L295-M387 HydrophobicContact CD1-CE 4.37Å; L295-M387 HydrophobicContact CG-CE 3.84Å; L295-M387 WeakPolarHBondContact O-CE 3.41Å; L295-L390 HydrophobicContact CD1-CD2 3.63Å; L295-L390 HydrophobicContact CD2-CD2 3.95Å; L295-L390 HydrophobicContact CD2-CG 4.47Å; L295-L390 HydrophobicContact CG-CD2 3.97Å; L295-I391 HydrophobicContact CD2-CG1 3.88Å; L295-I391 HydrophobicContact CG-CG1 4.25Å; L295-C394 HydrophobicContact CD2-CB 4.03Å
296	S	83.3	Confident	83.1	Confident	9 Å²	9	54.4 Å²	54.4	6%	0.063	29%	0.286	C	S	.	.	H	α-helix	trans	-59.6	-30.2	178.7	75.3	0	0	0	0	113.8	L292 T293 L298 D299	L292-S296 PolarHBondContact O-N 3.35Å; T293-S296 PolarHBondContact O-N 2.96Å; T293-S296 PolarHBondContact O-OG 3.17Å; S296-L298 PolarHBondContact O-N 3.04Å; S296-D299 VanDerWaalsContact O-CB 3.26Å; S296-D299 WeakPolarHBondContact O-CB 3.27Å; S296-D299 PolarHBondContact O-N 3.3Å; S296-D299 VanDerWaalsContact O-N 3.11Å
297	L	83.6	Confident	82.5	Confident	65 Å²	65	51.2 Å²	51.2	34%	0.34	27%	0.269	S	S	.	.	H	α-helix	trans	-64.2	-23.7	174.9	-83.3	158.6	0	0	0	112.9	Y282 T293 F294 L295 D299 L300 P301	Y282-L297 HydrophobicContact CE1-CD2 4.13Å; Y282-L297 HydrophobicContact CE1-CG 4.24Å; T293-L297 PolarHBondContact O-N 3.07Å; F294-L297 HydrophobicContact CD1-CD1 3.97Å; F294-L297 HydrophobicContact CE1-CD1 4.46Å; F294-L297 WeakPolarHBondContact O-CB 3.4Å; F294-L297 PolarHBondContact O-N 2.9Å; L295-L297 PolarHBondContact O-N 3.03Å; L297-D299 PolarHBondContact O-N 3.45Å; L297-L300 HydrophobicContact CD2-CD1 3.97Å; L297-L300 PolarHBondContact O-N 3.04Å; L297-P301 WeakPolarHBondContact O-CD 3.48Å
298	L	81.1	Confident	81.9	Confident	102 Å²	102	49.2 Å²	49.2	53%	0.534	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.2	174.4	-64.6	174.9	0	0	0	112.9	L295 S296 L300 P301 L302	L295-L298 HydrophobicContact CD1-CD1 4.22Å; L295-L298 VanDerWaalsContact O-CB 3.28Å; L295-L298 WeakPolarHBondContact O-CB 3.35Å; L295-L298 PolarHBondContact O-N 3.18Å; S296-L298 PolarHBondContact O-N 3.04Å; L298-L300 VanDerWaalsContact C-N 3.31Å; L298-L300 PolarHBondContact O-N 3.27Å; L298-P301 VanDerWaalsContact O-CD 3.26Å; L298-P301 WeakPolarHBondContact O-CD 3.39Å; L298-P301 WeakPolarHBondContact O-CG 3.48Å; L298-L302 WeakPolarHBondContact O-CD1 3.29Å
299	D	79.2	Confident	81.6	Confident	25 Å²	25	52.4 Å²	52.4	13%	0.134	28%	0.278	C	S	.	.	H	α-helix	trans	-68.3	-31.5	175.8	-168	48.2	0	0	0	112	S296 L297 L302 T303 M387	S296-D299 VanDerWaalsContact O-CB 3.26Å; S296-D299 WeakPolarHBondContact O-CB 3.27Å; S296-D299 PolarHBondContact O-N 3.3Å; S296-D299 VanDerWaalsContact O-N 3.11Å; L297-D299 PolarHBondContact O-N 3.45Å; D299-L302 PolarHBondContact O-N 2.88Å; D299-T303 WeakPolarHBondContact O-CB 3.3Å; D299-T303 WeakPolarHBondContact O-CG2 3.25Å; D299-T303 PolarHBondContact O-N 3.41Å; D299-T303 PolarHBondContact O-OG1 3.21Å; D299-M387 HydrophobicContact CB-CG 4.13Å
300	L	78.1	Confident	81.3	Confident	36 Å²	36	53.8 Å²	53.8	19%	0.188	28%	0.283	C	S	.	.	H	α-helix	trans	-60.5	-56.4	-179.8	-67.8	-172.4	0	0	0	114.6	Y282 L297 L298 L302 T303 I304 V423	Y282-L300 WeakPolarHBondContact OH-CD1 3.29Å; L297-L300 HydrophobicContact CD2-CD1 3.97Å; L297-L300 PolarHBondContact O-N 3.04Å; L298-L300 VanDerWaalsContact C-N 3.31Å; L298-L300 PolarHBondContact O-N 3.27Å; L300-L302 PolarHBondContact O-N 2.87Å; L300-T303 WeakPolarHBondContact CA-OG1 3.37Å; L300-T303 PolarHBondContact O-N 3.26Å; L300-T303 PolarHBondContact O-OG1 3.44Å; L300-I304 WeakPolarHBondContact O-CB 3.39Å; L300-I304 WeakPolarHBondContact O-CD1 3.17Å; L300-I304 VanDerWaalsContact O-CG1 3.25Å; L300-I304 WeakPolarHBondContact O-CG1 3.07Å; L300-I304 PolarHBondContact O-N 3.43Å; L300-V423 HydrophobicContact CD2-CB 4.09Å; L300-V423 HydrophobicContact CD2-CG1 3.58Å; L300-V423 HydrophobicContact CD2-CG2 4.22Å
301	P	79.1	Confident	81	Confident	48 Å²	48	53 Å²	53	31%	0.312	28%	0.275	S	S	.	.	H	α-helix	trans	-62.5	-32.6	-178.1	24.4	-35.2	0	0	0	112.3	L119 L297 L298 A305	L119-P301 HydrophobicContact CD1-CB 4.45Å; L297-P301 WeakPolarHBondContact O-CD 3.48Å; L298-P301 VanDerWaalsContact O-CD 3.26Å; L298-P301 WeakPolarHBondContact O-CD 3.39Å; L298-P301 WeakPolarHBondContact O-CG 3.48Å; P301-A305 VanDerWaalsContact O-CB 3.32Å; P301-A305 WeakPolarHBondContact O-CB 3.3Å; P301-A305 PolarHBondContact O-N 3.47Å
302	L	79.6	Confident	80.8	Confident	90 Å²	90	49.9 Å²	49.9	47%	0.471	27%	0.273	S	S	.	.	H	α-helix	trans	-71.5	-43.8	178.7	-71.3	153.2	0	0	0	112.2	L298 D299 L300 A305 A306 M383	L298-L302 WeakPolarHBondContact O-CD1 3.29Å; D299-L302 PolarHBondContact O-N 2.88Å; L300-L302 PolarHBondContact O-N 2.87Å; L302-A305 PolarHBondContact O-N 2.68Å; L302-A306 PolarHBondContact O-N 3.41Å; L302-M383 HydrophobicContact CB-CE 3.01Å; L302-M383 HydrophobicContact CB-SD 3.97Å; L302-M383 HydrophobicContact CD1-CE 3.31Å; L302-M383 HydrophobicContact CD2-CE 3.93Å; L302-M383 HydrophobicContact CG-CE 3.54Å
303	T	77.9	Confident	80.7	Confident	29 Å²	29	56.2 Å²	56.2	18%	0.178	30%	0.297	C	S	.	.	H	α-helix	trans	-64.6	-41.8	175.5	49.1	0	0	0	0	111.6	D299 L300 A305 A306 E307	D299-T303 WeakPolarHBondContact O-CB 3.3Å; D299-T303 WeakPolarHBondContact O-CG2 3.25Å; D299-T303 PolarHBondContact O-N 3.41Å; D299-T303 PolarHBondContact O-OG1 3.21Å; L300-T303 WeakPolarHBondContact CA-OG1 3.37Å; L300-T303 PolarHBondContact O-N 3.26Å; L300-T303 PolarHBondContact O-OG1 3.44Å; T303-A305 PolarHBondContact O-N 2.74Å; T303-A306 PolarHBondContact O-N 2.9Å; T303-E307 WeakPolarHBondContact O-CB 3.27Å; T303-E307 WeakPolarHBondContact O-CG 3.2Å; T303-E307 PolarHBondContact O-N 3.47Å
304	I	77.9	Confident	80.5	Confident	62 Å²	62	58 Å²	58	32%	0.318	31%	0.305	S	S	.	.	H	α-helix	trans	-59.7	-44.5	173.5	-69.7	162.7	0	0	0	111.1	L119 L300 E307 K308	L119-I304 HydrophobicContact CD2-CB 4.45Å; L119-I304 HydrophobicContact CD2-CG2 3.98Å; L300-I304 WeakPolarHBondContact O-CB 3.39Å; L300-I304 WeakPolarHBondContact O-CD1 3.17Å; L300-I304 VanDerWaalsContact O-CG1 3.25Å; L300-I304 WeakPolarHBondContact O-CG1 3.07Å; L300-I304 PolarHBondContact O-N 3.43Å; I304-E307 PolarHBondContact O-N 2.92Å; I304-K308 WeakPolarHBondContact O-CB 3.46Å; I304-K308 PolarHBondContact O-N 2.66Å
305	A	77.6	Confident	80.2	Confident	25 Å²	25	57 Å²	57	21%	0.207	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-44.6	178.2	0	0	0	0	0	111.9	V118 P301 L302 T303 K308 V309	V118-A305 HydrophobicContact CG1-CB 4.06Å; P301-A305 VanDerWaalsContact O-CB 3.32Å; P301-A305 WeakPolarHBondContact O-CB 3.3Å; P301-A305 PolarHBondContact O-N 3.47Å; L302-A305 PolarHBondContact O-N 2.68Å; T303-A305 PolarHBondContact O-N 2.74Å; A305-K308 PolarHBondContact O-N 3.04Å; A305-V309 PolarHBondContact O-N 3.39Å
306	A	80	Confident	80.2	Confident	33 Å²	33	57.8 Å²	57.8	27%	0.273	31%	0.314	S	S	.	.	H	α-helix	trans	-63	-44.5	176.7	0	0	0	0	0	112.1	L302 T303 K308 V309 Y310 Y376	L302-A306 PolarHBondContact O-N 3.41Å; T303-A306 PolarHBondContact O-N 2.9Å; A306-K308 VanDerWaalsContact C-N 3.33Å; A306-K308 PolarHBondContact O-N 2.65Å; A306-V309 PolarHBondContact O-N 3.36Å; A306-Y310 PolarHBondContact O-N 2.85Å; A306-Y376 HydrophobicContact CB-CE2 4.27Å
307	E	77.4	Confident	80.4	Confident	13 Å²	13	57.5 Å²	57.5	6%	0.061	31%	0.312	C	S	.	.	H	α-helix	trans	-61.7	-40.3	176.4	-80.7	-179.1	-174.1	0	0	112	T303 I304 V309 Y310 N311 Y376 Y428	T303-E307 WeakPolarHBondContact O-CB 3.27Å; T303-E307 WeakPolarHBondContact O-CG 3.2Å; T303-E307 PolarHBondContact O-N 3.47Å; I304-E307 PolarHBondContact O-N 2.92Å; E307-V309 VanDerWaalsContact C-N 3.32Å; E307-V309 PolarHBondContact O-N 3.49Å; E307-Y310 PolarHBondContact O-N 3.02Å; E307-N311 WeakPolarHBondContact O-CB 3.23Å; E307-N311 PolarHBondContact O-N 2.9Å; E307-Y376 WeakPolarHBondContact CG-OH 3.1Å; E307-Y428 PolarHBondContact OE1-OH 3.2Å
308	K	75.4	Confident	80.4	Confident	58 Å²	58	57.3 Å²	57.3	25%	0.252	31%	0.311	S	S	.	.	H	α-helix	trans	-67.9	-29.4	-178.5	-170.9	171.2	173	-168.3	0	113.8	V118 L119 S120 I304 A305 A306 P312	V118-K308 VanDerWaalsContact O-CD 3.27Å; V118-K308 WeakPolarHBondContact O-CD 3.28Å; V118-K308 WeakPolarHBondContact O-CE 3.46Å; V118-K308 PolarHBondContact O-NZ 2.84Å; L119-K308 PolarHBondContact O-NZ 2.87Å; S120-K308 PolarHBondContact O-NZ 3.38Å; I304-K308 WeakPolarHBondContact O-CB 3.46Å; I304-K308 PolarHBondContact O-N 2.66Å; A305-K308 PolarHBondContact O-N 3.04Å; A306-K308 VanDerWaalsContact C-N 3.33Å; A306-K308 PolarHBondContact O-N 2.65Å; K308-P312 WeakPolarHBondContact O-CD 3.44Å; K308-P312 VanDerWaalsContact O-CG 3.32Å; K308-P312 WeakPolarHBondContact O-CG 3.33Å
309	V	80.2	Confident	80.6	Confident	111 Å²	111	59 Å²	59	67%	0.673	31%	0.314	S	S	*	.	H	α-helix	trans	-74.6	-41.2	172.6	175.7	0	0	0	0	110.8	A305 A306 E307	A305-V309 PolarHBondContact O-N 3.39Å; A306-V309 PolarHBondContact O-N 3.36Å; E307-V309 VanDerWaalsContact C-N 3.32Å; E307-V309 PolarHBondContact O-N 3.49Å
310	Y	82.8	Confident	81.2	Confident	34 Å²	34	61.9 Å²	61.9	13%	0.133	33%	0.327	C	S	.	.	H	α-helix	trans	-74.4	-46.4	-176.4	175	-107	0	0	0	113.5	A306 E307 R313 H314 K373 Y376	A306-Y310 PolarHBondContact O-N 2.85Å; E307-Y310 PolarHBondContact O-N 3.02Å; Y310-R313 PolarHBondContact O-N 2.83Å; Y310-H314 HydrophobicContact CD1-CB 4.32Å; Y310-H314 HydrophobicContact CE1-CB 3.89Å; Y310-H314 AromaticContact CE1-CG 3.92Å; Y310-H314 HydrophobicContact CE2-CB 4.33Å; Y310-H314 AromaticContact CZ-CG 3.88Å; Y310-H314 AromaticContact CZ-ND1 3.78Å; Y310-H314 WeakPolarHBondContact O-CB 3.42Å; Y310-H314 PolarHBondContact O-N 2.81Å; Y310-H314 PolarHBondContact OH-ND1 2.83Å; Y310-K373 WeakPolarHBondContact OH-CA 3.45Å; Y310-K373 WeakPolarHBondContact OH-CB 3.47Å; Y310-Y376 AromaticContact CD1-CD1 3.96Å; Y310-Y376 HydrophobicContact CD1-CD1 3.96Å; Y310-Y376 HydrophobicContact CD1-CD2 4.27Å; Y310-Y376 HydrophobicContact CD1-CE1 4.04Å; Y310-Y376 HydrophobicContact CD1-CE2 4.35Å; Y310-Y376 HydrophobicContact CD1-CG 4.08Å; Y310-Y376 HydrophobicContact CD2-CD1 4.26Å; Y310-Y376 HydrophobicContact CD2-CD2 4.05Å; Y310-Y376 AromaticContact CD2-CG 3.72Å; Y310-Y376 HydrophobicContact CD2-CG 3.72Å; Y310-Y376 AromaticContact CE1-CD1 4Å; Y310-Y376 HydrophobicContact CE1-CD1 4Å; Y310-Y376 HydrophobicContact CE1-CE1 4.26Å; Y310-Y376 HydrophobicContact CE1-CG 4.41Å; Y310-Y376 HydrophobicContact CE2-CD1 4.3Å; Y310-Y376 HydrophobicContact CE2-CG 4.07Å; Y310-Y376 HydrophobicContact CG-CD1 4.09Å; Y310-Y376 AromaticContact CG-CD2 3.74Å; Y310-Y376 HydrophobicContact CG-CD2 3.74Å; Y310-Y376 HydrophobicContact CG-CE1 4.46Å; Y310-Y376 HydrophobicContact CG-CE2 4.13Å; Y310-Y376 AromaticContact CG-CG 3.72Å; Y310-Y376 HydrophobicContact CG-CG 3.72Å
311	N	80.6	Confident	81.8	Confident	55 Å²	55	60.7 Å²	60.7	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-62	-43.8	-166.4	-161.2	30.1	0	0	0	114.3	E307 R313 H314 Q315	E307-N311 WeakPolarHBondContact O-CB 3.23Å; E307-N311 PolarHBondContact O-N 2.9Å; N311-R313 VanDerWaalsContact C-N 3.32Å; N311-R313 PolarHBondContact O-N 3.06Å; N311-H314 PolarHBondContact O-N 3.2Å; N311-Q315 WeakPolarHBondContact O-CB 3Å; N311-Q315 WeakPolarHBondContact O-CG 3.46Å; N311-Q315 PolarHBondContact O-N 3.26Å
312	P	80.1	Confident	82.1	Confident	79 Å²	79	64.8 Å²	64.8	51%	0.513	34%	0.335	S	S	.	.	H	α-helix	trans	-62.9	-39.8	178.2	-21.4	33.2	0	0	0	112.4	K308 Q315 A316	K308-P312 WeakPolarHBondContact O-CD 3.44Å; K308-P312 VanDerWaalsContact O-CG 3.32Å; K308-P312 WeakPolarHBondContact O-CG 3.33Å; P312-Q315 PolarHBondContact O-N 3.25Å; P312-A316 PolarHBondContact O-N 2.8Å
313	R	82.4	Confident	82.7	Confident	133 Å²	133	64.9 Å²	64.9	50%	0.502	34%	0.336	S	S	.	.	H	α-helix	trans	-68.7	-43.2	178.4	-169.9	174.2	176.4	110.3	-3.1	111	Y310 N311 Q315 A316 V317 E372	Y310-R313 PolarHBondContact O-N 2.83Å; N311-R313 VanDerWaalsContact C-N 3.32Å; N311-R313 PolarHBondContact O-N 3.06Å; R313-Q315 VanDerWaalsContact C-N 3.35Å; R313-Q315 PolarHBondContact O-N 3.48Å; R313-A316 PolarHBondContact O-N 2.95Å; R313-V317 WeakPolarHBondContact O-CG2 3.48Å; R313-V317 PolarHBondContact O-N 3.35Å; R313-V317 VanDerWaalsContact O-N 3.1Å; R313-E372 WeakPolarHBondContact CD-OE2 3.45Å; R313-E372 WeakPolarHBondContact CG-OE2 3.18Å; R313-E372 IonicContact CZ-OE1 3.1Å; R313-E372 VanDerWaalsContact CZ-OE1 3.29Å; R313-E372 IonicContact NE-OE1 2.62Å; R313-E372 PolarHBondContact NE-OE1 3.13Å; R313-E372 IonicContact NE-OE2 3.83Å; R313-E372 PolarHBondContact NE-OE2 3.4Å; R313-E372 IonicContact NH2-OE1 3.63Å; R313-E372 PolarHBondContact NH2-OE1 2.98Å
314	H	82.9	Confident	83.4	Confident	40 Å²	40	63.9 Å²	63.9	19%	0.185	33%	0.331	C	S	.	.	H	α-helix	trans	-57.8	-46.4	174.1	-176.8	64.4	0	0	0	111.9	Y310 N311 A316 V317 L318	Y310-H314 HydrophobicContact CD1-CB 4.32Å; Y310-H314 HydrophobicContact CE1-CB 3.89Å; Y310-H314 AromaticContact CE1-CG 3.92Å; Y310-H314 HydrophobicContact CE2-CB 4.33Å; Y310-H314 AromaticContact CZ-CG 3.88Å; Y310-H314 AromaticContact CZ-ND1 3.78Å; Y310-H314 WeakPolarHBondContact O-CB 3.42Å; Y310-H314 PolarHBondContact O-N 2.81Å; Y310-H314 PolarHBondContact OH-ND1 2.83Å; N311-H314 PolarHBondContact O-N 3.2Å; H314-A316 PolarHBondContact O-N 3.37Å; H314-V317 PolarHBondContact O-N 2.87Å; H314-L318 WeakPolarHBondContact NE2-CD1 3.35Å; H314-L318 WeakPolarHBondContact O-CG 3.13Å; H314-L318 PolarHBondContact O-N 2.89Å
315	Q	80	Confident	84.2	Confident	116 Å²	116	64.4 Å²	64.4	54%	0.542	34%	0.337	S	S	.	.	H	α-helix	trans	-63.8	-39.4	177.6	-73.5	-176.4	-0.9	0	0	113	N311 P312 R313 L318 K319	N311-Q315 WeakPolarHBondContact O-CB 3Å; N311-Q315 WeakPolarHBondContact O-CG 3.46Å; N311-Q315 PolarHBondContact O-N 3.26Å; P312-Q315 PolarHBondContact O-N 3.25Å; R313-Q315 VanDerWaalsContact C-N 3.35Å; R313-Q315 PolarHBondContact O-N 3.48Å; Q315-L318 PolarHBondContact O-N 2.9Å; Q315-K319 PolarHBondContact O-N 3.02Å
316	A	84.4	Confident	84.7	Confident	51 Å²	51	65.7 Å²	65.7	42%	0.421	35%	0.348	S	S	.	.	H	α-helix	trans	-61	-47	175.9	0	0	0	0	0	111.8	P312 R313 H314 L318 K319 E320	P312-A316 PolarHBondContact O-N 2.8Å; R313-A316 PolarHBondContact O-N 2.95Å; H314-A316 PolarHBondContact O-N 3.37Å; A316-L318 PolarHBondContact O-N 3.24Å; A316-K319 WeakPolarHBondContact O-CB 3.49Å; A316-K319 PolarHBondContact O-N 3.34Å; A316-E320 PolarHBondContact O-N 3.38Å; A316-E320 VanDerWaalsContact O-N 3.1Å
317	V	87	Confident	85.3	Confident	3 Å²	3	70.9 Å²	70.9	2%	0.018	36%	0.364	C	S	.	.	H	α-helix	trans	-65.8	-38.6	177.5	177.5	0	0	0	0	111.4	R313 H314 K319 E320 I321 R369	R313-V317 WeakPolarHBondContact O-CG2 3.48Å; R313-V317 PolarHBondContact O-N 3.35Å; R313-V317 VanDerWaalsContact O-N 3.1Å; H314-V317 PolarHBondContact O-N 2.87Å; V317-K319 VanDerWaalsContact C-N 3.29Å; V317-K319 PolarHBondContact O-N 3.05Å; V317-E320 PolarHBondContact O-N 3.42Å; V317-I321 HydrophobicContact CG1-CD1 4Å; V317-I321 HydrophobicContact CG1-CG1 4.42Å; V317-I321 VanDerWaalsContact O-CG1 3.31Å; V317-I321 WeakPolarHBondContact O-CG1 3.06Å; V317-I321 PolarHBondContact O-N 2.92Å; V317-R369 HydrophobicContact CG1-CB 3.82Å; V317-R369 HydrophobicContact CG1-CG 4.44Å
318	L	85.1	Confident	86.1	Confident	60 Å²	60	70.6 Å²	70.6	31%	0.314	36%	0.364	S	S	.	.	H	α-helix	trans	-60.4	-39.2	174.9	-78	176.5	0	0	0	112.3	H314 Q315 A316 I321 Q322	H314-L318 WeakPolarHBondContact NE2-CD1 3.35Å; H314-L318 WeakPolarHBondContact O-CG 3.13Å; H314-L318 PolarHBondContact O-N 2.89Å; Q315-L318 PolarHBondContact O-N 2.9Å; A316-L318 PolarHBondContact O-N 3.24Å; L318-I321 PolarHBondContact O-N 3.45Å; L318-Q322 WeakPolarHBondContact O-CG 3.24Å; L318-Q322 PolarHBondContact O-N 2.95Å
319	K	85.1	Confident	87	Confident	139 Å²	139	69.2 Å²	69.2	60%	0.604	37%	0.366	S	S	*	.	H	α-helix	trans	-65.4	-45.3	176	-169.2	178.4	179.5	-178.5	0	111.5	Q315 A316 V317 I321 Q322 D323	Q315-K319 PolarHBondContact O-N 3.02Å; A316-K319 WeakPolarHBondContact O-CB 3.49Å; A316-K319 PolarHBondContact O-N 3.34Å; V317-K319 VanDerWaalsContact C-N 3.29Å; V317-K319 PolarHBondContact O-N 3.05Å; K319-I321 VanDerWaalsContact C-N 3.28Å; K319-I321 PolarHBondContact O-N 2.97Å; K319-Q322 PolarHBondContact O-N 3.45Å; K319-Q322 VanDerWaalsContact O-N 3.15Å; K319-D323 PolarHBondContact O-N 3.14Å
320	E	91.4	Very high	87.6	Confident	85 Å²	85	68.4 Å²	68.4	40%	0.397	36%	0.355	S	S	.	.	H	α-helix	trans	-59.1	-39.3	174.3	-69.2	177.3	-162.2	0	0	112.1	A316 V317 D323 A324 L365	A316-E320 PolarHBondContact O-N 3.38Å; A316-E320 VanDerWaalsContact O-N 3.1Å; V317-E320 PolarHBondContact O-N 3.42Å; E320-D323 PolarHBondContact O-N 3.41Å; E320-A324 WeakPolarHBondContact O-CB 3.42Å; E320-A324 PolarHBondContact O-N 3.41Å; E320-L365 HydrophobicContact CB-CD1 4.17Å; E320-L365 HydrophobicContact CB-CD2 4.18Å; E320-L365 WeakPolarHBondContact OE2-CD2 3.44Å
321	I	91.7	Very high	88.2	Confident	10 Å²	10	67.4 Å²	67.4	5%	0.051	35%	0.352	C	S	.	.	H	α-helix	trans	-63.3	-45.3	175	-71.6	168.6	0	0	0	110.9	V317 L318 K319 D323 A324 V325 L365 W366 R369	V317-I321 HydrophobicContact CG1-CD1 4Å; V317-I321 HydrophobicContact CG1-CG1 4.42Å; V317-I321 VanDerWaalsContact O-CG1 3.31Å; V317-I321 WeakPolarHBondContact O-CG1 3.06Å; V317-I321 PolarHBondContact O-N 2.92Å; L318-I321 PolarHBondContact O-N 3.45Å; K319-I321 VanDerWaalsContact C-N 3.28Å; K319-I321 PolarHBondContact O-N 2.97Å; I321-D323 VanDerWaalsContact C-N 3.33Å; I321-D323 PolarHBondContact O-N 3.45Å; I321-A324 PolarHBondContact O-N 3.4Å; I321-V325 HydrophobicContact CG2-CG2 4.22Å; I321-V325 WeakPolarHBondContact O-CB 3.36Å; I321-V325 VanDerWaalsContact O-CG2 3.3Å; I321-V325 WeakPolarHBondContact O-CG2 3.42Å; I321-V325 PolarHBondContact O-N 2.95Å; I321-L365 HydrophobicContact CD1-CB 4.45Å; I321-L365 HydrophobicContact CG1-CB 3.65Å; I321-L365 HydrophobicContact CG1-CD1 4.44Å; I321-W366 HydrophobicContact CG2-CZ2 4.2Å; I321-R369 HydrophobicContact CD1-CB 3.99Å; I321-R369 HydrophobicContact CD1-CG 4.31Å
322	Q	85.4	Confident	88.9	Confident	135 Å²	135	67.7 Å²	67.7	63%	0.631	36%	0.356	S	S	*	.	H	α-helix	trans	-59.4	-44.1	177.8	-74.4	177.3	1.5	0	0	111.6	L318 K319 V325 A326	L318-Q322 WeakPolarHBondContact O-CG 3.24Å; L318-Q322 PolarHBondContact O-N 2.95Å; K319-Q322 PolarHBondContact O-N 3.45Å; K319-Q322 VanDerWaalsContact O-N 3.15Å; Q322-V325 PolarHBondContact O-N 3.26Å; Q322-A326 WeakPolarHBondContact O-CB 3.3Å; Q322-A326 PolarHBondContact O-N 2.91Å
323	D	91.4	Very high	89.5	Confident	91 Å²	91	72.1 Å²	72.1	49%	0.487	36%	0.363	S	S	.	.	H	α-helix	trans	-64.4	-40.6	177.5	-68.7	-24.4	0	0	0	111.9	K319 E320 I321 A326 K327	K319-D323 PolarHBondContact O-N 3.14Å; E320-D323 PolarHBondContact O-N 3.41Å; I321-D323 VanDerWaalsContact C-N 3.33Å; I321-D323 PolarHBondContact O-N 3.45Å; D323-A326 PolarHBondContact O-N 3.2Å; D323-K327 WeakPolarHBondContact O-CG 3.36Å; D323-K327 PolarHBondContact O-N 3.33Å; D323-K327 VanDerWaalsContact O-N 3.1Å
324	A	93.3	Very high	90	Very high	9 Å²	9	69.9 Å²	69.9	7%	0.074	36%	0.358	C	S	.	.	H	α-helix	trans	-66.2	-43.1	176.9	0	0	0	0	0	112.4	E320 I321 K327 A328 L365	E320-A324 WeakPolarHBondContact O-CB 3.42Å; E320-A324 PolarHBondContact O-N 3.41Å; I321-A324 PolarHBondContact O-N 3.4Å; A324-K327 PolarHBondContact O-N 3.15Å; A324-A328 PolarHBondContact O-N 3.45Å; A324-L365 HydrophobicContact CB-CD1 3.72Å
325	V	93.2	Very high	90.4	Very high	72 Å²	72	68.9 Å²	68.9	44%	0.436	36%	0.356	S	S	.	.	H	α-helix	trans	-64.9	-40	176	171	0	0	0	0	111	I321 Q322 K327 A328 G329	I321-V325 HydrophobicContact CG2-CG2 4.22Å; I321-V325 WeakPolarHBondContact O-CB 3.36Å; I321-V325 VanDerWaalsContact O-CG2 3.3Å; I321-V325 WeakPolarHBondContact O-CG2 3.42Å; I321-V325 PolarHBondContact O-N 2.95Å; Q322-V325 PolarHBondContact O-N 3.26Å; V325-K327 VanDerWaalsContact C-N 3.32Å; V325-K327 PolarHBondContact O-N 2.93Å; V325-A328 PolarHBondContact O-N 3.41Å; V325-G329 PolarHBondContact O-N 3.23Å
326	A	89.5	Confident	91.1	Very high	53 Å²	53	68 Å²	68	44%	0.438	36%	0.359	S	S	.	.	H	α-helix	trans	-61.5	-40.4	176.2	0	0	0	0	0	112.1	Q322 D323 G329 Q330	Q322-A326 WeakPolarHBondContact O-CB 3.3Å; Q322-A326 PolarHBondContact O-N 2.91Å; D323-A326 PolarHBondContact O-N 3.2Å; A326-G329 PolarHBondContact O-N 3.26Å; A326-Q330 PolarHBondContact O-N 3.04Å
327	K	92.8	Very high	91.4	Very high	142 Å²	142	69 Å²	69	62%	0.617	37%	0.374	S	S	*	.	H	α-helix	trans	-64	-45.7	173.6	-73.8	176.5	-179.1	-179.4	0	112.2	D323 A324 V325 G329 Q330 V331	D323-K327 WeakPolarHBondContact O-CG 3.36Å; D323-K327 PolarHBondContact O-N 3.33Å; D323-K327 VanDerWaalsContact O-N 3.1Å; A324-K327 PolarHBondContact O-N 3.15Å; V325-K327 VanDerWaalsContact C-N 3.32Å; V325-K327 PolarHBondContact O-N 2.93Å; K327-G329 VanDerWaalsContact C-N 3.33Å; K327-G329 PolarHBondContact O-N 3.42Å; K327-Q330 WeakPolarHBondContact O-CB 3.45Å; K327-Q330 PolarHBondContact O-N 3.48Å; K327-Q330 VanDerWaalsContact O-N 3.11Å; K327-V331 PolarHBondContact O-N 3.42Å; K327-V331 VanDerWaalsContact O-N 3.16Å
328	A	94.4	Very high	91.7	Very high	6 Å²	6	69.9 Å²	69.9	5%	0.05	38%	0.383	C	S	.	.	H	α-helix	trans	-60.2	-43.2	175.9	0	0	0	0	0	111.7	A324 V325 Q330 V331 V332 Y355 A358	A324-A328 PolarHBondContact O-N 3.45Å; V325-A328 PolarHBondContact O-N 3.41Å; A328-Q330 VanDerWaalsContact C-N 3.3Å; A328-Q330 PolarHBondContact O-N 3.26Å; A328-V331 PolarHBondContact O-N 3.47Å; A328-V332 PolarHBondContact O-N 2.85Å; A328-Y355 HydrophobicContact CB-CE2 4.18Å; A328-A358 HydrophobicContact CB-CB 3.95Å
329	G	93.3	Very high	92.2	Very high	30 Å²	30	70.8 Å²	70.8	31%	0.309	39%	0.388	S	S	.	.	H	α-helix	trans	-66.7	-27.3	174.7	0	0	0	0	0	113.9	V325 A326 K327 R333	V325-G329 PolarHBondContact O-N 3.23Å; A326-G329 PolarHBondContact O-N 3.26Å; K327-G329 VanDerWaalsContact C-N 3.33Å; K327-G329 PolarHBondContact O-N 3.42Å; G329-R333 WeakPolarHBondContact O-CG 3.36Å; G329-R333 PolarHBondContact O-N 2.96Å; G329-R333 VanDerWaalsContact O-N 3.11Å; G329-R333 PolarHBondContact O-NE 3.38Å
330	Q	93	Very high	92.6	Very high	94 Å²	94	72.3 Å²	72.3	44%	0.439	40%	0.398	S	S	.	.	H	α-helix	trans	-66.7	-45.6	172.1	-178	179.1	-10.4	0	0	111.6	A326 K327 A328 V332 R333 E334	A326-Q330 PolarHBondContact O-N 3.04Å; K327-Q330 WeakPolarHBondContact O-CB 3.45Å; K327-Q330 PolarHBondContact O-N 3.48Å; K327-Q330 VanDerWaalsContact O-N 3.11Å; A328-Q330 VanDerWaalsContact C-N 3.3Å; A328-Q330 PolarHBondContact O-N 3.26Å; Q330-V332 VanDerWaalsContact C-N 3.29Å; Q330-V332 PolarHBondContact O-N 2.99Å; Q330-R333 PolarHBondContact O-N 2.76Å; Q330-R333 VanDerWaalsContact O-N 3.14Å; Q330-E334 HydrophobicContact CG-CG 4.47Å; Q330-E334 VanDerWaalsContact CG-OE1 3.27Å; Q330-E334 WeakPolarHBondContact CG-OE1 3.36Å; Q330-E334 PolarHBondContact NE2-OE1 3.47Å; Q330-E334 WeakPolarHBondContact O-CG 3.33Å; Q330-E334 PolarHBondContact O-N 3.49Å
331	V	94.4	Very high	92.8	Very high	12 Å²	12	72.2 Å²	72.2	7%	0.073	40%	0.403	C	S	.	.	H	α-helix	trans	-55.5	-46.4	176.5	178.2	0	0	0	0	110.8	K327 A328 R333 E334 A335 R354	K327-V331 PolarHBondContact O-N 3.42Å; K327-V331 VanDerWaalsContact O-N 3.16Å; A328-V331 PolarHBondContact O-N 3.47Å; V331-R333 PolarHBondContact O-N 3.01Å; V331-E334 PolarHBondContact O-N 2.83Å; V331-A335 WeakPolarHBondContact O-CB 3.32Å; V331-A335 PolarHBondContact O-N 2.93Å; V331-R354 HydrophobicContact CG1-CB 4.4Å; V331-R354 HydrophobicContact CG1-CG 3.98Å; V331-R354 HydrophobicContact CG2-CG 4.26Å
332	V	95.6	Very high	93.1	Very high	61 Å²	61	72.5 Å²	72.5	37%	0.37	41%	0.405	S	S	.	.	H	α-helix	trans	-62	-44.4	177.8	176.7	0	0	0	0	111.8	A328 Q330 E334 A335 V336 Y355	A328-V332 PolarHBondContact O-N 2.85Å; Q330-V332 VanDerWaalsContact C-N 3.29Å; Q330-V332 PolarHBondContact O-N 2.99Å; V332-E334 VanDerWaalsContact C-N 3.31Å; V332-E334 PolarHBondContact O-N 3.19Å; V332-A335 PolarHBondContact O-N 2.9Å; V332-V336 HydrophobicContact CG1-CG2 4.05Å; V332-V336 WeakPolarHBondContact O-CB 3.25Å; V332-V336 WeakPolarHBondContact O-CG2 3.37Å; V332-V336 PolarHBondContact O-N 3.34Å; V332-Y355 HydrophobicContact CG2-CD2 3.76Å; V332-Y355 HydrophobicContact CG2-CE2 3.47Å; V332-Y355 VanDerWaalsContact CG2-CE2 3.47Å
333	R	92.4	Very high	93.6	Very high	173 Å²	173	74.3 Å²	74.3	65%	0.653	41%	0.406	S	S	*	.	H	α-helix	trans	-62.9	-38.6	179.2	-77.8	-178.7	-67	-157.3	1	112.3	G329 Q330 V331 G337	G329-R333 WeakPolarHBondContact O-CG 3.36Å; G329-R333 PolarHBondContact O-N 2.96Å; G329-R333 VanDerWaalsContact O-N 3.11Å; G329-R333 PolarHBondContact O-NE 3.38Å; Q330-R333 PolarHBondContact O-N 2.76Å; Q330-R333 VanDerWaalsContact O-N 3.14Å; V331-R333 PolarHBondContact O-N 3.01Å; R333-G337 WeakPolarHBondContact O-CA 3.42Å; R333-G337 PolarHBondContact O-N 3.43Å
334	E	93	Very high	93.8	Very high	86 Å²	86	74 Å²	74	40%	0.402	41%	0.411	S	S	.	.	H	α-helix	trans	-69	-48.3	176.6	-71.4	172.7	-165.4	0	0	111.3	Q330 V331 V332 G338 R354	Q330-E334 HydrophobicContact CG-CG 4.47Å; Q330-E334 VanDerWaalsContact CG-OE1 3.27Å; Q330-E334 WeakPolarHBondContact CG-OE1 3.36Å; Q330-E334 PolarHBondContact NE2-OE1 3.47Å; Q330-E334 WeakPolarHBondContact O-CG 3.33Å; Q330-E334 PolarHBondContact O-N 3.49Å; V331-E334 PolarHBondContact O-N 2.83Å; V332-E334 VanDerWaalsContact C-N 3.31Å; V332-E334 PolarHBondContact O-N 3.19Å; E334-G338 PolarHBondContact O-N 3.29Å; E334-R354 IonicContact OE2-CZ 2.74Å; E334-R354 IonicContact OE2-NH1 3.41Å; E334-R354 PolarHBondContact OE2-NH1 3.45Å; E334-R354 IonicContact OE2-NH2 3.6Å; E334-R354 PolarHBondContact OE2-NH2 3.37Å
335	A	93.2	Very high	94	Very high	19 Å²	19	81.6 Å²	81.6	16%	0.157	44%	0.443	C	S	.	.	H	α-helix	trans	-65.3	-44.1	-179.1	0	0	0	0	0	112.8	V331 V332 G338 L339 E351	V331-A335 WeakPolarHBondContact O-CB 3.32Å; V331-A335 PolarHBondContact O-N 2.93Å; V332-A335 PolarHBondContact O-N 2.9Å; A335-G338 CarbonylContact O-C 3.39Å; A335-L339 WeakPolarHBondContact O-CA 3.3Å; A335-L339 PolarHBondContact O-N 3.15Å; A335-L339 VanDerWaalsContact O-N 3.07Å; A335-E351 HydrophobicContact CB-CB 4.27Å; A335-E351 HydrophobicContact CB-CG 4.16Å
336	V	93.5	Very high	94.1	Very high	97 Å²	97	80.8 Å²	80.8	59%	0.588	45%	0.449	S	S	*	.	H	α-helix	trans	-74	-40.5	178.6	176.5	0	0	0	0	111.2	V332 G338 L339	V332-V336 HydrophobicContact CG1-CG2 4.05Å; V332-V336 WeakPolarHBondContact O-CB 3.25Å; V332-V336 WeakPolarHBondContact O-CG2 3.37Å; V332-V336 PolarHBondContact O-N 3.34Å; V336-G338 PolarHBondContact O-N 3.07Å; V336-L339 WeakPolarHBondContact O-CB 3.36Å; V336-L339 PolarHBondContact O-N 3.22Å
337	G	91.4	Very high	94.4	Very high	72 Å²	72	79.2 Å²	79.2	74%	0.742	44%	0.436	S	S	*	.	H	α-helix	trans	-63.5	-31.5	175.7	0	0	0	0	0	112.7	R333	R333-G337 WeakPolarHBondContact O-CA 3.42Å; R333-G337 PolarHBondContact O-N 3.43Å
338	G	93.3	Very high	94.6	Very high	21 Å²	21	76.7 Å²	76.7	22%	0.216	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	23.7	175	0	0	0	0	0	114.2	E334 A335 V336 Q340 T341 V342	E334-G338 PolarHBondContact O-N 3.29Å; A335-G338 CarbonylContact O-C 3.39Å; V336-G338 PolarHBondContact O-N 3.07Å; G338-Q340 PolarHBondContact O-N 3.45Å; G338-Q340 VanDerWaalsContact O-N 3.13Å; G338-T341 CarbonylContact O-C 3.5Å; G338-T341 WeakPolarHBondContact O-CA 3.43Å; G338-T341 VanDerWaalsContact O-CB 3.25Å; G338-T341 WeakPolarHBondContact O-CB 3.29Å; G338-T341 PolarHBondContact O-N 2.97Å; G338-V342 PolarHBondContact O-N 3.22Å
339	L	94.3	Very high	94.7	Very high	80 Å²	80	84.6 Å²	84.6	42%	0.419	46%	0.462	S	S	.	.	H	α-helix	trans	-57.2	-35.3	-170.7	-176.3	64.1	0	0	0	113.2	A335 V336 T341 V342 R343	A335-L339 WeakPolarHBondContact O-CA 3.3Å; A335-L339 PolarHBondContact O-N 3.15Å; A335-L339 VanDerWaalsContact O-N 3.07Å; V336-L339 WeakPolarHBondContact O-CB 3.36Å; V336-L339 PolarHBondContact O-N 3.22Å; L339-T341 VanDerWaalsContact C-N 3.33Å; L339-V342 PolarHBondContact O-N 3.28Å; L339-R343 HydrophobicContact CD1-CG 4.44Å; L339-R343 WeakPolarHBondContact O-CB 3.31Å; L339-R343 WeakPolarHBondContact O-CG 3.16Å; L339-R343 PolarHBondContact O-N 3.27Å
340	Q	94.3	Very high	94.8	Very high	171 Å²	171	89.8 Å²	89.8	80%	0.799	48%	0.479	S	S	*	.	H	α-helix	trans	-61.5	-42.4	174.3	-174.8	177.2	5	0	0	111.5	G338 S344	G338-Q340 PolarHBondContact O-N 3.45Å; G338-Q340 VanDerWaalsContact O-N 3.13Å; Q340-S344 VanDerWaalsContact O-CB 3.29Å; Q340-S344 WeakPolarHBondContact O-CB 3.19Å; Q340-S344 PolarHBondContact O-N 3.49Å; Q340-S344 PolarHBondContact O-OG 3.13Å
341	T	96.6	Very high	95	Very high	82 Å²	82	87.3 Å²	87.3	50%	0.503	47%	0.467	S	S	.	.	H	α-helix	trans	-65.6	-47.6	175.1	-50.1	0	0	0	0	110.9	G338 L339 R343 S344 F345	G338-T341 CarbonylContact O-C 3.5Å; G338-T341 WeakPolarHBondContact O-CA 3.43Å; G338-T341 VanDerWaalsContact O-CB 3.25Å; G338-T341 WeakPolarHBondContact O-CB 3.29Å; G338-T341 PolarHBondContact O-N 2.97Å; L339-T341 VanDerWaalsContact C-N 3.33Å; T341-R343 VanDerWaalsContact C-N 3.26Å; T341-R343 PolarHBondContact O-N 2.99Å; T341-S344 WeakPolarHBondContact CA-OG 3.4Å; T341-S344 PolarHBondContact O-N 2.93Å; T341-S344 PolarHBondContact O-OG 3Å; T341-F345 HydrophobicContact CG2-CD2 3.67Å; T341-F345 HydrophobicContact CG2-CE2 3.84Å; T341-F345 VanDerWaalsContact O-CD2 3.27Å; T341-F345 WeakPolarHBondContact O-CD2 3.34Å; T341-F345 PolarHBondContact O-N 2.93Å
342	V	96.9	Very high	95.1	Very high	17 Å²	17	91.3 Å²	91.3	10%	0.103	49%	0.491	C	S	.	.	H	α-helix	trans	-56.1	-45.4	178.2	177.1	0	0	0	0	110.4	G338 L339 G346 A347 E348 E351	G338-V342 PolarHBondContact O-N 3.22Å; L339-V342 PolarHBondContact O-N 3.28Å; V342-G346 PolarHBondContact O-N 2.95Å; V342-A347 HydrophobicContact CG1-CB 4.4Å; V342-A347 PolarHBondContact O-N 3.1Å; V342-E348 HydrophobicContact CG1-CG 4.16Å; V342-E351 HydrophobicContact CG1-CG 4.39Å; V342-E351 HydrophobicContact CG2-CG 4.22Å
343	R	95.9	Very high	95.1	Very high	173 Å²	173	91.2 Å²	91.2	65%	0.653	49%	0.493	S	S	*	.	H	α-helix	trans	-69.7	-39.5	176.9	-74.3	-172.7	173.2	-171.6	-0.6	113.6	L339 T341 F345 G346	L339-R343 HydrophobicContact CD1-CG 4.44Å; L339-R343 WeakPolarHBondContact O-CB 3.31Å; L339-R343 WeakPolarHBondContact O-CG 3.16Å; L339-R343 PolarHBondContact O-N 3.27Å; T341-R343 VanDerWaalsContact C-N 3.26Å; T341-R343 PolarHBondContact O-N 2.99Å; R343-F345 PolarHBondContact O-N 3.33Å; R343-G346 PolarHBondContact O-N 3.46Å
344	S	96.5	Very high	95.3	Very high	85 Å²	85	87.4 Å²	87.4	59%	0.594	48%	0.479	S	S	*	.	H	α-helix	trans	-67.1	-26.2	-179.9	68.3	0	0	0	0	112.4	Q340 T341	Q340-S344 VanDerWaalsContact O-CB 3.29Å; Q340-S344 WeakPolarHBondContact O-CB 3.19Å; Q340-S344 PolarHBondContact O-N 3.49Å; Q340-S344 PolarHBondContact O-OG 3.13Å; T341-S344 WeakPolarHBondContact CA-OG 3.4Å; T341-S344 PolarHBondContact O-N 2.93Å; T341-S344 PolarHBondContact O-OG 3Å
345	F	96.3	Very high	95.4	Very high	167 Å²	167	87.6 Å²	87.6	73%	0.732	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	-0.3	177.2	-72.6	-83.5	0	0	0	113.8	T341 R343 A347	T341-F345 HydrophobicContact CG2-CD2 3.67Å; T341-F345 HydrophobicContact CG2-CE2 3.84Å; T341-F345 VanDerWaalsContact O-CD2 3.27Å; T341-F345 WeakPolarHBondContact O-CD2 3.34Å; T341-F345 PolarHBondContact O-N 2.93Å; R343-F345 PolarHBondContact O-N 3.33Å; F345-A347 VanDerWaalsContact C-N 3.28Å; F345-A347 PolarHBondContact O-N 3.28Å
346	G	95.5	Very high	95.6	Very high	55 Å²	55	93.9 Å²	93.9	57%	0.567	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	33.6	-179.2	0	0	0	0	0	114.2	V342 R343 E348	V342-G346 PolarHBondContact O-N 2.95Å; R343-G346 PolarHBondContact O-N 3.46Å; G346-E348 VanDerWaalsContact CA-OE2 3.29Å; G346-E348 WeakPolarHBondContact CA-OE2 3.27Å
347	A	96	Very high	95.8	Very high	20 Å²	20	95.6 Å²	95.6	17%	0.165	50%	0.502	C	S	.	.			trans	-93.9	18.4	-170.3	0	0	0	0	0	114	V342 F345 E349 Q350 E351	V342-A347 HydrophobicContact CG1-CB 4.4Å; V342-A347 PolarHBondContact O-N 3.1Å; F345-A347 VanDerWaalsContact C-N 3.28Å; F345-A347 PolarHBondContact O-N 3.28Å; A347-E349 PolarHBondContact O-N 2.99Å; A347-Q350 PolarHBondContact O-N 2.87Å; A347-E351 PolarHBondContact O-N 2.9Å
348	E	96.1	Very high	95.9	Very high	89 Å²	89	93.1 Å²	93.1	42%	0.416	47%	0.474	S	S	.	.	H	α-helix	trans	-58.9	-45.6	-174.1	-66.4	87.7	165.5	0	0	112.7	V342 G346 Q350 E351 V352	V342-E348 HydrophobicContact CG1-CG 4.16Å; G346-E348 VanDerWaalsContact CA-OE2 3.29Å; G346-E348 WeakPolarHBondContact CA-OE2 3.27Å; E348-Q350 VanDerWaalsContact C-N 3.31Å; E348-Q350 PolarHBondContact O-N 3.48Å; E348-E351 PolarHBondContact O-N 3.5Å; E348-V352 VanDerWaalsContact O-CG2 3.3Å; E348-V352 WeakPolarHBondContact O-CG2 3.3Å; E348-V352 PolarHBondContact O-N 2.94Å
349	E	96.8	Very high	96.1	Very high	173 Å²	173	95.7 Å²	95.7	81%	0.808	48%	0.483	S	S	*	.	H	α-helix	trans	-65.9	-34.3	179.9	-68.1	-151	159.3	0	0	112.8	A347 V352 S353	A347-E349 PolarHBondContact O-N 2.99Å; E349-V352 PolarHBondContact O-N 3.01Å; E349-S353 PolarHBondContact O-N 2.89Å
350	Q	95.7	Very high	96.2	Very high	139 Å²	139	95.7 Å²	95.7	65%	0.65	48%	0.481	S	S	*	.	H	α-helix	trans	-65.6	-45.5	178.4	-174.2	177.6	4.3	0	0	111	A347 E348 V352 S353 R354	A347-Q350 PolarHBondContact O-N 2.87Å; E348-Q350 VanDerWaalsContact C-N 3.31Å; E348-Q350 PolarHBondContact O-N 3.48Å; Q350-V352 VanDerWaalsContact C-N 3.34Å; Q350-S353 PolarHBondContact O-N 3.24Å; Q350-R354 WeakPolarHBondContact O-CB 3.09Å; Q350-R354 PolarHBondContact O-N 3.45Å
351	E	96.4	Very high	96.2	Very high	41 Å²	41	95.2 Å²	95.2	19%	0.192	47%	0.471	C	S	.	.	H	α-helix	trans	-67.1	-34.9	176.7	-70.7	-59.5	154.6	0	0	112	A335 V342 A347 E348 R354 Y355	A335-E351 HydrophobicContact CB-CB 4.27Å; A335-E351 HydrophobicContact CB-CG 4.16Å; V342-E351 HydrophobicContact CG1-CG 4.39Å; V342-E351 HydrophobicContact CG2-CG 4.22Å; A347-E351 PolarHBondContact O-N 2.9Å; E348-E351 PolarHBondContact O-N 3.5Å; E351-R354 PolarHBondContact O-N 2.99Å; E351-R354 IonicContact OE1-NH1 3.59Å; E351-R354 IonicContact OE2-NH1 2.78Å; E351-R354 PolarHBondContact OE2-NH1 3.23Å; E351-Y355 WeakPolarHBondContact O-CB 3.15Å; E351-Y355 PolarHBondContact O-N 2.72Å
352	V	96.6	Very high	96.1	Very high	97 Å²	97	91.9 Å²	91.9	59%	0.588	45%	0.451	S	S	*	.	H	α-helix	trans	-62.6	-44.4	172.2	170.1	0	0	0	0	111.3	E348 E349 Q350 Y355 K356	E348-V352 VanDerWaalsContact O-CG2 3.3Å; E348-V352 WeakPolarHBondContact O-CG2 3.3Å; E348-V352 PolarHBondContact O-N 2.94Å; E349-V352 PolarHBondContact O-N 3.01Å; Q350-V352 VanDerWaalsContact C-N 3.34Å; V352-Y355 PolarHBondContact O-N 3.13Å; V352-K356 WeakPolarHBondContact O-CB 2.9Å; V352-K356 PolarHBondContact O-N 2.89Å
353	S	96.9	Very high	96.1	Very high	59 Å²	59	98.8 Å²	98.8	41%	0.413	48%	0.475	S	S	.	.	H	α-helix	trans	-62.1	-45.6	176.8	-170.3	0	0	0	0	111.7	E349 Q350 Y355 K356 E357	E349-S353 PolarHBondContact O-N 2.89Å; Q350-S353 PolarHBondContact O-N 3.24Å; S353-Y355 VanDerWaalsContact C-N 3.3Å; S353-Y355 PolarHBondContact O-N 3.07Å; S353-K356 WeakPolarHBondContact O-CB 3.29Å; S353-K356 PolarHBondContact O-N 2.86Å; S353-K356 VanDerWaalsContact O-N 3.11Å; S353-E357 PolarHBondContact O-N 2.83Å
354	R	95.8	Very high	96.1	Very high	92 Å²	92	95.6 Å²	95.6	35%	0.347	47%	0.468	S	S	.	.	H	α-helix	trans	-59.4	-40.6	177.1	-174.5	-177.9	165.9	-156.8	-3.6	112	V331 E334 Q350 E351 A358	V331-R354 HydrophobicContact CG1-CB 4.4Å; V331-R354 HydrophobicContact CG1-CG 3.98Å; V331-R354 HydrophobicContact CG2-CG 4.26Å; E334-R354 IonicContact OE2-CZ 2.74Å; E334-R354 IonicContact OE2-NH1 3.41Å; E334-R354 PolarHBondContact OE2-NH1 3.45Å; E334-R354 IonicContact OE2-NH2 3.6Å; E334-R354 PolarHBondContact OE2-NH2 3.37Å; Q350-R354 WeakPolarHBondContact O-CB 3.09Å; Q350-R354 PolarHBondContact O-N 3.45Å; E351-R354 PolarHBondContact O-N 2.99Å; E351-R354 IonicContact OE1-NH1 3.59Å; E351-R354 IonicContact OE2-NH1 2.78Å; E351-R354 PolarHBondContact OE2-NH1 3.23Å; R354-A358 PolarHBondContact O-N 2.71Å
355	Y	96.5	Very high	96	Very high	91 Å²	91	92.4 Å²	92.4	36%	0.357	44%	0.444	S	S	.	.	H	α-helix	trans	-67.8	-39.8	174.7	-175.5	-120.4	0	0	0	112.3	A328 V332 E351 V352 S353 E357 A358 L359	A328-Y355 HydrophobicContact CB-CE2 4.18Å; V332-Y355 HydrophobicContact CG2-CD2 3.76Å; V332-Y355 HydrophobicContact CG2-CE2 3.47Å; V332-Y355 VanDerWaalsContact CG2-CE2 3.47Å; E351-Y355 WeakPolarHBondContact O-CB 3.15Å; E351-Y355 PolarHBondContact O-N 2.72Å; V352-Y355 PolarHBondContact O-N 3.13Å; S353-Y355 VanDerWaalsContact C-N 3.3Å; S353-Y355 PolarHBondContact O-N 3.07Å; Y355-E357 PolarHBondContact O-N 3.26Å; Y355-A358 PolarHBondContact O-N 2.7Å; Y355-L359 HydrophobicContact CD1-CD1 3.84Å; Y355-L359 HydrophobicContact CD1-CG 4.34Å; Y355-L359 HydrophobicContact CE1-CD1 3.44Å; Y355-L359 VanDerWaalsContact CE1-CD1 3.44Å; Y355-L359 HydrophobicContact CE1-CD2 4.46Å; Y355-L359 HydrophobicContact CE1-CG 4Å; Y355-L359 HydrophobicContact CE2-CD2 4.41Å; Y355-L359 HydrophobicContact CE2-CG 4.25Å; Y355-L359 WeakPolarHBondContact O-CG 3.29Å; Y355-L359 PolarHBondContact O-N 2.82Å
356	K	97.3	Very high	95.9	Very high	150 Å²	150	89.8 Å²	89.8	65%	0.652	43%	0.429	S	S	*	.	H	α-helix	trans	-60.8	-42.2	176.7	-171.7	-179.5	179.2	-177.3	0	112.3	V352 S353 L359 E360	V352-K356 WeakPolarHBondContact O-CB 2.9Å; V352-K356 PolarHBondContact O-N 2.89Å; S353-K356 WeakPolarHBondContact O-CB 3.29Å; S353-K356 PolarHBondContact O-N 2.86Å; S353-K356 VanDerWaalsContact O-N 3.11Å; K356-L359 PolarHBondContact O-N 3.43Å; K356-E360 PolarHBondContact O-N 2.94Å
357	E	96.2	Very high	95.9	Very high	134 Å²	134	95.9 Å²	95.9	63%	0.626	44%	0.436	S	S	*	.	H	α-helix	trans	-61.8	-43	174.9	-72.1	175.6	-165.6	0	0	112.2	S353 Y355 L359 E360 R361	S353-E357 PolarHBondContact O-N 2.83Å; Y355-E357 PolarHBondContact O-N 3.26Å; E357-L359 VanDerWaalsContact C-N 3.31Å; E357-L359 PolarHBondContact O-N 3.36Å; E357-E360 PolarHBondContact O-N 2.98Å; E357-R361 PolarHBondContact O-N 3.27Å
358	A	94.3	Very high	95.8	Very high	19 Å²	19	99.7 Å²	99.7	16%	0.157	45%	0.446	C	S	.	.	H	α-helix	trans	-63.3	-37.7	175.6	0	0	0	0	0	112.1	A328 R354 Y355 C362	A328-A358 HydrophobicContact CB-CB 3.95Å; R354-A358 PolarHBondContact O-N 2.71Å; Y355-A358 PolarHBondContact O-N 2.7Å; A358-C362 PolarHBondContact O-N 2.92Å; A358-C362 PolarHBondContact O-SG 3.49Å
359	L	96.4	Very high	95.6	Very high	76 Å²	76	97.4 Å²	97.4	40%	0.398	43%	0.433	S	S	.	.	H	α-helix	trans	-68.2	-38.4	174.8	-76.1	178.8	0	0	0	112.9	Y355 K356 E357 R361 C362 R363	Y355-L359 HydrophobicContact CD1-CD1 3.84Å; Y355-L359 HydrophobicContact CD1-CG 4.34Å; Y355-L359 HydrophobicContact CE1-CD1 3.44Å; Y355-L359 VanDerWaalsContact CE1-CD1 3.44Å; Y355-L359 HydrophobicContact CE1-CD2 4.46Å; Y355-L359 HydrophobicContact CE1-CG 4Å; Y355-L359 HydrophobicContact CE2-CD2 4.41Å; Y355-L359 HydrophobicContact CE2-CG 4.25Å; Y355-L359 WeakPolarHBondContact O-CG 3.29Å; Y355-L359 PolarHBondContact O-N 2.82Å; K356-L359 PolarHBondContact O-N 3.43Å; E357-L359 VanDerWaalsContact C-N 3.31Å; E357-L359 PolarHBondContact O-N 3.36Å; L359-R361 VanDerWaalsContact C-N 3.3Å; L359-R361 PolarHBondContact O-N 3.46Å; L359-C362 WeakPolarHBondContact O-CA 3.2Å; L359-C362 WeakPolarHBondContact O-CB 3.27Å; L359-C362 PolarHBondContact O-N 3.37Å; L359-C362 VanDerWaalsContact O-N 3.1Å; L359-R363 PolarHBondContact O-N 2.84Å
360	E	96.9	Very high	95.5	Very high	80 Å²	80	91.7 Å²	91.7	37%	0.374	41%	0.408	S	S	.	.	H	α-helix	trans	-64.4	-38	178.4	-169.9	57.3	-142.9	0	0	111.1	K356 E357 C362 R363 Q364	K356-E360 PolarHBondContact O-N 2.94Å; E357-E360 PolarHBondContact O-N 2.98Å; E360-C362 VanDerWaalsContact C-N 3.32Å; E360-C362 PolarHBondContact O-N 3.46Å; E360-R363 WeakPolarHBondContact O-CB 3.44Å; E360-R363 PolarHBondContact O-N 3.35Å; E360-R363 IonicContact OE2-NH1 2.93Å; E360-Q364 WeakPolarHBondContact O-CG 3.39Å; E360-Q364 PolarHBondContact O-N 3.42Å
361	R	93.9	Very high	95.3	Very high	160 Å²	160	90 Å²	90	60%	0.604	40%	0.403	S	S	*	.	H	α-helix	trans	-59.9	-42.7	171.4	-169.4	73.5	178.5	-173.5	1.4	111.8	E357 L359 L365	E357-R361 PolarHBondContact O-N 3.27Å; L359-R361 VanDerWaalsContact C-N 3.3Å; L359-R361 PolarHBondContact O-N 3.46Å; R361-L365 WeakPolarHBondContact O-CG 3.36Å; R361-L365 PolarHBondContact O-N 2.87Å
362	C	95.1	Very high	95	Very high	12 Å²	12	90 Å²	90	8%	0.081	40%	0.403	C	S	.	.	H	α-helix	trans	-60.2	-53.2	173.8	-64.3	0	0	0	0	109.6	A358 L359 E360 Q364 L365 W366	A358-C362 PolarHBondContact O-N 2.92Å; A358-C362 PolarHBondContact O-SG 3.49Å; L359-C362 WeakPolarHBondContact O-CA 3.2Å; L359-C362 WeakPolarHBondContact O-CB 3.27Å; L359-C362 PolarHBondContact O-N 3.37Å; L359-C362 VanDerWaalsContact O-N 3.1Å; E360-C362 VanDerWaalsContact C-N 3.32Å; E360-C362 PolarHBondContact O-N 3.46Å; C362-Q364 VanDerWaalsContact C-N 3.3Å; C362-Q364 PolarHBondContact O-N 3.04Å; C362-L365 PolarHBondContact O-N 2.84Å; C362-W366 PolarHBondContact O-N 2.95Å
363	R	96.7	Very high	94.6	Very high	162 Å²	162	90.1 Å²	90.1	61%	0.611	40%	0.396	S	S	*	.	H	α-helix	trans	-50.5	-46.7	-178.7	-175	-174.7	179.2	-179.2	1	113	L359 E360 L365 W366 W367	L359-R363 PolarHBondContact O-N 2.84Å; E360-R363 WeakPolarHBondContact O-CB 3.44Å; E360-R363 PolarHBondContact O-N 3.35Å; E360-R363 IonicContact OE2-NH1 2.93Å; R363-L365 VanDerWaalsContact C-N 3.34Å; R363-L365 PolarHBondContact O-N 3.43Å; R363-W366 PolarHBondContact O-N 2.93Å; R363-W367 WeakPolarHBondContact O-CB 3.46Å; R363-W367 PolarHBondContact O-N 3.3Å
364	Q	95.8	Very high	94.4	Very high	107 Å²	107	91.4 Å²	91.4	50%	0.5	40%	0.398	S	S	.	.	H	α-helix	trans	-59.6	-42.6	178.6	-70.4	174.1	0.7	0	0	112.7	E360 C362 R368	E360-Q364 WeakPolarHBondContact O-CG 3.39Å; E360-Q364 PolarHBondContact O-N 3.42Å; C362-Q364 VanDerWaalsContact C-N 3.3Å; C362-Q364 PolarHBondContact O-N 3.04Å; Q364-R368 PolarHBondContact O-N 3.45Å
365	L	93.9	Very high	94.2	Very high	17 Å²	17	90.8 Å²	90.8	9%	0.089	40%	0.404	C	S	.	.	H	α-helix	trans	-70.1	-40.3	178.4	-66.8	171.9	0	0	0	112.1	E320 I321 A324 R361 C362 R363 R368 R369	E320-L365 HydrophobicContact CB-CD1 4.17Å; E320-L365 HydrophobicContact CB-CD2 4.18Å; E320-L365 WeakPolarHBondContact OE2-CD2 3.44Å; I321-L365 HydrophobicContact CD1-CB 4.45Å; I321-L365 HydrophobicContact CG1-CB 3.65Å; I321-L365 HydrophobicContact CG1-CD1 4.44Å; A324-L365 HydrophobicContact CB-CD1 3.72Å; R361-L365 WeakPolarHBondContact O-CG 3.36Å; R361-L365 PolarHBondContact O-N 2.87Å; C362-L365 PolarHBondContact O-N 2.84Å; R363-L365 VanDerWaalsContact C-N 3.34Å; R363-L365 PolarHBondContact O-N 3.43Å; L365-R368 PolarHBondContact O-N 2.84Å; L365-R369 WeakPolarHBondContact O-CB 3.36Å; L365-R369 PolarHBondContact O-N 3.32Å
366	W	95.2	Very high	93.8	Very high	112 Å²	112	88 Å²	88	42%	0.424	39%	0.393	S	S	.	.	H	α-helix	trans	-62.1	-44.9	175.3	-78	66.5	0	0	0	110.9	I321 C362 R363 R368 R369 D370	I321-W366 HydrophobicContact CG2-CZ2 4.2Å; C362-W366 PolarHBondContact O-N 2.95Å; R363-W366 PolarHBondContact O-N 2.93Å; W366-R368 PolarHBondContact O-N 3.44Å; W366-R369 VanDerWaalsContact CE3-CZ 3.44Å; W366-R369 VanDerWaalsContact CE3-NH1 3.28Å; W366-R369 WeakPolarHBondContact O-CB 3.49Å; W366-R369 PolarHBondContact O-N 3.06Å; W366-D370 WeakPolarHBondContact O-CB 3.48Å; W366-D370 VanDerWaalsContact O-CG 3.24Å; W366-D370 PolarHBondContact O-N 3.17Å
367	W	95.8	Very high	93.4	Very high	184 Å²	184	84.5 Å²	84.5	70%	0.697	38%	0.382	S	S	*	.	H	α-helix	trans	-59.7	-45.8	176	-170.4	-89.1	0	0	0	112.3	R363 R369 D370 L371	R363-W367 WeakPolarHBondContact O-CB 3.46Å; R363-W367 PolarHBondContact O-N 3.3Å; W367-R369 PolarHBondContact O-N 3.18Å; W367-D370 PolarHBondContact O-N 3.23Å; W367-L371 WeakPolarHBondContact O-CB 3.46Å; W367-L371 PolarHBondContact O-N 2.81Å
368	R	93	Very high	93.1	Very high	100 Å²	100	82.5 Å²	82.5	38%	0.377	38%	0.378	S	S	.	.	H	α-helix	trans	-60.4	-45.7	176.2	-177.9	179.5	175.6	-173.2	1.4	111.7	Q364 L365 W366 D370 E372	Q364-R368 PolarHBondContact O-N 3.45Å; L365-R368 PolarHBondContact O-N 2.84Å; W366-R368 PolarHBondContact O-N 3.44Å; R368-D370 VanDerWaalsContact C-N 3.34Å; R368-D370 PolarHBondContact O-N 2.87Å; R368-E372 IonicContact CZ-OE1 3.05Å; R368-E372 IonicContact NE-OE1 2.74Å; R368-E372 PolarHBondContact NE-OE1 3.32Å; R368-E372 VanDerWaalsContact NE-OE1 3.15Å; R368-E372 IonicContact NH2-OE1 3.86Å; R368-E372 WeakPolarHBondContact O-CB 3.29Å; R368-E372 VanDerWaalsContact O-CG 3.27Å; R368-E372 WeakPolarHBondContact O-CG 3.41Å; R368-E372 PolarHBondContact O-N 2.91Å
369	R	93.4	Very high	92.8	Very high	41 Å²	41	86.5 Å²	86.5	16%	0.155	40%	0.396	C	S	.	.	H	α-helix	trans	-58.5	-47.1	176.4	-177.9	-158.1	69.2	-166.1	-3	111.2	V317 I321 L365 W366 W367 E372 K373	V317-R369 HydrophobicContact CG1-CB 3.82Å; V317-R369 HydrophobicContact CG1-CG 4.44Å; I321-R369 HydrophobicContact CD1-CB 3.99Å; I321-R369 HydrophobicContact CD1-CG 4.31Å; L365-R369 WeakPolarHBondContact O-CB 3.36Å; L365-R369 PolarHBondContact O-N 3.32Å; W366-R369 VanDerWaalsContact CE3-CZ 3.44Å; W366-R369 VanDerWaalsContact CE3-NH1 3.28Å; W366-R369 WeakPolarHBondContact O-CB 3.49Å; W366-R369 PolarHBondContact O-N 3.06Å; W367-R369 PolarHBondContact O-N 3.18Å; R369-E372 PolarHBondContact O-N 3.17Å; R369-K373 VanDerWaalsContact O-CB 3.23Å; R369-K373 WeakPolarHBondContact O-CB 3.42Å; R369-K373 PolarHBondContact O-N 3.29Å
370	D	92.9	Very high	92.3	Very high	53 Å²	53	86.1 Å²	86.1	28%	0.283	39%	0.389	S	S	.	.	H	α-helix	trans	-69.4	-43.1	-174.7	-69	-18.1	0	0	0	110.9	W366 W367 R368 E372 K373 D374	W366-D370 WeakPolarHBondContact O-CB 3.48Å; W366-D370 VanDerWaalsContact O-CG 3.24Å; W366-D370 PolarHBondContact O-N 3.17Å; W367-D370 PolarHBondContact O-N 3.23Å; R368-D370 VanDerWaalsContact C-N 3.34Å; R368-D370 PolarHBondContact O-N 2.87Å; D370-E372 PolarHBondContact O-N 3.29Å; D370-K373 PolarHBondContact O-N 2.8Å; D370-D374 WeakPolarHBondContact O-CB 3.43Å; D370-D374 PolarHBondContact O-N 2.91Å
371	L	92.7	Very high	91.9	Very high	104 Å²	104	89.5 Å²	89.5	55%	0.545	40%	0.398	S	S	.	.	H	α-helix	trans	-59.5	-48.2	172.8	-173.5	71.8	0	0	0	112.1	W367 K373 D374 V375	W367-L371 WeakPolarHBondContact O-CB 3.46Å; W367-L371 PolarHBondContact O-N 2.81Å; L371-K373 VanDerWaalsContact C-N 3.3Å; L371-K373 PolarHBondContact O-N 3.11Å; L371-D374 PolarHBondContact O-N 3.35Å; L371-V375 VanDerWaalsContact O-CG2 3.3Å; L371-V375 WeakPolarHBondContact O-CG2 3.27Å; L371-V375 PolarHBondContact O-N 3.41Å
372	E	88.8	Confident	91.7	Very high	39 Å²	39	86.6 Å²	86.6	18%	0.182	40%	0.398	C	S	.	.	H	α-helix	trans	-62.9	-37.2	178.6	-71.9	-178.3	-174.9	0	0	111.7	R313 R368 R369 D370 Y376	R313-E372 WeakPolarHBondContact CD-OE2 3.45Å; R313-E372 WeakPolarHBondContact CG-OE2 3.18Å; R313-E372 IonicContact CZ-OE1 3.1Å; R313-E372 VanDerWaalsContact CZ-OE1 3.29Å; R313-E372 IonicContact NE-OE1 2.62Å; R313-E372 PolarHBondContact NE-OE1 3.13Å; R313-E372 IonicContact NE-OE2 3.83Å; R313-E372 PolarHBondContact NE-OE2 3.4Å; R313-E372 IonicContact NH2-OE1 3.63Å; R313-E372 PolarHBondContact NH2-OE1 2.98Å; R368-E372 IonicContact CZ-OE1 3.05Å; R368-E372 IonicContact NE-OE1 2.74Å; R368-E372 PolarHBondContact NE-OE1 3.32Å; R368-E372 VanDerWaalsContact NE-OE1 3.15Å; R368-E372 IonicContact NH2-OE1 3.86Å; R368-E372 WeakPolarHBondContact O-CB 3.29Å; R368-E372 VanDerWaalsContact O-CG 3.27Å; R368-E372 WeakPolarHBondContact O-CG 3.41Å; R368-E372 PolarHBondContact O-N 2.91Å; R369-E372 PolarHBondContact O-N 3.17Å; D370-E372 PolarHBondContact O-N 3.29Å; E372-Y376 WeakPolarHBondContact O-CB 3.27Å; E372-Y376 PolarHBondContact O-N 3.11Å
373	K	90	Very high	91.2	Very high	100 Å²	100	88.7 Å²	88.7	44%	0.435	41%	0.407	S	S	.	.	H	α-helix	trans	-68	-44.7	175.5	179.4	-174.7	171.4	-169	0	112.3	Y310 R369 D370 L371 Y376 L377	Y310-K373 WeakPolarHBondContact OH-CA 3.45Å; Y310-K373 WeakPolarHBondContact OH-CB 3.47Å; R369-K373 VanDerWaalsContact O-CB 3.23Å; R369-K373 WeakPolarHBondContact O-CB 3.42Å; R369-K373 PolarHBondContact O-N 3.29Å; D370-K373 PolarHBondContact O-N 2.8Å; L371-K373 VanDerWaalsContact C-N 3.3Å; L371-K373 PolarHBondContact O-N 3.11Å; K373-Y376 PolarHBondContact O-N 2.97Å; K373-L377 WeakPolarHBondContact O-CB 3.35Å; K373-L377 PolarHBondContact O-N 3.31Å
374	D	92.6	Very high	90.6	Very high	86 Å²	86	82.7 Å²	82.7	46%	0.46	39%	0.393	S	S	.	.	H	α-helix	trans	-67.9	-41.8	-176.7	-71.1	-16.6	0	0	0	110.9	D370 L371 Y376 L377 V378	D370-D374 WeakPolarHBondContact O-CB 3.43Å; D370-D374 PolarHBondContact O-N 2.91Å; L371-D374 PolarHBondContact O-N 3.35Å; D374-Y376 VanDerWaalsContact C-N 3.35Å; D374-Y376 PolarHBondContact O-N 2.94Å; D374-L377 WeakPolarHBondContact O-CB 3.45Å; D374-L377 PolarHBondContact O-N 3.32Å; D374-V378 WeakPolarHBondContact O-CG2 3.48Å; D374-V378 PolarHBondContact O-N 3.43Å
375	V	90.4	Very high	90.3	Very high	80 Å²	80	81.2 Å²	81.2	49%	0.485	39%	0.388	S	S	.	.	H	α-helix	trans	-58.9	-46.8	172.8	171.8	0	0	0	0	110.9	L371 L377 V378 I379	L371-V375 VanDerWaalsContact O-CG2 3.3Å; L371-V375 WeakPolarHBondContact O-CG2 3.27Å; L371-V375 PolarHBondContact O-N 3.41Å; V375-L377 VanDerWaalsContact C-N 3.34Å; V375-L377 PolarHBondContact O-N 2.97Å; V375-V378 PolarHBondContact O-N 3.11Å; V375-I379 HydrophobicContact CG1-CD1 3.91Å; V375-I379 WeakPolarHBondContact O-CG1 3.46Å; V375-I379 PolarHBondContact O-N 3.46Å
376	Y	87.8	Confident	90	Very high	32 Å²	32	82.4 Å²	82.4	13%	0.125	40%	0.404	C	S	.	.	H	α-helix	trans	-60.4	-42.8	175.5	168.2	-101.2	0	0	0	112.2	A306 E307 Y310 E372 K373 D374 V378 I379 R380	A306-Y376 HydrophobicContact CB-CE2 4.27Å; E307-Y376 WeakPolarHBondContact CG-OH 3.1Å; Y310-Y376 AromaticContact CD1-CD1 3.96Å; Y310-Y376 HydrophobicContact CD1-CD1 3.96Å; Y310-Y376 HydrophobicContact CD1-CD2 4.27Å; Y310-Y376 HydrophobicContact CD1-CE1 4.04Å; Y310-Y376 HydrophobicContact CD1-CE2 4.35Å; Y310-Y376 HydrophobicContact CD1-CG 4.08Å; Y310-Y376 HydrophobicContact CD2-CD1 4.26Å; Y310-Y376 HydrophobicContact CD2-CD2 4.05Å; Y310-Y376 AromaticContact CD2-CG 3.72Å; Y310-Y376 HydrophobicContact CD2-CG 3.72Å; Y310-Y376 AromaticContact CE1-CD1 4Å; Y310-Y376 HydrophobicContact CE1-CD1 4Å; Y310-Y376 HydrophobicContact CE1-CE1 4.26Å; Y310-Y376 HydrophobicContact CE1-CG 4.41Å; Y310-Y376 HydrophobicContact CE2-CD1 4.3Å; Y310-Y376 HydrophobicContact CE2-CG 4.07Å; Y310-Y376 HydrophobicContact CG-CD1 4.09Å; Y310-Y376 AromaticContact CG-CD2 3.74Å; Y310-Y376 HydrophobicContact CG-CD2 3.74Å; Y310-Y376 HydrophobicContact CG-CE1 4.46Å; Y310-Y376 HydrophobicContact CG-CE2 4.13Å; Y310-Y376 AromaticContact CG-CG 3.72Å; Y310-Y376 HydrophobicContact CG-CG 3.72Å; E372-Y376 WeakPolarHBondContact O-CB 3.27Å; E372-Y376 PolarHBondContact O-N 3.11Å; K373-Y376 PolarHBondContact O-N 2.97Å; D374-Y376 VanDerWaalsContact C-N 3.35Å; D374-Y376 PolarHBondContact O-N 2.94Å; Y376-V378 PolarHBondContact O-N 3.43Å; Y376-I379 PolarHBondContact O-N 3.14Å; Y376-R380 VanDerWaalsContact O-CB 3.27Å; Y376-R380 WeakPolarHBondContact O-CB 3.15Å; Y376-R380 PolarHBondContact O-N 3.21Å
377	L	88.8	Confident	89.5	Confident	77 Å²	77	78 Å²	78	40%	0.403	39%	0.389	S	S	.	.	H	α-helix	trans	-62.2	-42.5	179.5	-177.1	63.7	0	0	0	111.9	K373 D374 V375 R381	K373-L377 WeakPolarHBondContact O-CB 3.35Å; K373-L377 PolarHBondContact O-N 3.31Å; D374-L377 WeakPolarHBondContact O-CB 3.45Å; D374-L377 PolarHBondContact O-N 3.32Å; V375-L377 VanDerWaalsContact C-N 3.34Å; V375-L377 PolarHBondContact O-N 2.97Å; L377-R381 WeakPolarHBondContact O-CB 3.21Å; L377-R381 PolarHBondContact O-N 3.46Å
378	V	91.8	Very high	89.1	Confident	91 Å²	91	73 Å²	73	55%	0.552	37%	0.373	S	S	*	.	H	α-helix	trans	-63.8	-51.2	176.9	171.4	0	0	0	0	110.8	D374 V375 Y376 R380 R381 V382	D374-V378 WeakPolarHBondContact O-CG2 3.48Å; D374-V378 PolarHBondContact O-N 3.43Å; V375-V378 PolarHBondContact O-N 3.11Å; Y376-V378 PolarHBondContact O-N 3.43Å; V378-R380 VanDerWaalsContact C-N 3.28Å; V378-R380 PolarHBondContact O-N 2.93Å; V378-R381 PolarHBondContact O-N 3.05Å; V378-R381 VanDerWaalsContact O-N 3.11Å; V378-V382 HydrophobicContact CG1-CG2 4.42Å; V378-V382 WeakPolarHBondContact O-CG2 3.26Å; V378-V382 PolarHBondContact O-N 3.31Å
379	I	87.6	Confident	88.9	Confident	104 Å²	104	72.8 Å²	72.8	53%	0.533	38%	0.383	S	S	.	.	H	α-helix	trans	-55.7	-47.1	178.4	-68.8	168.6	0	0	0	110.3	V375 Y376 R381 V382 M383	V375-I379 HydrophobicContact CG1-CD1 3.91Å; V375-I379 WeakPolarHBondContact O-CG1 3.46Å; V375-I379 PolarHBondContact O-N 3.46Å; Y376-I379 PolarHBondContact O-N 3.14Å; I379-R381 PolarHBondContact O-N 3.41Å; I379-V382 PolarHBondContact O-N 2.89Å; I379-M383 VanDerWaalsContact O-CB 3.32Å; I379-M383 WeakPolarHBondContact O-CB 3.45Å; I379-M383 PolarHBondContact O-N 3.04Å
380	R	86	Confident	88.7	Confident	67 Å²	67	74.7 Å²	74.7	25%	0.253	40%	0.396	S	S	.	.	H	α-helix	trans	-63	-40.7	178.4	-171.4	-174.6	67.1	78.8	-0.2	112.5	Y376 V378 M383 A384	Y376-R380 VanDerWaalsContact O-CB 3.27Å; Y376-R380 WeakPolarHBondContact O-CB 3.15Å; Y376-R380 PolarHBondContact O-N 3.21Å; V378-R380 VanDerWaalsContact C-N 3.28Å; V378-R380 PolarHBondContact O-N 2.93Å; R380-M383 PolarHBondContact O-N 2.9Å; R380-A384 WeakPolarHBondContact O-CB 3.48Å; R380-A384 PolarHBondContact O-N 3Å
381	R	87.9	Confident	88.4	Confident	152 Å²	152	72.2 Å²	72.2	57%	0.574	38%	0.382	S	S	*	.	H	α-helix	trans	-68	-43.6	179.9	-174.7	61.9	171.3	-171.8	-0.4	111.5	L377 V378 I379 M383 A384 L385	L377-R381 WeakPolarHBondContact O-CB 3.21Å; L377-R381 PolarHBondContact O-N 3.46Å; V378-R381 PolarHBondContact O-N 3.05Å; V378-R381 VanDerWaalsContact O-N 3.11Å; I379-R381 PolarHBondContact O-N 3.41Å; R381-M383 VanDerWaalsContact C-N 3.29Å; R381-M383 PolarHBondContact O-N 3.39Å; R381-A384 PolarHBondContact O-N 3.3Å; R381-L385 HydrophobicContact CG-CD1 4.12Å; R381-L385 WeakPolarHBondContact O-CB 3.41Å; R381-L385 WeakPolarHBondContact O-CG 3.35Å; R381-L385 PolarHBondContact O-N 3.18Å
382	V	88.9	Confident	88.2	Confident	98 Å²	98	70.4 Å²	70.4	59%	0.594	37%	0.373	S	S	*	.	H	α-helix	trans	-59.7	-44.8	174.9	171.1	0	0	0	0	110.2	V378 I379 L385 G386	V378-V382 HydrophobicContact CG1-CG2 4.42Å; V378-V382 WeakPolarHBondContact O-CG2 3.26Å; V378-V382 PolarHBondContact O-N 3.31Å; I379-V382 PolarHBondContact O-N 2.89Å; V382-L385 PolarHBondContact O-N 2.98Å; V382-G386 PolarHBondContact O-N 3Å
383	M	85.1	Confident	88.2	Confident	56 Å²	56	73.1 Å²	73.1	28%	0.276	39%	0.389	S	S	.	.	H	α-helix	trans	-60.9	-49.2	178	-175.9	178.2	177.1	0	0	112.7	L302 I379 R380 R381 L385 G386 M387	L302-M383 HydrophobicContact CB-CE 3.01Å; L302-M383 HydrophobicContact CB-SD 3.97Å; L302-M383 HydrophobicContact CD1-CE 3.31Å; L302-M383 HydrophobicContact CD2-CE 3.93Å; L302-M383 HydrophobicContact CG-CE 3.54Å; I379-M383 VanDerWaalsContact O-CB 3.32Å; I379-M383 WeakPolarHBondContact O-CB 3.45Å; I379-M383 PolarHBondContact O-N 3.04Å; R380-M383 PolarHBondContact O-N 2.9Å; R381-M383 VanDerWaalsContact C-N 3.29Å; R381-M383 PolarHBondContact O-N 3.39Å; M383-L385 VanDerWaalsContact C-N 3.34Å; M383-L385 PolarHBondContact O-N 3.3Å; M383-G386 PolarHBondContact O-N 3.33Å; M383-M387 PolarHBondContact O-N 2.97Å
384	A	84.9	Confident	88.1	Confident	37 Å²	37	70 Å²	70	31%	0.306	38%	0.379	S	S	.	.	H	α-helix	trans	-61.8	-41.4	178.9	0	0	0	0	0	112.1	R380 R381 M387 Q388	R380-A384 WeakPolarHBondContact O-CB 3.48Å; R380-A384 PolarHBondContact O-N 3Å; R381-A384 PolarHBondContact O-N 3.3Å; A384-M387 PolarHBondContact O-N 2.63Å; A384-Q388 WeakPolarHBondContact O-CB 3.06Å; A384-Q388 PolarHBondContact O-N 3.36Å
385	L	88.2	Confident	87.9	Confident	75 Å²	75	65.9 Å²	65.9	39%	0.393	36%	0.357	S	S	.	.	H	α-helix	trans	-64.6	-42.9	175.2	-74.5	169	0	0	0	111.7	R381 V382 M383 M387 Q388 V389	R381-L385 HydrophobicContact CG-CD1 4.12Å; R381-L385 WeakPolarHBondContact O-CB 3.41Å; R381-L385 WeakPolarHBondContact O-CG 3.35Å; R381-L385 PolarHBondContact O-N 3.18Å; V382-L385 PolarHBondContact O-N 2.98Å; M383-L385 VanDerWaalsContact C-N 3.34Å; M383-L385 PolarHBondContact O-N 3.3Å; L385-M387 VanDerWaalsContact C-N 3.29Å; L385-M387 PolarHBondContact O-N 3.43Å; L385-Q388 PolarHBondContact O-N 3.15Å; L385-V389 WeakPolarHBondContact O-CG2 3.1Å; L385-V389 PolarHBondContact O-N 3.4Å
386	G	88.3	Confident	87.8	Confident	43 Å²	43	65.5 Å²	65.5	44%	0.443	36%	0.355	S	S	.	.	H	α-helix	trans	-57.9	-43	175.2	0	0	0	0	0	111.9	V382 M383 V389 L390	V382-G386 PolarHBondContact O-N 3Å; M383-G386 PolarHBondContact O-N 3.33Å; G386-V389 PolarHBondContact O-N 3.34Å; G386-L390 WeakPolarHBondContact O-CB 3.4Å; G386-L390 PolarHBondContact O-N 2.86Å
387	M	85.3	Confident	87.8	Confident	18 Å²	18	69.7 Å²	69.7	9%	0.089	38%	0.375	C	S	.	.	H	α-helix	trans	-66.1	-40.7	176	-168	60.2	-175.5	0	0	112.6	L295 D299 M383 A384 L385 L390 I391	L295-M387 VanDerWaalsContact C-CE 3.41Å; L295-M387 HydrophobicContact CD1-CE 4.37Å; L295-M387 HydrophobicContact CG-CE 3.84Å; L295-M387 WeakPolarHBondContact O-CE 3.41Å; D299-M387 HydrophobicContact CB-CG 4.13Å; M383-M387 PolarHBondContact O-N 2.97Å; A384-M387 PolarHBondContact O-N 2.63Å; L385-M387 VanDerWaalsContact C-N 3.29Å; L385-M387 PolarHBondContact O-N 3.43Å; M387-L390 HydrophobicContact CE-CD2 4.37Å; M387-L390 WeakPolarHBondContact O-CB 3.33Å; M387-L390 PolarHBondContact O-N 3.19Å; M387-L390 HydrophobicContact SD-CD2 3.98Å; M387-I391 HydrophobicContact CE-CD1 4Å; M387-I391 HydrophobicContact CE-CG1 4.23Å; M387-I391 HydrophobicContact CG-CD1 4.09Å; M387-I391 WeakPolarHBondContact O-CG1 3.44Å; M387-I391 PolarHBondContact O-N 3.22Å
388	Q	86.8	Confident	87.7	Confident	80 Å²	80	66.9 Å²	66.9	37%	0.374	36%	0.36	S	S	.	.	H	α-helix	trans	-62.3	-42.9	175.9	-171	177.3	8.9	0	0	111.9	A384 L385 L390 I391 L392 L413	A384-Q388 WeakPolarHBondContact O-CB 3.06Å; A384-Q388 PolarHBondContact O-N 3.36Å; L385-Q388 PolarHBondContact O-N 3.15Å; Q388-L390 VanDerWaalsContact C-N 3.34Å; Q388-I391 PolarHBondContact O-N 3.04Å; Q388-L392 HydrophobicContact CG-CD1 4.42Å; Q388-L392 WeakPolarHBondContact O-CB 3.32Å; Q388-L392 WeakPolarHBondContact O-CG 3.13Å; Q388-L392 PolarHBondContact O-N 3.22Å; Q388-L413 HydrophobicContact CG-CD2 4.47Å
389	V	89.8	Confident	87.6	Confident	96 Å²	96	64.8 Å²	64.8	58%	0.582	35%	0.345	S	S	*	.	H	α-helix	trans	-63.3	-41	175.1	172.6	0	0	0	0	111.1	L385 G386 L392 N393	L385-V389 WeakPolarHBondContact O-CG2 3.1Å; L385-V389 PolarHBondContact O-N 3.4Å; G386-V389 PolarHBondContact O-N 3.34Å; V389-L392 PolarHBondContact O-N 3.4Å; V389-N393 WeakPolarHBondContact O-CB 3.48Å; V389-N393 PolarHBondContact O-N 3.04Å
390	L	87.4	Confident	87.6	Confident	81 Å²	81	66.8 Å²	66.8	42%	0.424	36%	0.356	S	S	.	.	H	α-helix	trans	-61.3	-44.5	176.5	-165.3	95.1	0	0	0	111.8	L295 G386 M387 Q388 N393 C394	L295-L390 HydrophobicContact CD1-CD2 3.63Å; L295-L390 HydrophobicContact CD2-CD2 3.95Å; L295-L390 HydrophobicContact CD2-CG 4.47Å; L295-L390 HydrophobicContact CG-CD2 3.97Å; G386-L390 WeakPolarHBondContact O-CB 3.4Å; G386-L390 PolarHBondContact O-N 2.86Å; M387-L390 HydrophobicContact CE-CD2 4.37Å; M387-L390 WeakPolarHBondContact O-CB 3.33Å; M387-L390 PolarHBondContact O-N 3.19Å; M387-L390 HydrophobicContact SD-CD2 3.98Å; Q388-L390 VanDerWaalsContact C-N 3.34Å; L390-N393 PolarHBondContact O-N 2.93Å; L390-C394 PolarHBondContact O-N 3.04Å; L390-C394 PolarHBondContact O-SG 3.49Å
391	I	88	Confident	87.6	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-66.8	-41.3	178.3	-72.6	168	0	0	0	111.1	L295 M387 Q388 C394 G395 F412 L413	L295-I391 HydrophobicContact CD2-CG1 3.88Å; L295-I391 HydrophobicContact CG-CG1 4.25Å; M387-I391 HydrophobicContact CE-CD1 4Å; M387-I391 HydrophobicContact CE-CG1 4.23Å; M387-I391 HydrophobicContact CG-CD1 4.09Å; M387-I391 WeakPolarHBondContact O-CG1 3.44Å; M387-I391 PolarHBondContact O-N 3.22Å; Q388-I391 PolarHBondContact O-N 3.04Å; I391-C394 PolarHBondContact O-N 3.47Å; I391-G395 WeakPolarHBondContact O-CA 3.37Å; I391-G395 PolarHBondContact O-N 3.09Å; I391-F412 HydrophobicContact CG2-CD1 4.04Å; I391-F412 HydrophobicContact CG2-CE1 3.8Å; I391-L413 HydrophobicContact CG2-CD2 4.12Å
392	L	88.8	Confident	87.3	Confident	66 Å²	66	62.7 Å²	62.7	35%	0.346	38%	0.376	S	S	.	.	H	α-helix	trans	-60.6	-46.5	174	-79.7	168.7	0	0	0	111.6	Q388 V389 C394 G395 V396 L409 L413	Q388-L392 HydrophobicContact CG-CD1 4.42Å; Q388-L392 WeakPolarHBondContact O-CB 3.32Å; Q388-L392 WeakPolarHBondContact O-CG 3.13Å; Q388-L392 PolarHBondContact O-N 3.22Å; V389-L392 PolarHBondContact O-N 3.4Å; L392-C394 PolarHBondContact O-N 3.3Å; L392-G395 PolarHBondContact O-N 3.02Å; L392-V396 WeakPolarHBondContact O-CG2 3.35Å; L392-V396 PolarHBondContact O-N 3.04Å; L392-L409 HydrophobicContact CD2-CD2 4.45Å; L392-L413 HydrophobicContact CD2-CD1 3.64Å; L392-L413 HydrophobicContact CD2-CD2 4.25Å; L392-L413 HydrophobicContact CG-CD1 4.48Å; L392-L413 HydrophobicContact CG-CD2 4.3Å
393	N	88.8	Confident	86.9	Confident	97 Å²	97	62.6 Å²	62.6	52%	0.519	37%	0.369	S	S	.	.	H	α-helix	trans	-61.6	-46	179	-172.4	39.6	0	0	0	111.9	V389 L390 G395 V396 Q397	V389-N393 WeakPolarHBondContact O-CB 3.48Å; V389-N393 PolarHBondContact O-N 3.04Å; L390-N393 PolarHBondContact O-N 2.93Å; N393-G395 VanDerWaalsContact C-N 3.33Å; N393-G395 PolarHBondContact O-N 3.31Å; N393-V396 PolarHBondContact O-N 3.22Å; N393-Q397 PolarHBondContact O-N 3.42Å
394	C	87.8	Confident	87	Confident	33 Å²	33	60.6 Å²	60.6	22%	0.223	36%	0.36	C	S	.	.	H	α-helix	trans	-66.8	-35.3	175.3	-62.9	0	0	0	0	112.2	L292 L295 L390 I391 L392 Q397 Q398	L292-C394 HydrophobicContact CD2-CB 3.85Å; L295-C394 HydrophobicContact CD2-CB 4.03Å; L390-C394 PolarHBondContact O-N 3.04Å; L390-C394 PolarHBondContact O-SG 3.49Å; I391-C394 PolarHBondContact O-N 3.47Å; L392-C394 PolarHBondContact O-N 3.3Å; C394-Q397 PolarHBondContact O-N 2.82Å; C394-Q398 PolarHBondContact O-N 2.9Å; C394-Q398 VanDerWaalsContact O-N 3.12Å
395	G	88.8	Confident	87.2	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-64.9	-42.5	177.3	0	0	0	0	0	112.2	I391 L392 N393 Q397 Q398 I399	I391-G395 WeakPolarHBondContact O-CA 3.37Å; I391-G395 PolarHBondContact O-N 3.09Å; L392-G395 PolarHBondContact O-N 3.02Å; N393-G395 VanDerWaalsContact C-N 3.33Å; N393-G395 PolarHBondContact O-N 3.31Å; G395-Q397 VanDerWaalsContact C-N 3.33Å; G395-Q397 PolarHBondContact O-N 3.35Å; G395-Q398 PolarHBondContact O-N 3.13Å; G395-I399 WeakPolarHBondContact O-CG1 3.27Å; G395-I399 PolarHBondContact O-N 2.71Å
396	V	87.6	Confident	87.1	Confident	73 Å²	73	66.8 Å²	66.8	44%	0.442	38%	0.378	S	S	.	.	H	α-helix	trans	-60.7	-43	174.1	171	0	0	0	0	111.1	L392 N393 Q398 I399 L400	L392-V396 WeakPolarHBondContact O-CG2 3.35Å; L392-V396 PolarHBondContact O-N 3.04Å; N393-V396 PolarHBondContact O-N 3.22Å; V396-Q398 VanDerWaalsContact C-N 3.29Å; V396-Q398 PolarHBondContact O-N 2.97Å; V396-I399 PolarHBondContact O-N 3.36Å; V396-L400 HydrophobicContact CG1-CD1 4.17Å; V396-L400 HydrophobicContact CG1-CG 4.46Å; V396-L400 WeakPolarHBondContact O-CG 3.47Å; V396-L400 PolarHBondContact O-N 3.46Å
397	Q	87.9	Confident	87.1	Confident	119 Å²	119	64.8 Å²	64.8	56%	0.556	36%	0.358	S	S	*	.	H	α-helix	trans	-60.3	-38.5	175.7	-68.8	178.8	-8	0	0	112.3	N393 C394 G395 L400 A401	N393-Q397 PolarHBondContact O-N 3.42Å; C394-Q397 PolarHBondContact O-N 2.82Å; G395-Q397 VanDerWaalsContact C-N 3.33Å; G395-Q397 PolarHBondContact O-N 3.35Å; Q397-L400 PolarHBondContact O-N 3.02Å; Q397-A401 WeakPolarHBondContact O-CB 3.22Å; Q397-A401 PolarHBondContact O-N 2.94Å
398	Q	86.7	Confident	87.2	Confident	19 Å²	19	64.5 Å²	64.5	9%	0.089	36%	0.359	C	S	.	.	H	α-helix	trans	-72.2	-33.2	176.6	-72.3	175.4	21.4	0	0	113.2	S289 C394 G395 V396 A401 G402 E403 V404	S289-Q398 PolarHBondContact OG-OE1 2.85Å; C394-Q398 PolarHBondContact O-N 2.9Å; C394-Q398 VanDerWaalsContact O-N 3.12Å; G395-Q398 PolarHBondContact O-N 3.13Å; V396-Q398 VanDerWaalsContact C-N 3.29Å; V396-Q398 PolarHBondContact O-N 2.97Å; Q398-A401 PolarHBondContact O-N 3.33Å; Q398-G402 PolarHBondContact O-N 2.85Å; Q398-E403 HydrophobicContact CB-CB 4.4Å; Q398-E403 PolarHBondContact O-N 2.91Å; Q398-V404 HydrophobicContact CB-CB 4.4Å; Q398-V404 HydrophobicContact CB-CG2 4.14Å
399	I	89.4	Confident	87.3	Confident	47 Å²	47	61.3 Å²	61.3	24%	0.241	34%	0.344	C	S	.	.	H	α-helix	trans	-64.3	-44.9	171.8	-68.7	166.7	0	0	0	110.1	G395 V396 A401 G402 V404 L409	G395-I399 WeakPolarHBondContact O-CG1 3.27Å; G395-I399 PolarHBondContact O-N 2.71Å; V396-I399 PolarHBondContact O-N 3.36Å; I399-A401 VanDerWaalsContact C-N 3.26Å; I399-A401 PolarHBondContact O-N 3.08Å; I399-G402 PolarHBondContact O-N 3.08Å; I399-V404 WeakPolarHBondContact CA-O 3.5Å; I399-V404 WeakPolarHBondContact CG1-O 3.3Å; I399-L409 HydrophobicContact CD1-CB 4.07Å; I399-L409 HydrophobicContact CD1-CD2 3.53Å; I399-L409 HydrophobicContact CD1-CG 4.43Å
400	L	86.8	Confident	87.3	Confident	145 Å²	145	59.4 Å²	59.4	76%	0.759	33%	0.331	S	S	*	.	H	α-helix	trans	-64.4	-31.2	177.3	-68	173.3	0	0	0	112.4	V396 Q397 G402	V396-L400 HydrophobicContact CG1-CD1 4.17Å; V396-L400 HydrophobicContact CG1-CG 4.46Å; V396-L400 WeakPolarHBondContact O-CG 3.47Å; V396-L400 PolarHBondContact O-N 3.46Å; Q397-L400 PolarHBondContact O-N 3.02Å; L400-G402 VanDerWaalsContact C-N 3.27Å
401	A	86.3	Confident	87.5	Confident	67 Å²	67	55.8 Å²	55.8	55%	0.554	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.8	173.6	0	0	0	0	0	113.9	Q397 Q398 I399 E403	Q397-A401 WeakPolarHBondContact O-CB 3.22Å; Q397-A401 PolarHBondContact O-N 2.94Å; Q398-A401 PolarHBondContact O-N 3.33Å; I399-A401 VanDerWaalsContact C-N 3.26Å; I399-A401 PolarHBondContact O-N 3.08Å; A401-E403 VanDerWaalsContact C-N 3.27Å; A401-E403 HydrophobicContact CB-CG 4.13Å; A401-E403 PolarHBondContact O-N 3.21Å
402	G	81.7	Confident	87.6	Confident	66 Å²	66	55.8 Å²	55.8	68%	0.68	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	12	-177.8	0	0	0	0	0	114.8	Q398 I399 L400	Q398-G402 PolarHBondContact O-N 2.85Å; I399-G402 PolarHBondContact O-N 3.08Å; L400-G402 VanDerWaalsContact C-N 3.27Å
403	E	81.5	Confident	87.6	Confident	97 Å²	97	54.2 Å²	54.2	45%	0.453	30%	0.304	S	S	.	.	S	Bend	trans	-81	-27.2	-177.6	-64.9	-176.5	172.3	0	0	112.8	R291 Q398 A401	R291-E403 IonicContact CZ-OE1 3.15Å; R291-E403 IonicContact CZ-OE2 3.9Å; R291-E403 IonicContact NH1-OE1 3.88Å; R291-E403 PolarHBondContact NH1-OE1 3.13Å; R291-E403 IonicContact NH1-OE2 3.97Å; R291-E403 PolarHBondContact NH1-OE2 2.66Å; R291-E403 IonicContact NH2-OE1 3.29Å; Q398-E403 HydrophobicContact CB-CB 4.4Å; Q398-E403 PolarHBondContact O-N 2.91Å; A401-E403 VanDerWaalsContact C-N 3.27Å; A401-E403 HydrophobicContact CB-CG 4.13Å; A401-E403 PolarHBondContact O-N 3.21Å
404	V	87.3	Confident	87.7	Confident	13 Å²	13	52.5 Å²	52.5	8%	0.079	29%	0.294	C	S	.	.	S	Bend	trans	-139	140.6	-175.6	-179.8	0	0	0	0	110.3	V288 Q398 I399	V288-V404 HydrophobicContact CG1-CG1 4.35Å; Q398-V404 HydrophobicContact CB-CB 4.4Å; Q398-V404 HydrophobicContact CB-CG2 4.14Å; I399-V404 WeakPolarHBondContact CA-O 3.5Å; I399-V404 WeakPolarHBondContact CG1-O 3.3Å
405	T	88.5	Confident	87.9	Confident	74 Å²	74	51 Å²	51	45%	0.454	28%	0.284	S	S	.	.			trans	-80.9	162.8	175.6	66.4	0	0	0	0	112.4	D178 G407 G408 L409	D178-T405 VanDerWaalsContact OD1-CB 3.27Å; D178-T405 WeakPolarHBondContact OD1-CB 3.33Å; D178-T405 PolarHBondContact OD1-OG1 3Å; D178-T405 WeakPolarHBondContact OD2-CB 3.47Å; D178-T405 PolarHBondContact OD2-OG1 3.22Å; T405-G407 VanDerWaalsContact C-N 3.29Å; T405-G407 PolarHBondContact O-N 3.22Å; T405-G408 PolarHBondContact O-N 3.46Å; T405-G408 PolarHBondContact OG1-N 3Å; T405-L409 PolarHBondContact O-N 3.39Å
406	R	86.6	Confident	87.9	Confident	169 Å²	169	52.4 Å²	52.4	64%	0.638	29%	0.291	S	S	*	.	H	α-helix	trans	-60.5	-41.4	177.2	-63.8	177.6	-175.1	163.6	2.1	111.2	D178 L409 L410	D178-R406 PolarHBondContact OD1-N 3.37Å; R406-L409 PolarHBondContact O-N 2.9Å; R406-L410 PolarHBondContact O-N 3.31Å
407	G	86.8	Confident	87.8	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-66.4	-39.8	173.6	0	0	0	0	0	113	G174 D178 T405 L409 L410 S411	G174-G407 VanDerWaalsContact CA-O 3.27Å; G174-G407 WeakPolarHBondContact CA-O 3.3Å; G174-G407 VanDerWaalsContact O-CA 3.22Å; G174-G407 WeakPolarHBondContact O-CA 3.11Å; D178-G407 VanDerWaalsContact OD1-CA 3.29Å; D178-G407 WeakPolarHBondContact OD1-CA 3.5Å; D178-G407 PolarHBondContact OD1-N 3.49Å; T405-G407 VanDerWaalsContact C-N 3.29Å; T405-G407 PolarHBondContact O-N 3.22Å; G407-L409 VanDerWaalsContact C-N 3.33Å; G407-L409 PolarHBondContact O-N 2.91Å; G407-L410 PolarHBondContact O-N 3.1Å; G407-S411 PolarHBondContact O-N 3.44Å; G407-S411 PolarHBondContact O-OG 3.4Å
408	G	87.8	Confident	87.8	Confident	11 Å²	11	52.7 Å²	52.7	11%	0.113	29%	0.287	C	S	.	.	H	α-helix	trans	-58.7	-42	173.3	0	0	0	0	0	112.6	V288 T405 S411 F412	V288-G408 WeakPolarHBondContact CG1-O 3.2Å; T405-G408 PolarHBondContact O-N 3.46Å; T405-G408 PolarHBondContact OG1-N 3Å; G408-S411 PolarHBondContact O-N 3.45Å; G408-F412 WeakPolarHBondContact O-CB 3.29Å; G408-F412 PolarHBondContact O-N 3.42Å
409	L	89.2	Confident	87.8	Confident	13 Å²	13	52.1 Å²	52.1	7%	0.068	29%	0.285	C	S	.	.	H	α-helix	trans	-65	-40.8	174.6	-176.1	62.3	0	0	0	112.1	L292 L392 I399 T405 R406 G407 F412 L413	L292-L409 HydrophobicContact CD1-CD1 3.99Å; L392-L409 HydrophobicContact CD2-CD2 4.45Å; I399-L409 HydrophobicContact CD1-CB 4.07Å; I399-L409 HydrophobicContact CD1-CD2 3.53Å; I399-L409 HydrophobicContact CD1-CG 4.43Å; T405-L409 PolarHBondContact O-N 3.39Å; R406-L409 PolarHBondContact O-N 2.9Å; G407-L409 VanDerWaalsContact C-N 3.33Å; G407-L409 PolarHBondContact O-N 2.91Å; L409-F412 WeakPolarHBondContact O-CB 3.49Å; L409-F412 PolarHBondContact O-N 3.01Å; L409-L413 WeakPolarHBondContact O-CG 3.35Å; L409-L413 PolarHBondContact O-N 3.46Å
410	L	90.2	Very high	87.5	Confident	56 Å²	56	50.9 Å²	50.9	29%	0.293	28%	0.284	S	S	.	.	H	α-helix	trans	-61.5	-49.5	174.4	179.2	67.3	0	0	0	111.3	I177 R406 G407 F412 L413 L414	I177-L410 HydrophobicContact CD1-CB 4.43Å; I177-L410 HydrophobicContact CD1-CD2 3.18Å; I177-L410 HydrophobicContact CD1-CG 4.31Å; I177-L410 HydrophobicContact CG1-CD2 4.07Å; R406-L410 PolarHBondContact O-N 3.31Å; G407-L410 PolarHBondContact O-N 3.1Å; L410-F412 PolarHBondContact O-N 3.05Å; L410-L413 PolarHBondContact O-N 2.91Å; L410-L413 VanDerWaalsContact O-N 3.13Å; L410-L414 HydrophobicContact CD1-CD1 4.47Å; L410-L414 HydrophobicContact CD1-CG 4.36Å; L410-L414 HydrophobicContact CD2-CD1 4.43Å; L410-L414 HydrophobicContact CG-CD1 4.1Å; L410-L414 HydrophobicContact CG-CG 4.4Å; L410-L414 WeakPolarHBondContact O-CG 3.39Å; L410-L414 PolarHBondContact O-N 3.3Å
411	S	90.5	Very high	87.4	Confident	6 Å²	6	49.2 Å²	49.2	4%	0.042	27%	0.272	C	S	.	.	H	α-helix	trans	-55	-41.7	177.2	-63.4	0	0	0	0	111.1	P170 G174 G407 G408 L414 Y415	P170-S411 WeakPolarHBondContact O-CB 3.22Å; P170-S411 PolarHBondContact O-OG 3.46Å; G174-S411 WeakPolarHBondContact CA-OG 3.4Å; G407-S411 PolarHBondContact O-N 3.44Å; G407-S411 PolarHBondContact O-OG 3.4Å; G408-S411 PolarHBondContact O-N 3.45Å; S411-L414 PolarHBondContact O-N 3.23Å; S411-Y415 WeakPolarHBondContact O-CB 3.5Å; S411-Y415 WeakPolarHBondContact O-CD2 3.45Å; S411-Y415 VanDerWaalsContact O-CG 3.24Å; S411-Y415 PolarHBondContact O-N 2.92Å
412	F	90.9	Very high	87.5	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-61.3	-45.4	177	-172.3	-86.2	0	0	0	112.6	M285 V288 L292 I391 G408 L409 L410 L414 Y415 Q416	M285-F412 HydrophobicContact CB-CD2 4.36Å; M285-F412 HydrophobicContact CB-CE2 4.01Å; M285-F412 HydrophobicContact CE-CD2 4.2Å; M285-F412 HydrophobicContact CE-CE1 3.95Å; M285-F412 HydrophobicContact CE-CE2 3.49Å; M285-F412 VanDerWaalsContact CE-CE2 3.49Å; M285-F412 HydrophobicContact CE-CZ 3.31Å; M285-F412 HydrophobicContact CG-CD2 4.36Å; M285-F412 HydrophobicContact CG-CE2 4.23Å; V288-F412 HydrophobicContact CG1-CB 4.32Å; V288-F412 HydrophobicContact CG1-CD2 4.49Å; L292-F412 HydrophobicContact CB-CD1 4.26Å; L292-F412 HydrophobicContact CB-CD2 4.22Å; L292-F412 HydrophobicContact CB-CE1 3.71Å; L292-F412 HydrophobicContact CB-CE2 3.65Å; L292-F412 HydrophobicContact CB-CZ 3.38Å; L292-F412 HydrophobicContact CD1-CD1 4.3Å; L292-F412 HydrophobicContact CD1-CG 4.34Å; L292-F412 WeakPolarHBondContact O-CZ 3.01Å; I391-F412 HydrophobicContact CG2-CD1 4.04Å; I391-F412 HydrophobicContact CG2-CE1 3.8Å; G408-F412 WeakPolarHBondContact O-CB 3.29Å; G408-F412 PolarHBondContact O-N 3.42Å; L409-F412 WeakPolarHBondContact O-CB 3.49Å; L409-F412 PolarHBondContact O-N 3.01Å; L410-F412 PolarHBondContact O-N 3.05Å; F412-L414 PolarHBondContact O-N 2.94Å; F412-Y415 PolarHBondContact O-N 3.25Å; F412-Q416 WeakPolarHBondContact O-CB 3.4Å; F412-Q416 PolarHBondContact O-N 3.32Å
413	L	89.6	Confident	87.6	Confident	32 Å²	32	45 Å²	45	17%	0.168	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-42.7	178.6	-67.8	168.4	0	0	0	111.9	Q388 I391 L392 L409 L410 Q416 E417	Q388-L413 HydrophobicContact CG-CD2 4.47Å; I391-L413 HydrophobicContact CG2-CD2 4.12Å; L392-L413 HydrophobicContact CD2-CD1 3.64Å; L392-L413 HydrophobicContact CD2-CD2 4.25Å; L392-L413 HydrophobicContact CG-CD1 4.48Å; L392-L413 HydrophobicContact CG-CD2 4.3Å; L409-L413 WeakPolarHBondContact O-CG 3.35Å; L409-L413 PolarHBondContact O-N 3.46Å; L410-L413 PolarHBondContact O-N 2.91Å; L410-L413 VanDerWaalsContact O-N 3.13Å; L413-Q416 PolarHBondContact O-N 3.16Å; L413-E417 PolarHBondContact O-N 2.68Å; L413-E417 VanDerWaalsContact O-N 3.17Å
414	L	90.6	Very high	87.5	Confident	61 Å²	61	44.2 Å²	44.2	32%	0.319	22%	0.217	S	C	.	.	H	α-helix	trans	-63.9	-41.7	176.3	-67.7	175.5	0	0	0	111.6	P170 L410 S411 F412 E418	P170-L414 HydrophobicContact CB-CB 3.78Å; P170-L414 HydrophobicContact CB-CD1 3.94Å; P170-L414 HydrophobicContact CG-CB 4.2Å; L410-L414 HydrophobicContact CD1-CD1 4.47Å; L410-L414 HydrophobicContact CD1-CG 4.36Å; L410-L414 HydrophobicContact CD2-CD1 4.43Å; L410-L414 HydrophobicContact CG-CD1 4.1Å; L410-L414 HydrophobicContact CG-CG 4.4Å; L410-L414 WeakPolarHBondContact O-CG 3.39Å; L410-L414 PolarHBondContact O-N 3.3Å; S411-L414 PolarHBondContact O-N 3.23Å; F412-L414 PolarHBondContact O-N 2.94Å; L414-E418 PolarHBondContact O-N 3.44Å
415	Y	90.8	Very high	87.3	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-42.4	175.4	-69.7	-39.7	0	0	0	112.9	T167 P170 R171 L281 F284 M285 S411 F412 E417 E418 V419	T167-Y415 WeakPolarHBondContact O-CE1 3.25Å; T167-Y415 PolarHBondContact O-OH 3.43Å; P170-Y415 HydrophobicContact CB-CD1 3.88Å; P170-Y415 HydrophobicContact CB-CE1 3.5Å; P170-Y415 HydrophobicContact CB-CE2 4.44Å; P170-Y415 HydrophobicContact CG-CD1 3.84Å; P170-Y415 HydrophobicContact CG-CE1 3.52Å; R171-Y415 WeakPolarHBondContact CB-OH 3.49Å; R171-Y415 PolarHBondContact N-OH 3.3Å; L281-Y415 HydrophobicContact CD2-CD1 3.44Å; L281-Y415 VanDerWaalsContact CD2-CD1 3.44Å; L281-Y415 HydrophobicContact CD2-CE1 3.98Å; L281-Y415 HydrophobicContact CD2-CG 4.28Å; F284-Y415 HydrophobicContact CB-CD2 4.4Å; F284-Y415 HydrophobicContact CB-CE2 3.92Å; M285-Y415 HydrophobicContact CG-CD2 4.28Å; M285-Y415 HydrophobicContact CG-CG 4.29Å; S411-Y415 WeakPolarHBondContact O-CB 3.5Å; S411-Y415 WeakPolarHBondContact O-CD2 3.45Å; S411-Y415 VanDerWaalsContact O-CG 3.24Å; S411-Y415 PolarHBondContact O-N 2.92Å; F412-Y415 PolarHBondContact O-N 3.25Å; Y415-E417 VanDerWaalsContact C-N 3.32Å; Y415-E417 PolarHBondContact O-N 2.9Å; Y415-E418 PolarHBondContact O-N 3.29Å; Y415-V419 WeakPolarHBondContact O-CG2 3.3Å; Y415-V419 PolarHBondContact O-N 3.28Å
416	Q	88.4	Confident	86.9	Confident	30 Å²	30	44.2 Å²	44.2	14%	0.14	22%	0.216	C	C	.	.	H	α-helix	trans	-59.8	-43.3	179.4	-175.3	-165	-21.3	0	0	111.8	M285 F412 L413 V419 G420	M285-Q416 HydrophobicContact CE-CB 4.07Å; F412-Q416 WeakPolarHBondContact O-CB 3.4Å; F412-Q416 PolarHBondContact O-N 3.32Å; L413-Q416 PolarHBondContact O-N 3.16Å; Q416-V419 PolarHBondContact O-N 3.44Å; Q416-G420 PolarHBondContact O-N 3.32Å; Q416-G420 VanDerWaalsContact O-N 3.15Å
417	E	85.9	Confident	86.4	Confident	146 Å²	146	39 Å²	39	68%	0.682	20%	0.203	S	C	*	.	H	α-helix	trans	-61.6	-45.4	178	-174.7	170.8	-168.2	0	0	111.7	L413 Y415	L413-E417 PolarHBondContact O-N 2.68Å; L413-E417 VanDerWaalsContact O-N 3.17Å; Y415-E417 VanDerWaalsContact C-N 3.32Å; Y415-E417 PolarHBondContact O-N 2.9Å
418	E	87.9	Confident	85.7	Confident	52 Å²	52	43.8 Å²	43.8	24%	0.243	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-47.5	176.8	-78.8	-160.2	-159.9	0	0	112.4	K277 L281 L414 Y415 G420 Q421 Y422	K277-E418 IonicContact NZ-OE2 2.82Å; K277-E418 PolarHBondContact NZ-OE2 2.92Å; L281-E418 HydrophobicContact CD1-CB 3.76Å; L281-E418 HydrophobicContact CD2-CB 4.48Å; L414-E418 PolarHBondContact O-N 3.44Å; Y415-E418 PolarHBondContact O-N 3.29Å; E418-G420 VanDerWaalsContact C-N 3.29Å; E418-G420 PolarHBondContact O-N 3.36Å; E418-Q421 PolarHBondContact O-N 3.33Å; E418-Q421 VanDerWaalsContact O-N 3.08Å; E418-Y422 HydrophobicContact CB-CD2 4.46Å; E418-Y422 HydrophobicContact CB-CE2 4.26Å; E418-Y422 WeakPolarHBondContact O-CD2 3.36Å; E418-Y422 PolarHBondContact O-N 3.12Å
419	V	87.9	Confident	84.9	Confident	6 Å²	6	43.9 Å²	43.9	4%	0.036	22%	0.219	C	C	.	.	H	α-helix	trans	-56.6	-45.8	-178.8	170.4	0	0	0	0	110.9	L281 Y282 M285 Y415 Q416 Q421 Y422 V423	L281-V419 HydrophobicContact CB-CG2 3.25Å; L281-V419 HydrophobicContact CD1-CB 4.47Å; L281-V419 HydrophobicContact CD1-CG2 3.6Å; L281-V419 HydrophobicContact CG-CG2 4.01Å; Y282-V419 HydrophobicContact CD2-CG1 4.4Å; Y282-V419 HydrophobicContact CE1-CG1 4.15Å; Y282-V419 HydrophobicContact CE2-CG1 3.7Å; Y282-V419 WeakPolarHBondContact OH-CG1 3.34Å; M285-V419 HydrophobicContact SD-CG2 3.8Å; Y415-V419 WeakPolarHBondContact O-CG2 3.3Å; Y415-V419 PolarHBondContact O-N 3.28Å; Q416-V419 PolarHBondContact O-N 3.44Å; V419-Q421 PolarHBondContact O-N 3Å; V419-Y422 PolarHBondContact O-N 2.96Å; V419-Y422 VanDerWaalsContact O-N 3.13Å; V419-V423 HydrophobicContact CG1-CG2 3.84Å; V419-V423 WeakPolarHBondContact O-CG2 3.38Å; V419-V423 PolarHBondContact O-N 3.04Å
420	G	82.5	Confident	83.8	Confident	21 Å²	21	51.5 Å²	51.5	22%	0.216	25%	0.248	C	C	.	.	H	α-helix	trans	-58.1	-31.8	180	0	0	0	0	0	113.1	Q416 E418 R424	Q416-G420 PolarHBondContact O-N 3.32Å; Q416-G420 VanDerWaalsContact O-N 3.15Å; E418-G420 VanDerWaalsContact C-N 3.29Å; E418-G420 PolarHBondContact O-N 3.36Å; G420-R424 VanDerWaalsContact O-CG 3.3Å; G420-R424 WeakPolarHBondContact O-CG 3.43Å; G420-R424 PolarHBondContact O-NE 3.4Å
421	Q	84.8	Confident	82.4	Confident	111 Å²	111	50.9 Å²	50.9	52%	0.519	26%	0.255	S	S	.	.	H	α-helix	trans	-75.3	-41.7	175.5	-174.8	176	-7.1	0	0	113.1	E418 V419 S425	E418-Q421 PolarHBondContact O-N 3.33Å; E418-Q421 VanDerWaalsContact O-N 3.08Å; V419-Q421 PolarHBondContact O-N 3Å; Q421-S425 PolarHBondContact O-N 3.41Å; Q421-S425 VanDerWaalsContact O-N 3.08Å; Q421-S425 PolarHBondContact O-OG 3.23Å
422	Y	87.4	Confident	81.1	Confident	23 Å²	23	54 Å²	54	9%	0.09	27%	0.272	C	S	.	.	H	α-helix	trans	-75	-35.8	-178.3	-68.8	-68.9	0	0	0	112.9	R273 K277 L281 E418 V419 S425 L426	R273-Y422 HydrophobicContact CG-CE1 4.36Å; R273-Y422 PolarHBondContact NH2-OH 3.37Å; K277-Y422 HydrophobicContact CB-CD1 4.05Å; K277-Y422 HydrophobicContact CB-CD2 3.81Å; K277-Y422 HydrophobicContact CB-CE1 4.28Å; K277-Y422 HydrophobicContact CB-CE2 4.07Å; K277-Y422 HydrophobicContact CB-CG 3.81Å; K277-Y422 HydrophobicContact CD-CD2 4.18Å; K277-Y422 HydrophobicContact CD-CE2 3.64Å; K277-Y422 HydrophobicContact CG-CD1 4.25Å; K277-Y422 HydrophobicContact CG-CD2 4.1Å; K277-Y422 HydrophobicContact CG-CE1 3.96Å; K277-Y422 HydrophobicContact CG-CE2 3.83Å; K277-Y422 HydrophobicContact CG-CG 4.32Å; L281-Y422 HydrophobicContact CD1-CD2 4Å; L281-Y422 HydrophobicContact CD1-CE2 4.36Å; E418-Y422 HydrophobicContact CB-CD2 4.46Å; E418-Y422 HydrophobicContact CB-CE2 4.26Å; E418-Y422 WeakPolarHBondContact O-CD2 3.36Å; E418-Y422 PolarHBondContact O-N 3.12Å; V419-Y422 PolarHBondContact O-N 2.96Å; V419-Y422 VanDerWaalsContact O-N 3.13Å; Y422-S425 WeakPolarHBondContact O-CB 3.4Å; Y422-S425 PolarHBondContact O-N 3.43Å; Y422-L426 PolarHBondContact O-N 3.35Å
423	V	84.3	Confident	79.7	Confident	21 Å²	21	56 Å²	56	13%	0.127	28%	0.281	C	S	.	.	H	α-helix	trans	-62.9	-45.3	174.1	176.5	0	0	0	0	110.7	V278 Y282 L300 V419 S425 L426 V427	V278-V423 HydrophobicContact CG1-CG2 4.09Å; V278-V423 HydrophobicContact CG2-CG2 3.69Å; Y282-V423 HydrophobicContact CE2-CG2 4.39Å; L300-V423 HydrophobicContact CD2-CB 4.09Å; L300-V423 HydrophobicContact CD2-CG1 3.58Å; L300-V423 HydrophobicContact CD2-CG2 4.22Å; V419-V423 HydrophobicContact CG1-CG2 3.84Å; V419-V423 WeakPolarHBondContact O-CG2 3.38Å; V419-V423 PolarHBondContact O-N 3.04Å; V423-S425 VanDerWaalsContact C-N 3.27Å; V423-S425 PolarHBondContact O-N 3.41Å; V423-L426 WeakPolarHBondContact O-CB 3.27Å; V423-L426 PolarHBondContact O-N 3.15Å; V423-L426 VanDerWaalsContact O-N 3.09Å; V423-V427 WeakPolarHBondContact O-CG2 3.5Å; V423-V427 PolarHBondContact O-N 3.17Å
424	R	79.4	Confident	78.2	Confident	81 Å²	81	58 Å²	58	31%	0.306	29%	0.292	S	S	.	.	H	α-helix	trans	-56.5	-44.8	173.1	-77.6	-177.4	-69.7	146.2	-3.2	111.5	G420 L426 V427 Y428	G420-R424 VanDerWaalsContact O-CG 3.3Å; G420-R424 WeakPolarHBondContact O-CG 3.43Å; G420-R424 PolarHBondContact O-NE 3.4Å; R424-L426 VanDerWaalsContact C-N 3.27Å; R424-L426 PolarHBondContact O-N 2.89Å; R424-V427 PolarHBondContact O-N 2.94Å; R424-V427 VanDerWaalsContact O-N 3.13Å; R424-Y428 HydrophobicContact CB-CD2 4.27Å; R424-Y428 HydrophobicContact CB-CE2 4.17Å; R424-Y428 WeakPolarHBondContact O-CD2 3.27Å; R424-Y428 PolarHBondContact O-N 3.04Å
425	S	83.5	Confident	76.5	Confident	39 Å²	39	58.7 Å²	58.7	27%	0.273	30%	0.302	S	S	.	.	H	α-helix	trans	-59.3	-36.8	178.2	-59.3	0	0	0	0	112.1	Q421 Y422 V423 M429	Q421-S425 PolarHBondContact O-N 3.41Å; Q421-S425 VanDerWaalsContact O-N 3.08Å; Q421-S425 PolarHBondContact O-OG 3.23Å; Y422-S425 WeakPolarHBondContact O-CB 3.4Å; Y422-S425 PolarHBondContact O-N 3.43Å; V423-S425 VanDerWaalsContact C-N 3.27Å; V423-S425 PolarHBondContact O-N 3.41Å; S425-M429 WeakPolarHBondContact O-CB 3.45Å; S425-M429 PolarHBondContact O-N 3.15Å
426	L	80.9	Confident	75.1	Confident	48 Å²	48	61.4 Å²	61.4	25%	0.251	32%	0.317	S	S	.	.	H	α-helix	trans	-68	-42.6	173.3	-71.3	172.8	0	0	0	112.8	V278 Y422 V423 R424 M429 Y430	V278-L426 HydrophobicContact CB-CD1 4.34Å; V278-L426 HydrophobicContact CG2-CD1 3.91Å; Y422-L426 PolarHBondContact O-N 3.35Å; V423-L426 WeakPolarHBondContact O-CB 3.27Å; V423-L426 PolarHBondContact O-N 3.15Å; V423-L426 VanDerWaalsContact O-N 3.09Å; R424-L426 VanDerWaalsContact C-N 3.27Å; R424-L426 PolarHBondContact O-N 2.89Å; L426-M429 PolarHBondContact O-N 3.22Å; L426-Y430 PolarHBondContact O-N 3.09Å
427	V	75.1	Confident	74.1	Confident	60 Å²	60	60.7 Å²	60.7	36%	0.364	31%	0.314	S	S	.	.	H	α-helix	trans	-63.1	-47	178.4	175.2	0	0	0	0	110.8	V423 R424 Y430	V423-V427 WeakPolarHBondContact O-CG2 3.5Å; V423-V427 PolarHBondContact O-N 3.17Å; R424-V427 PolarHBondContact O-N 2.94Å; R424-V427 VanDerWaalsContact O-N 3.13Å; V427-Y430 PolarHBondContact O-N 2.78Å
428	Y	72	Confident	73.2	Confident	101 Å²	101	55.1 Å²	55.1	40%	0.396	30%	0.296	S	S	.	.	H	α-helix	trans	-65.3	-39.9	177.1	-74.3	-62.1	0	0	0	112.6	E307 R424 Y430 G431 D432	E307-Y428 PolarHBondContact OE1-OH 3.2Å; R424-Y428 HydrophobicContact CB-CD2 4.27Å; R424-Y428 HydrophobicContact CB-CE2 4.17Å; R424-Y428 WeakPolarHBondContact O-CD2 3.27Å; R424-Y428 PolarHBondContact O-N 3.04Å; Y428-Y430 VanDerWaalsContact C-N 3.29Å; Y428-Y430 PolarHBondContact O-N 3.48Å; Y428-G431 PolarHBondContact O-N 3.42Å; Y428-G431 VanDerWaalsContact O-N 3.15Å; Y428-D432 PolarHBondContact O-N 3.15Å
429	M	71.7	Confident	72.4	Confident	12 Å²	12	53.6 Å²	53.6	6%	0.059	29%	0.292	C	S	.	.	H	α-helix	trans	-58.7	-40.1	178.2	-179.8	57.4	49.9	0	0	112.4	N267 I270 L271 S425 L426 G431 D432 M433	N267-M429 HydrophobicContact CB-CE 4.32Å; N267-M429 HydrophobicContact CB-SD 3.59Å; N267-M429 VanDerWaalsContact CB-SD 3.59Å; N267-M429 VanDerWaalsContact CG-SD 3.53Å; N267-M429 WeakPolarHBondContact OD1-CE 3.45Å; N267-M429 PolarHBondContact OD1-SD 3.49Å; I270-M429 HydrophobicContact CB-CE 3.7Å; I270-M429 HydrophobicContact CD1-CE 3.9Å; I270-M429 HydrophobicContact CG1-CE 4.41Å; I270-M429 HydrophobicContact CG2-CE 3.58Å; L271-M429 HydrophobicContact CB-CG 4.34Å; L271-M429 HydrophobicContact CD1-CG 4.46Å; S425-M429 WeakPolarHBondContact O-CB 3.45Å; S425-M429 PolarHBondContact O-N 3.15Å; L426-M429 PolarHBondContact O-N 3.22Å; M429-G431 VanDerWaalsContact C-N 3.29Å; M429-G431 PolarHBondContact O-N 3.29Å; M429-D432 PolarHBondContact O-N 3.41Å; M429-M433 HydrophobicContact CG-CE 4.18Å; M429-M433 HydrophobicContact CG-CG 4.32Å; M429-M433 HydrophobicContact CG-SD 4.48Å; M429-M433 WeakPolarHBondContact O-CB 3.31Å; M429-M433 WeakPolarHBondContact O-CG 3.3Å; M429-M433 PolarHBondContact O-N 2.86Å; M429-M433 HydrophobicContact SD-CE 3.99Å; M429-M433 HydrophobicContact SD-CG 3.94Å
430	Y	64.9	Low	72	Confident	174 Å²	174	53.5 Å²	53.5	68%	0.682	29%	0.292	S	S	*	.	H	α-helix	trans	-61.9	-39.4	178.1	-171	-98.4	0	0	0	111.9	L426 V427 Y428 L434	L426-Y430 PolarHBondContact O-N 3.09Å; V427-Y430 PolarHBondContact O-N 2.78Å; Y428-Y430 VanDerWaalsContact C-N 3.29Å; Y428-Y430 PolarHBondContact O-N 3.48Å; Y430-L434 HydrophobicContact CD1-CD1 4.17Å; Y430-L434 HydrophobicContact CE1-CD1 3.92Å; Y430-L434 WeakPolarHBondContact O-CD1 3.43Å; Y430-L434 WeakPolarHBondContact O-CG 3.44Å
431	G	62.3	Low	71.9	Confident	43 Å²	43	57.4 Å²	57.4	44%	0.443	31%	0.305	S	S	.	.	H	α-helix	trans	-68.9	-41.5	174.5	0	0	0	0	0	113.4	Y428 M429 L434 S435	Y428-G431 PolarHBondContact O-N 3.42Å; Y428-G431 VanDerWaalsContact O-N 3.15Å; M429-G431 VanDerWaalsContact C-N 3.29Å; M429-G431 PolarHBondContact O-N 3.29Å; G431-L434 PolarHBondContact O-N 3.35Å; G431-S435 PolarHBondContact O-N 2.93Å
432	D	62.6	Low	71.7	Confident	71 Å²	71	56.8 Å²	56.8	38%	0.38	30%	0.3	S	S	.	.	H	α-helix	trans	-76.5	-24.3	-178.5	-161.6	43.2	0	0	0	113.3	Y428 M429 L434 S435 N436	Y428-D432 PolarHBondContact O-N 3.15Å; M429-D432 PolarHBondContact O-N 3.41Å; D432-L434 VanDerWaalsContact C-N 3.25Å; D432-L434 PolarHBondContact O-N 3.35Å; D432-S435 PolarHBondContact O-OG 3.49Å; D432-S435 VanDerWaalsContact O-OG 3.06Å; D432-S435 PolarHBondContact OD1-OG 3.03Å; D432-N436 VanDerWaalsContact CG-ND2 3.28Å; D432-N436 PolarHBondContact O-ND2 3.15Å; D432-N436 PolarHBondContact OD1-ND2 3.36Å; D432-N436 PolarHBondContact OD2-ND2 3.18Å
433	M	62.4	Low	71.6	Confident	42 Å²	42	55.7 Å²	55.7	21%	0.207	30%	0.296	C	S	.	.	H	α-helix	trans	-66.6	-29.1	169.8	-84.3	-167.9	173.4	0	0	112.2	W263 N267 L271 M429	W263-M433 HydrophobicContact CZ2-CB 4.29Å; W263-M433 HydrophobicContact CZ2-CG 4.25Å; W263-M433 WeakPolarHBondContact CZ2-O 3.41Å; N267-M433 HydrophobicContact CB-CE 3.79Å; L271-M433 HydrophobicContact CB-CE 4.4Å; L271-M433 HydrophobicContact CD1-CE 3.54Å; L271-M433 HydrophobicContact CD1-SD 4.09Å; M429-M433 HydrophobicContact CG-CE 4.18Å; M429-M433 HydrophobicContact CG-CG 4.32Å; M429-M433 HydrophobicContact CG-SD 4.48Å; M429-M433 WeakPolarHBondContact O-CB 3.31Å; M429-M433 WeakPolarHBondContact O-CG 3.3Å; M429-M433 PolarHBondContact O-N 2.86Å; M429-M433 HydrophobicContact SD-CE 3.99Å; M429-M433 HydrophobicContact SD-CG 3.94Å
434	L	57.6	Low	71.8	Confident	74 Å²	74	55.3 Å²	55.3	39%	0.387	29%	0.293	S	S	.	.	H	α-helix	trans	-82.8	-29.6	-178.2	-71.9	163.2	0	0	0	112.8	Y430 G431 D432	Y430-L434 HydrophobicContact CD1-CD1 4.17Å; Y430-L434 HydrophobicContact CE1-CD1 3.92Å; Y430-L434 WeakPolarHBondContact O-CD1 3.43Å; Y430-L434 WeakPolarHBondContact O-CG 3.44Å; G431-L434 PolarHBondContact O-N 3.35Å; D432-L434 VanDerWaalsContact C-N 3.25Å; D432-L434 PolarHBondContact O-N 3.35Å
435	S	55.2	Low	72.2	Confident	76 Å²	76	54.7 Å²	54.7	53%	0.531	30%	0.301	S	S	.	.	H	α-helix	trans	-80.7	-28.4	-174.7	57.5	0	0	0	0	114.2	G431 D432	G431-S435 PolarHBondContact O-N 2.93Å; D432-S435 PolarHBondContact O-OG 3.49Å; D432-S435 VanDerWaalsContact O-OG 3.06Å; D432-S435 PolarHBondContact OD1-OG 3.03Å
436	N	60.5	Low	72.3	Confident	59 Å²	59	54.2 Å²	54.2	32%	0.316	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	1.5	-166	-74.6	-51.4	0	0	0	115.2	W263 D432 G438 A439	W263-N436 VanDerWaalsContact CD1-CB 3.46Å; W263-N436 HydrophobicContact CD2-CB 4.48Å; W263-N436 HydrophobicContact CG-CB 4.32Å; W263-N436 HydrophobicContact CZ2-CB 4.26Å; W263-N436 PolarHBondContact NE1-ND2 3.23Å; D432-N436 VanDerWaalsContact CG-ND2 3.28Å; D432-N436 PolarHBondContact O-ND2 3.15Å; D432-N436 PolarHBondContact OD1-ND2 3.36Å; D432-N436 PolarHBondContact OD2-ND2 3.18Å; N436-G438 PolarHBondContact O-N 3.1Å; N436-A439 PolarHBondContact O-N 3.29Å
437	V	67.1	Low	72.6	Confident	14 Å²	14	53.5 Å²	53.5	9%	0.085	29%	0.29	C	S	.	.	H	α-helix	trans	-61.3	-27.8	175.4	-177.2	0	0	0	0	111.6	R134 L137 A439 A440 E441	R134-V437 HydrophobicContact CB-CG1 4.45Å; R134-V437 HydrophobicContact CG-CB 4.42Å; R134-V437 HydrophobicContact CG-CG1 3.82Å; R134-V437 HydrophobicContact CG-CG2 4.36Å; L137-V437 HydrophobicContact CD1-CG1 3.64Å; V437-A439 VanDerWaalsContact C-N 3.3Å; V437-A439 PolarHBondContact O-N 3.03Å; V437-A440 PolarHBondContact O-N 2.97Å; V437-E441 WeakPolarHBondContact O-CB 3.48Å; V437-E441 PolarHBondContact O-N 3.45Å
438	G	67.8	Low	73.3	Confident	29 Å²	29	54.8 Å²	54.8	30%	0.299	29%	0.294	S	S	.	.	H	α-helix	trans	-63.7	-27	-177.9	0	0	0	0	0	115	N436 K442	N436-G438 PolarHBondContact O-N 3.1Å; G438-K442 VanDerWaalsContact O-CG 3.29Å; G438-K442 WeakPolarHBondContact O-CG 3.29Å; G438-K442 PolarHBondContact O-N 3.28Å
439	A	71.6	Confident	74	Confident	21 Å²	21	53.4 Å²	53.4	17%	0.174	29%	0.288	C	S	.	.	H	α-helix	trans	-73.6	-43.3	174.9	0	0	0	0	0	111.3	N436 V437 K442 V443	N436-A439 PolarHBondContact O-N 3.29Å; V437-A439 VanDerWaalsContact C-N 3.3Å; V437-A439 PolarHBondContact O-N 3.03Å; A439-K442 PolarHBondContact O-N 3.24Å; A439-V443 WeakPolarHBondContact O-CG2 3.32Å; A439-V443 PolarHBondContact O-N 3.4Å; A439-V443 VanDerWaalsContact O-N 3.13Å
440	A	78.3	Confident	74.8	Confident	4 Å²	4	63.5 Å²	63.5	3%	0.033	33%	0.326	C	S	.	.	H	α-helix	trans	-64.8	-42.2	176.1	0	0	0	0	0	111.4	L141 M260 V437 K442 V443 F444	L141-A440 HydrophobicContact CD1-CB 4.08Å; M260-A440 HydrophobicContact CE-CB 4.3Å; M260-A440 HydrophobicContact CG-CB 4.06Å; M260-A440 HydrophobicContact SD-CB 4.3Å; V437-A440 PolarHBondContact O-N 2.97Å; A440-K442 VanDerWaalsContact C-N 3.32Å; A440-K442 PolarHBondContact O-N 3.35Å; A440-V443 PolarHBondContact O-N 3.45Å; A440-F444 HydrophobicContact CB-CD2 4.43Å; A440-F444 HydrophobicContact CB-CE2 4.42Å; A440-F444 WeakPolarHBondContact O-CD2 3.47Å; A440-F444 PolarHBondContact O-N 2.97Å
441	E	81.6	Confident	75.8	Confident	103 Å²	103	57.6 Å²	57.6	48%	0.481	31%	0.309	S	S	.	.	H	α-helix	trans	-55.5	-46.2	176.5	-175.5	173.6	-166.9	0	0	111.8	L137 V437 F444 S445	L137-E441 HydrophobicContact CD1-CB 3.84Å; L137-E441 HydrophobicContact CD1-CG 4.2Å; V437-E441 WeakPolarHBondContact O-CB 3.48Å; V437-E441 PolarHBondContact O-N 3.45Å; E441-F444 PolarHBondContact O-N 2.68Å; E441-S445 WeakPolarHBondContact O-CB 3.39Å; E441-S445 PolarHBondContact O-N 3.2Å
442	K	79.8	Confident	76.7	Confident	97 Å²	97	62 Å²	62	42%	0.422	32%	0.322	S	S	.	.	H	α-helix	trans	-64.5	-47.6	177.2	-68.8	175.4	-165.7	176.4	0	112.1	R252 G438 A439 A440 F444 S445 Y446	R252-K442 VanDerWaalsContact NH1-CD 3.27Å; G438-K442 VanDerWaalsContact O-CG 3.29Å; G438-K442 WeakPolarHBondContact O-CG 3.29Å; G438-K442 PolarHBondContact O-N 3.28Å; A439-K442 PolarHBondContact O-N 3.24Å; A440-K442 VanDerWaalsContact C-N 3.32Å; A440-K442 PolarHBondContact O-N 3.35Å; K442-F444 VanDerWaalsContact C-N 3.28Å; K442-F444 PolarHBondContact O-N 3.42Å; K442-S445 WeakPolarHBondContact CA-OG 3.08Å; K442-S445 PolarHBondContact O-N 2.96Å; K442-S445 VanDerWaalsContact O-N 3.13Å; K442-S445 PolarHBondContact O-OG 3.18Å; K442-Y446 WeakPolarHBondContact O-CD2 3.47Å; K442-Y446 PolarHBondContact O-N 3.43Å; K442-Y446 VanDerWaalsContact O-N 3.15Å
443	V	85.8	Confident	77.4	Confident	1 Å²	1	62 Å²	62	1%	0.006	32%	0.322	C	S	.	.	H	α-helix	trans	-59.7	-42.7	178.9	172.9	0	0	0	0	110.7	I225 L229 D256 T257 M260 A439 A440 Y446 L447	I225-V443 HydrophobicContact CG2-CG1 3.98Å; L229-V443 HydrophobicContact CD2-CG1 4.37Å; D256-V443 HydrophobicContact CB-CG2 3.86Å; T257-V443 HydrophobicContact CG2-CG2 4.47Å; M260-V443 HydrophobicContact CE-CG1 4.36Å; M260-V443 HydrophobicContact SD-CB 3.57Å; M260-V443 VanDerWaalsContact SD-CB 3.57Å; M260-V443 HydrophobicContact SD-CG1 3.54Å; M260-V443 VanDerWaalsContact SD-CG1 3.54Å; M260-V443 HydrophobicContact SD-CG2 3.98Å; A439-V443 WeakPolarHBondContact O-CG2 3.32Å; A439-V443 PolarHBondContact O-N 3.4Å; A439-V443 VanDerWaalsContact O-N 3.13Å; A440-V443 PolarHBondContact O-N 3.45Å; V443-Y446 PolarHBondContact O-N 3.49Å; V443-L447 HydrophobicContact CG1-CD1 3.91Å; V443-L447 HydrophobicContact CG1-CG 4.48Å; V443-L447 WeakPolarHBondContact O-CG 3.42Å; V443-L447 PolarHBondContact O-N 3.05Å
444	F	87.1	Confident	78.2	Confident	12 Å²	12	62.7 Å²	62.7	5%	0.053	33%	0.33	C	S	.	.	H	α-helix	trans	-67.3	-35.2	175.4	-74.6	-57.7	0	0	0	113.3	L137 R140 L141 L144 M260 A440 E441 K442 Y446 L447 D448	L137-F444 HydrophobicContact CD2-CB 4.3Å; L137-F444 HydrophobicContact CD2-CD2 3.64Å; L137-F444 HydrophobicContact CD2-CE2 4.28Å; L137-F444 HydrophobicContact CD2-CG 4.27Å; R140-F444 HydrophobicContact CB-CE1 4.27Å; R140-F444 HydrophobicContact CB-CE2 4.32Å; R140-F444 HydrophobicContact CB-CZ 3.85Å; L141-F444 HydrophobicContact CD2-CE2 4.26Å; L141-F444 HydrophobicContact CD2-CZ 4.29Å; L141-F444 HydrophobicContact CG-CE2 3.93Å; L141-F444 HydrophobicContact CG-CZ 4.16Å; L144-F444 HydrophobicContact CD1-CE1 3.64Å; L144-F444 HydrophobicContact CD1-CZ 3.63Å; M260-F444 HydrophobicContact CE-CD1 4.41Å; M260-F444 HydrophobicContact CE-CD2 3.86Å; M260-F444 HydrophobicContact CE-CE1 3.87Å; M260-F444 HydrophobicContact CE-CE2 3.28Å; M260-F444 HydrophobicContact CE-CG 4.41Å; M260-F444 HydrophobicContact CE-CZ 3.28Å; A440-F444 HydrophobicContact CB-CD2 4.43Å; A440-F444 HydrophobicContact CB-CE2 4.42Å; A440-F444 WeakPolarHBondContact O-CD2 3.47Å; A440-F444 PolarHBondContact O-N 2.97Å; E441-F444 PolarHBondContact O-N 2.68Å; K442-F444 VanDerWaalsContact C-N 3.28Å; K442-F444 PolarHBondContact O-N 3.42Å; F444-Y446 VanDerWaalsContact C-N 3.26Å; F444-Y446 PolarHBondContact O-N 2.91Å; F444-L447 HydrophobicContact CD1-CD1 4.01Å; F444-L447 HydrophobicContact CE1-CD1 4.38Å; F444-L447 PolarHBondContact O-N 3.18Å; F444-D448 VanDerWaalsContact O-CB 3.3Å; F444-D448 WeakPolarHBondContact O-CB 3.34Å; F444-D448 PolarHBondContact O-N 3.04Å
445	S	87.6	Confident	79.2	Confident	68 Å²	68	67.8 Å²	67.8	48%	0.476	35%	0.351	S	S	.	.	H	α-helix	trans	-62.4	-35.1	176.2	71.2	0	0	0	0	112.1	E441 K442 R449	E441-S445 WeakPolarHBondContact O-CB 3.39Å; E441-S445 PolarHBondContact O-N 3.2Å; K442-S445 WeakPolarHBondContact CA-OG 3.08Å; K442-S445 PolarHBondContact O-N 2.96Å; K442-S445 VanDerWaalsContact O-N 3.13Å; K442-S445 PolarHBondContact O-OG 3.18Å; S445-R449 WeakPolarHBondContact O-CB 3.44Å; S445-R449 PolarHBondContact O-N 3.31Å
446	Y	86.3	Confident	80.4	Confident	30 Å²	30	68.6 Å²	68.6	12%	0.118	36%	0.355	C	S	.	.	H	α-helix	trans	-74.8	-39.7	172.8	-73.1	-79.8	0	0	0	112.4	L233 F240 E248 L249 R252 K442 V443 F444 D448 R449	L233-Y446 HydrophobicContact CD2-CD1 4.04Å; F240-Y446 AromaticContact CE2-CD1 3.77Å; F240-Y446 HydrophobicContact CE2-CD1 3.77Å; F240-Y446 AromaticContact CE2-CE1 3.48Å; F240-Y446 HydrophobicContact CE2-CE1 3.48Å; F240-Y446 VanDerWaalsContact CE2-CE1 3.48Å; F240-Y446 AromaticContact CZ-CD1 3.51Å; F240-Y446 HydrophobicContact CZ-CD1 3.51Å; F240-Y446 AromaticContact CZ-CE1 3.37Å; F240-Y446 HydrophobicContact CZ-CE1 3.37Å; E248-Y446 PolarHBondContact OE1-OH 3.42Å; L249-Y446 HydrophobicContact CD2-CE1 4.36Å; R252-Y446 HydrophobicContact CG-CD2 4.43Å; R252-Y446 HydrophobicContact CG-CE2 3.9Å; K442-Y446 WeakPolarHBondContact O-CD2 3.47Å; K442-Y446 PolarHBondContact O-N 3.43Å; K442-Y446 VanDerWaalsContact O-N 3.15Å; V443-Y446 PolarHBondContact O-N 3.49Å; F444-Y446 VanDerWaalsContact C-N 3.26Å; F444-Y446 PolarHBondContact O-N 2.91Å; Y446-D448 VanDerWaalsContact C-N 3.35Å; Y446-D448 PolarHBondContact O-N 2.89Å; Y446-R449 PolarHBondContact O-N 2.95Å
447	L	88.1	Confident	81.7	Confident	33 Å²	33	66.5 Å²	66.5	17%	0.173	35%	0.348	C	S	.	.	H	α-helix	trans	-63.5	-40.2	177.4	-78.6	168.1	0	0	0	112.6	Q228 L229 S232 V443 F444	Q228-L447 HydrophobicContact CB-CD2 3.97Å; L229-L447 HydrophobicContact CB-CD2 4.16Å; L229-L447 HydrophobicContact CD1-CD2 4.33Å; L229-L447 HydrophobicContact CD1-CG 4.16Å; S232-L447 PolarHBondContact OG-O 3.13Å; V443-L447 HydrophobicContact CG1-CD1 3.91Å; V443-L447 HydrophobicContact CG1-CG 4.48Å; V443-L447 WeakPolarHBondContact O-CG 3.42Å; V443-L447 PolarHBondContact O-N 3.05Å; F444-L447 HydrophobicContact CD1-CD1 4.01Å; F444-L447 HydrophobicContact CE1-CD1 4.38Å; F444-L447 PolarHBondContact O-N 3.18Å
448	D	88.8	Confident	83	Confident	86 Å²	86	73.6 Å²	73.6	46%	0.46	38%	0.383	S	S	.	.	S	Bend	trans	-86.8	-9.9	-176.5	-67.1	-19.4	0	0	0	113.2	R140 F444 Y446 R450	R140-D448 IonicContact CZ-OD2 3.68Å; R140-D448 IonicContact NH1-OD1 3.92Å; R140-D448 IonicContact NH1-OD2 2.72Å; R140-D448 PolarHBondContact NH1-OD2 3.28Å; R140-D448 IonicContact NH2-OD2 3.66Å; F444-D448 VanDerWaalsContact O-CB 3.3Å; F444-D448 WeakPolarHBondContact O-CB 3.34Å; F444-D448 PolarHBondContact O-N 3.04Å; Y446-D448 VanDerWaalsContact C-N 3.35Å; Y446-D448 PolarHBondContact O-N 2.89Å; D448-R450 PolarHBondContact O-N 3.3Å
449	R	87.8	Confident	84.2	Confident	72 Å²	72	74.7 Å²	74.7	27%	0.272	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-60.1	121.6	178.1	-171.8	-178.7	-177.1	-88.1	1	108.9	Q236 D237 S445 Y446	Q236-R449 PolarHBondContact NE2-O 3.17Å; Q236-R449 VanDerWaalsContact OE1-CG 3.32Å; Q236-R449 PolarHBondContact OE1-O 3.39Å; D237-R449 IonicContact OD1-CZ 3.47Å; D237-R449 IonicContact OD1-NH1 3.36Å; D237-R449 PolarHBondContact OD1-NH1 3.42Å; D237-R449 IonicContact OD1-NH2 2.68Å; D237-R449 PolarHBondContact OD1-NH2 3.08Å; D237-R449 IonicContact OD2-NH2 3.33Å; S445-R449 WeakPolarHBondContact O-CB 3.44Å; S445-R449 PolarHBondContact O-N 3.31Å; Y446-R449 PolarHBondContact O-N 2.95Å
450	R	86.8	Confident	85.2	Confident	224 Å²	224	76.4 Å²	76.4	85%	0.845	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-86.6	131.2	171.2	-64.5	-172.6	178.7	-165.9	-0.7	108.8	D448	D448-R450 PolarHBondContact O-N 3.3Å
451	P	85.9	Confident	85.9	Confident	50 Å²	50	77.9 Å²	77.9	33%	0.325	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-60.7	143.9	174.9	24.2	-32	0	0	0	110.4	R235 L453	R235-P451 VanDerWaalsContact O-CB 3.3Å; R235-P451 WeakPolarHBondContact O-CB 3.43Å; R235-P451 WeakPolarHBondContact O-CG 3.32Å; P451-L453 HydrophobicContact CB-CB 4.43Å; P451-L453 HydrophobicContact CB-CD1 4.36Å; P451-L453 HydrophobicContact CB-CG 4.49Å; P451-L453 PolarHBondContact O-N 3.27Å
452	N	82.1	Confident	86.2	Confident	136 Å²	136	79.9 Å²	79.9	73%	0.727	43%	0.427	S	S	*	.	S	Bend	trans	-83.5	58.7	170.4	-168.4	27.4	0	0	0	110.5	D237	D237-N452 PolarHBondContact OD1-N 3.32Å; D237-N452 VanDerWaalsContact OD1-N 3.16Å
453	L	77.5	Confident	86.6	Confident	70 Å²	70	83.2 Å²	83.2	37%	0.366	44%	0.437	S	S	.	.	S	Bend	trans	-128.2	143.9	177.2	-70.2	167.6	0	0	0	108.6	D237 P451	D237-L453 HydrophobicContact CB-CD1 4.2Å; D237-L453 HydrophobicContact CB-CG 4.01Å; P451-L453 HydrophobicContact CB-CB 4.43Å; P451-L453 HydrophobicContact CB-CD1 4.36Å; P451-L453 HydrophobicContact CB-CG 4.49Å; P451-L453 PolarHBondContact O-N 3.27Å
454	P	78.2	Confident	86.9	Confident	58 Å²	58	83.3 Å²	83.3	38%	0.377	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-58.5	153.4	169.1	24.8	-30.4	0	0	0	109.7	Q521 T535	P454-Q521 HydrophobicContact CG-CG 4.23Å; P454-T535 HydrophobicContact CB-CG2 4.41Å; P454-T535 HydrophobicContact CG-CG2 3.71Å
455	Q	80.3	Confident	87.1	Confident	180 Å²	180	88.2 Å²	88.2	84%	0.841	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-59.9	138.8	171.5	-68	-172.8	3.9	0	0	108.6	G457	Q455-G457 PolarHBondContact O-N 2.91Å
456	P	78.7	Confident	87.3	Confident	93 Å²	93	85 Å²	85	60%	0.604	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-58.6	134.7	177.7	25.3	-32.9	0	0	0	108.9	H539	P456-H539 HydrophobicContact CB-CB 4.33Å
457	G	88.8	Confident	87.7	Confident	16 Å²	16	87.9 Å²	87.9	17%	0.165	45%	0.449	C	S	.	.			trans	-70.9	-176.8	172.5	0	0	0	0	0	112.1	Q455 T535 E536 Y537 D538	Q455-G457 PolarHBondContact O-N 2.91Å; G457-T535 PolarHBondContact N-O 3.03Å; G457-E536 CarbonylContact C-O 3.58Å; G457-E536 WeakPolarHBondContact CA-O 2.85Å; G457-Y537 PolarHBondContact N-O 3.43Å; G457-D538 WeakPolarHBondContact O-CA 3.28Å
458	I	93.9	Very high	88.1	Confident	163 Å²	163	86.4 Å²	86.4	84%	0.836	44%	0.441	S	S	*	.			trans	-116	-8.1	-172.3	-51.3	170.4	0	0	0	110.7	A460 E536	I458-A460 PolarHBondContact O-N 3.39Å; I458-E536 PolarHBondContact N-O 3Å; I458-E536 VanDerWaalsContact N-O 3.12Å
459	L	93.1	Very high	88.5	Confident	52 Å²	52	83.5 Å²	83.5	27%	0.272	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-73	119.7	-171.2	-164.9	142	0	0	0	110.7	P461 E532 E536 Y537 D538	L459-P461 VanDerWaalsContact CD2-CD 3.41Å; L459-P461 HydrophobicContact CD2-CG 3.95Å; L459-E532 HydrophobicContact CD1-CG 4.16Å; L459-E536 WeakPolarHBondContact CB-O 3.27Å; L459-E536 PolarHBondContact N-O 3.23Å; L459-Y537 HydrophobicContact CD2-CD1 3.41Å; L459-Y537 VanDerWaalsContact CD2-CD1 3.41Å; L459-Y537 HydrophobicContact CD2-CD2 4.37Å; L459-Y537 HydrophobicContact CD2-CE1 3.1Å; L459-Y537 HydrophobicContact CD2-CE2 4.12Å; L459-Y537 HydrophobicContact CD2-CG 4.06Å; L459-Y537 VanDerWaalsContact CD2-CZ 3.49Å; L459-Y537 WeakPolarHBondContact O-CA 3.5Å; L459-D538 PolarHBondContact O-N 3.23Å
460	A	93.4	Very high	88.9	Confident	56 Å²	56	80.2 Å²	80.2	46%	0.463	41%	0.413	S	S	.	.			trans	-145.5	68.5	-179.6	0	0	0	0	0	110.4	I458 D538 Y541	I458-A460 PolarHBondContact O-N 3.39Å; A460-D538 HydrophobicContact CB-CB 4.46Å; A460-Y541 HydrophobicContact CB-CD1 4.37Å; A460-Y541 HydrophobicContact CB-CD2 3.72Å; A460-Y541 HydrophobicContact CB-CE2 4.33Å; A460-Y541 HydrophobicContact CB-CG 3.74Å
461	P	93.3	Very high	89.4	Confident	36 Å²	36	73.3 Å²	73.3	23%	0.234	39%	0.39	C	S	.	.			trans	-66.5	148	-173.7	26.7	-34.9	0	0	0	111.2	L459 W463 L464 Y537 Y541	L459-P461 VanDerWaalsContact CD2-CD 3.41Å; L459-P461 HydrophobicContact CD2-CG 3.95Å; P461-W463 PolarHBondContact O-N 3.46Å; P461-L464 HydrophobicContact CG-CD1 4.32Å; P461-Y537 HydrophobicContact CG-CE1 4.34Å; P461-Y541 HydrophobicContact CG-CE1 4.26Å; P461-Y541 WeakPolarHBondContact O-CE2 3.37Å; P461-Y541 PolarHBondContact O-OH 2.72Å
462	P	87.9	Confident	89.8	Confident	144 Å²	144	75.8 Å²	75.8	94%	0.935	40%	0.4	S	S	*	.	S	Bend	trans	-66.9	-26.4	179.9	27.6	-34.5	0	0	0	112.4
463	W	87.7	Confident	90.5	Very high	167 Å²	167	69.3 Å²	69.3	63%	0.633	37%	0.366	S	S	*	.			trans	-128.9	143.7	178.4	-174.3	-98.2	0	0	0	110.4	P461 R626	P461-W463 PolarHBondContact O-N 3.46Å; W463-R626 VanDerWaalsContact CE3-NH2 3.35Å
464	L	91.5	Very high	91.3	Very high	3 Å²	3	67.8 Å²	67.8	2%	0.016	36%	0.361	C	S	.	.			trans	-144.4	126.3	-178	-162.2	141.3	0	0	0	107	P461 L529 D530 Y537 Y541 Q545 R626	P461-L464 HydrophobicContact CG-CD1 4.32Å; L464-L529 HydrophobicContact CD1-CD2 3.83Å; L464-L529 HydrophobicContact CD1-CG 4.28Å; L464-L529 HydrophobicContact CD2-CD1 3.98Å; L464-L529 HydrophobicContact CD2-CD2 4.1Å; L464-L529 HydrophobicContact CD2-CG 4.09Å; L464-D530 WeakPolarHBondContact CA-OD2 3.39Å; L464-D530 VanDerWaalsContact CG-OD2 3.27Å; L464-D530 WeakPolarHBondContact CG-OD2 3.26Å; L464-Y537 HydrophobicContact CD1-CE1 3.77Å; L464-Y541 HydrophobicContact CD1-CE1 3.67Å; L464-Y541 WeakPolarHBondContact CD1-OH 3.36Å; L464-Q545 HydrophobicContact CD1-CG 4.46Å; L464-R626 HydrophobicContact CB-CG 4.29Å; L464-R626 HydrophobicContact CD2-CB 3.92Å; L464-R626 HydrophobicContact CD2-CG 4.16Å; L464-R626 WeakPolarHBondContact O-CD 3.43Å; L464-R626 PolarHBondContact O-NE 3.19Å
465	E	90.5	Very high	92.1	Very high	116 Å²	116	65.3 Å²	65.3	54%	0.542	34%	0.344	S	S	.	.			trans	-73.3	-36.9	179.9	-64.5	-175.2	174	0	0	110.6	P495 D530	E465-P495 HydrophobicContact CB-CG 4.25Å; E465-D530 PolarHBondContact N-OD2 3.32Å
466	G	91.8	Very high	92.6	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.311	C	S	.	.			trans	92.2	23.3	176.8	0	0	0	0	0	113.4	D530 T655	G466-D530 PolarHBondContact N-OD1 2.9Å; G466-D530 PolarHBondContact N-OD2 2.92Å; G466-T655 WeakPolarHBondContact O-CB 3.37Å; G466-T655 PolarHBondContact O-OG1 3.32Å
467	R	95.7	Very high	93.2	Very high	90 Å²	90	56.1 Å²	56.1	34%	0.34	29%	0.294	S	S	.	.			trans	-78.4	123.2	174.6	-174.8	170.6	-177.9	-109.6	-13.3	109.3	E469 T492 P495 L529 D530	R467-E469 IonicContact CZ-OE1 2.74Å; R467-E469 IonicContact NE-OE1 2.7Å; R467-E469 IonicContact NH1-OE1 3.57Å; R467-E469 PolarHBondContact NH1-OE1 3.44Å; R467-E469 IonicContact NH2-OE1 3.69Å; R467-E469 PolarHBondContact NH2-OE1 3.1Å; R467-T492 HydrophobicContact CG-CG2 4.23Å; R467-P495 HydrophobicContact CB-CG 3.98Å; R467-L529 WeakPolarHBondContact O-CA 3.44Å; R467-D530 WeakPolarHBondContact CB-OD1 3.12Å; R467-D530 PolarHBondContact N-OD1 3.45Å; R467-D530 PolarHBondContact O-N 2.93Å
468	V	96.8	Very high	92.9	Very high	3 Å²	3	58.5 Å²	58.5	2%	0.018	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	130.6	-179.2	-170.2	0	0	0	0	110.7	F470 T492 L493 L516 L528 L529 V627	V468-F470 HydrophobicContact CG1-CE2 4.3Å; V468-T492 CarbonylContact O-C 3.38Å; V468-T492 VanDerWaalsContact O-CA 3.31Å; V468-T492 WeakPolarHBondContact O-CA 3.01Å; V468-L493 HydrophobicContact CB-CB 4.05Å; V468-L493 HydrophobicContact CB-CD1 4.1Å; V468-L493 HydrophobicContact CB-CG 4.27Å; V468-L493 HydrophobicContact CG2-CB 4.49Å; V468-L493 HydrophobicContact CG2-CD1 4.36Å; V468-L493 PolarHBondContact N-O 3.26Å; V468-L493 PolarHBondContact O-N 3Å; V468-L516 HydrophobicContact CB-CD2 4.45Å; V468-L516 HydrophobicContact CG1-CD2 3.45Å; V468-L516 VanDerWaalsContact CG1-CD2 3.45Å; V468-L528 WeakPolarHBondContact CA-O 3.42Å; V468-L529 HydrophobicContact CG2-CD1 3.78Å; V468-V627 HydrophobicContact CG2-CG1 4.29Å; V468-V627 HydrophobicContact CG2-CG2 3.95Å
469	E	96.9	Very high	92.4	Very high	25 Å²	25	58.9 Å²	58.9	12%	0.117	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	128.2	179.1	-57.9	-176.7	178.9	0	0	111.6	R467 Q471 T492 L527 L528	R467-E469 IonicContact CZ-OE1 2.74Å; R467-E469 IonicContact NE-OE1 2.7Å; R467-E469 IonicContact NH1-OE1 3.57Å; R467-E469 PolarHBondContact NH1-OE1 3.44Å; R467-E469 IonicContact NH2-OE1 3.69Å; R467-E469 PolarHBondContact NH2-OE1 3.1Å; E469-Q471 HydrophobicContact CB-CG 4.48Å; E469-Q471 PolarHBondContact OE2-NE2 2.9Å; E469-T492 HydrophobicContact CG-CG2 4.08Å; E469-L527 WeakPolarHBondContact O-CA 3.49Å; E469-L528 HydrophobicContact CB-CB 4.25Å; E469-L528 PolarHBondContact N-O 3.49Å; E469-L528 PolarHBondContact O-N 3.25Å
470	F	96.8	Very high	92	Very high	2 Å²	2	63.6 Å²	63.6	1%	0.009	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.1	163.7	-76.3	-112.6	0	0	0	107.7	V468 V473 L489 T490 F491 V512 L516 L527	V468-F470 HydrophobicContact CG1-CE2 4.3Å; F470-V473 HydrophobicContact CB-CG2 4.04Å; F470-V473 HydrophobicContact CD1-CB 3.92Å; F470-V473 HydrophobicContact CD1-CG1 4.17Å; F470-V473 HydrophobicContact CD1-CG2 3.79Å; F470-V473 HydrophobicContact CE1-CG1 4.49Å; F470-V473 HydrophobicContact CG-CG2 4.28Å; F470-L489 HydrophobicContact CD1-CB 4.47Å; F470-T490 VanDerWaalsContact O-CA 3.26Å; F470-T490 WeakPolarHBondContact O-CA 3.49Å; F470-F491 HydrophobicContact CB-CD1 3.77Å; F470-F491 HydrophobicContact CB-CE1 3.79Å; F470-F491 HydrophobicContact CB-CG 4.35Å; F470-F491 HydrophobicContact CB-CZ 4.36Å; F470-F491 HydrophobicContact CD1-CD1 4.43Å; F470-F491 AromaticContact CD1-CE1 3.62Å; F470-F491 HydrophobicContact CD1-CE1 3.62Å; F470-F491 AromaticContact CD1-CZ 3.95Å; F470-F491 HydrophobicContact CD1-CZ 3.95Å; F470-F491 HydrophobicContact CD2-CD1 4.15Å; F470-F491 HydrophobicContact CD2-CD2 4.19Å; F470-F491 AromaticContact CD2-CE1 3.54Å; F470-F491 HydrophobicContact CD2-CE1 3.54Å; F470-F491 AromaticContact CD2-CE2 3.57Å; F470-F491 HydrophobicContact CD2-CE2 3.57Å; F470-F491 HydrophobicContact CD2-CG 4.47Å; F470-F491 AromaticContact CD2-CZ 3.22Å; F470-F491 HydrophobicContact CD2-CZ 3.22Å; F470-F491 HydrophobicContact CE1-CE1 4.08Å; F470-F491 HydrophobicContact CE1-CZ 4.04Å; F470-F491 AromaticContact CE2-CE1 3.99Å; F470-F491 HydrophobicContact CE2-CE1 3.99Å; F470-F491 AromaticContact CE2-CE2 3.77Å; F470-F491 HydrophobicContact CE2-CE2 3.77Å; F470-F491 AromaticContact CE2-CZ 3.31Å; F470-F491 HydrophobicContact CE2-CZ 3.31Å; F470-F491 AromaticContact CG-CD1 3.88Å; F470-F491 HydrophobicContact CG-CD1 3.88Å; F470-F491 AromaticContact CG-CE1 3.35Å; F470-F491 HydrophobicContact CG-CE1 3.35Å; F470-F491 HydrophobicContact CG-CE2 4.25Å; F470-F491 AromaticContact CG-CZ 3.58Å; F470-F491 HydrophobicContact CG-CZ 3.58Å; F470-F491 HydrophobicContact CZ-CE1 4.26Å; F470-F491 AromaticContact CZ-CZ 3.75Å; F470-F491 HydrophobicContact CZ-CZ 3.75Å; F470-F491 PolarHBondContact N-O 2.87Å; F470-F491 PolarHBondContact O-N 3.24Å; F470-V512 HydrophobicContact CE1-CG1 4.05Å; F470-V512 HydrophobicContact CE2-CG1 4.38Å; F470-V512 HydrophobicContact CZ-CG1 3.61Å; F470-L516 HydrophobicContact CE2-CD1 4.45Å; F470-L516 HydrophobicContact CE2-CD2 3.63Å; F470-L516 HydrophobicContact CE2-CG 4.04Å; F470-L516 HydrophobicContact CZ-CD1 4.41Å; F470-L516 HydrophobicContact CZ-CD2 3.88Å; F470-L516 HydrophobicContact CZ-CG 3.84Å; F470-L527 HydrophobicContact CB-CD1 4.19Å; F470-L527 HydrophobicContact CD1-CD1 3.24Å; F470-L527 HydrophobicContact CD2-CD1 3.66Å; F470-L527 HydrophobicContact CE1-CD1 3.29Å; F470-L527 HydrophobicContact CE1-CD2 4.44Å; F470-L527 HydrophobicContact CE1-CG 4.48Å; F470-L527 HydrophobicContact CE2-CD1 3.71Å; F470-L527 HydrophobicContact CE2-CD2 4.36Å; F470-L527 HydrophobicContact CE2-CG 4.37Å; F470-L527 HydrophobicContact CG-CD1 3.41Å; F470-L527 VanDerWaalsContact CG-CD1 3.41Å; F470-L527 HydrophobicContact CZ-CD1 3.51Å; F470-L527 HydrophobicContact CZ-CD2 4.05Å; F470-L527 HydrophobicContact CZ-CG 4.33Å
471	Q	95.8	Very high	91.5	Very high	80 Å²	80	64.9 Å²	64.9	37%	0.374	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	103.7	177.5	-61.3	-175	-0.5	0	0	110	E469 V473 G525 Q526	E469-Q471 HydrophobicContact CB-CG 4.48Å; E469-Q471 PolarHBondContact OE2-NE2 2.9Å; Q471-V473 VanDerWaalsContact C-N 3.25Å; Q471-V473 PolarHBondContact O-N 3.29Å; Q471-G525 CarbonylContact O-C 3.53Å; Q471-G525 WeakPolarHBondContact O-CA 3.12Å; Q471-Q526 PolarHBondContact N-O 3.32Å; Q471-Q526 PolarHBondContact O-N 2.89Å
472	D	94.9	Very high	91.3	Very high	101 Å²	101	69.3 Å²	69.3	54%	0.54	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	49.8	40.4	-179.8	-165.6	33	0	0	0	114.5	S474 G488 L489 T490 G525	D472-S474 PolarHBondContact O-N 3.46Å; D472-G488 WeakPolarHBondContact OD1-CA 3.26Å; D472-L489 PolarHBondContact N-O 3.25Å; D472-T490 PolarHBondContact N-OG1 2.93Å; D472-G525 VanDerWaalsContact O-CA 3.3Å; D472-G525 WeakPolarHBondContact O-CA 3.42Å
473	V	95.9	Very high	91.3	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	121.2	-170.5	176.4	0	0	0	0	111.3	F470 Q471 G488 L489 L515 P522 G524 Q526 L527	F470-V473 HydrophobicContact CB-CG2 4.04Å; F470-V473 HydrophobicContact CD1-CB 3.92Å; F470-V473 HydrophobicContact CD1-CG1 4.17Å; F470-V473 HydrophobicContact CD1-CG2 3.79Å; F470-V473 HydrophobicContact CE1-CG1 4.49Å; F470-V473 HydrophobicContact CG-CG2 4.28Å; Q471-V473 VanDerWaalsContact C-N 3.25Å; Q471-V473 PolarHBondContact O-N 3.29Å; V473-G488 PolarHBondContact O-N 2.98Å; V473-G488 VanDerWaalsContact O-N 3.14Å; V473-L489 HydrophobicContact CB-CB 4.47Å; V473-L489 PolarHBondContact N-O 2.99Å; V473-L489 PolarHBondContact O-N 2.92Å; V473-L515 HydrophobicContact CG1-CD1 4.06Å; V473-P522 HydrophobicContact CG1-CB 3.95Å; V473-G524 WeakPolarHBondContact CA-O 3.36Å; V473-Q526 VanDerWaalsContact CG2-O 3.23Å; V473-Q526 WeakPolarHBondContact CG2-O 3.44Å; V473-L527 HydrophobicContact CG2-CD1 3.75Å
474	S	95.1	Very high	91.4	Very high	38 Å²	38	64 Å²	64	27%	0.266	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	142.2	174.7	-63.4	0	0	0	0	110.6	D472 L486 G488 T523 G524	D472-S474 PolarHBondContact O-N 3.46Å; S474-L486 WeakPolarHBondContact CA-O 3.48Å; S474-G488 PolarHBondContact OG-N 3.27Å; S474-T523 WeakPolarHBondContact O-CA 3.5Å; S474-T523 PolarHBondContact O-N 3.45Å; S474-G524 PolarHBondContact N-O 2.81Å; S474-G524 PolarHBondContact O-N 3.46Å; S474-G524 VanDerWaalsContact O-N 3.12Å
475	F	94.7	Very high	91.5	Very high	7 Å²	7	65.6 Å²	65.6	3%	0.031	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	136.8	-177.5	-180	-99.2	0	0	0	113.7	Y477 V485 L486 T511 L515 Y520 Q521	F475-Y477 AromaticContact CE1-CD1 3.84Å; F475-Y477 HydrophobicContact CE1-CD1 3.84Å; F475-Y477 AromaticContact CE1-CD2 3.95Å; F475-Y477 HydrophobicContact CE1-CD2 3.95Å; F475-Y477 AromaticContact CE1-CE1 3.9Å; F475-Y477 HydrophobicContact CE1-CE1 3.9Å; F475-Y477 HydrophobicContact CE1-CE2 4Å; F475-Y477 AromaticContact CE1-CG 3.86Å; F475-Y477 HydrophobicContact CE1-CG 3.86Å; F475-Y477 AromaticContact CE1-CZ 3.97Å; F475-Y477 HydrophobicContact CZ-CD1 4.05Å; F475-Y477 HydrophobicContact CZ-CE1 4.28Å; F475-Y477 HydrophobicContact CZ-CG 4.34Å; F475-V485 PolarHBondContact O-N 3.11Å; F475-L486 HydrophobicContact CB-CB 4.06Å; F475-L486 HydrophobicContact CB-CD1 4.22Å; F475-L486 HydrophobicContact CB-CG 4.39Å; F475-L486 PolarHBondContact N-O 2.93Å; F475-L486 PolarHBondContact O-N 3.37Å; F475-L486 VanDerWaalsContact O-N 3.12Å; F475-T511 HydrophobicContact CD1-CG2 3.35Å; F475-T511 HydrophobicContact CE1-CG2 3.64Å; F475-T511 HydrophobicContact CG-CG2 4.29Å; F475-L515 HydrophobicContact CB-CD1 4.12Å; F475-L515 HydrophobicContact CD2-CD2 3.94Å; F475-L515 HydrophobicContact CE2-CD2 4.24Å; F475-L515 HydrophobicContact CG-CD1 4.33Å; F475-L515 HydrophobicContact CG-CD2 4.29Å; F475-Y520 HydrophobicContact CE2-CD1 4.36Å; F475-Y520 HydrophobicContact CE2-CG 4.16Å; F475-Y520 AromaticContact CZ-CD1 3.88Å; F475-Y520 HydrophobicContact CZ-CD1 3.88Å; F475-Y520 HydrophobicContact CZ-CD2 4.38Å; F475-Y520 AromaticContact CZ-CG 3.72Å; F475-Y520 HydrophobicContact CZ-CG 3.72Å; F475-Q521 WeakPolarHBondContact CD2-O 3.47Å; F475-Q521 VanDerWaalsContact CE2-O 3.27Å; F475-Q521 WeakPolarHBondContact CE2-O 3.48Å
476	S	92.1	Very high	91.7	Very high	21 Å²	21	60 Å²	60	15%	0.147	29%	0.29	C	S	.	.			trans	-124.4	139.3	166.9	-61.4	0	0	0	0	110.1	P481 P484 T523	S476-P481 WeakPolarHBondContact CB-O 3.44Å; S476-P481 PolarHBondContact OG-O 2.93Å; S476-P481 VanDerWaalsContact OG-O 3.04Å; S476-P484 VanDerWaalsContact OG-CA 3.3Å; S476-P484 WeakPolarHBondContact OG-CA 3.25Å; S476-T523 PolarHBondContact N-OG1 3.19Å
477	Y	89.6	Confident	91.8	Very high	59 Å²	59	63 Å²	63	23%	0.231	30%	0.303	C	S	.	.			trans	-66	142.1	172.3	-76.8	-81	0	0	0	110.6	F475 R479 R480 V485 T511 Y520	F475-Y477 AromaticContact CE1-CD1 3.84Å; F475-Y477 HydrophobicContact CE1-CD1 3.84Å; F475-Y477 AromaticContact CE1-CD2 3.95Å; F475-Y477 HydrophobicContact CE1-CD2 3.95Å; F475-Y477 AromaticContact CE1-CE1 3.9Å; F475-Y477 HydrophobicContact CE1-CE1 3.9Å; F475-Y477 HydrophobicContact CE1-CE2 4Å; F475-Y477 AromaticContact CE1-CG 3.86Å; F475-Y477 HydrophobicContact CE1-CG 3.86Å; F475-Y477 AromaticContact CE1-CZ 3.97Å; F475-Y477 HydrophobicContact CZ-CD1 4.05Å; F475-Y477 HydrophobicContact CZ-CE1 4.28Å; F475-Y477 HydrophobicContact CZ-CG 4.34Å; Y477-R479 PolarHBondContact O-N 3.29Å; Y477-R480 CarbonylContact O-C 3.53Å; Y477-R480 PolarHBondContact O-N 3.34Å; Y477-V485 HydrophobicContact CD2-CG2 3.82Å; Y477-V485 HydrophobicContact CE2-CG2 4.07Å; Y477-T511 HydrophobicContact CE2-CG2 4.23Å; Y477-T511 PolarHBondContact OH-OG1 3.36Å; Y477-Y520 HydrophobicContact CD1-CE1 4.3Å; Y477-Y520 HydrophobicContact CE1-CD2 4.39Å; Y477-Y520 HydrophobicContact CE1-CE1 4.43Å; Y477-Y520 AromaticContact CE1-CE2 3.89Å; Y477-Y520 HydrophobicContact CE1-CE2 3.89Å; Y477-Y520 AromaticContact CE1-CZ 3.92Å
478	P	84.3	Confident	91.7	Very high	66 Å²	66	60 Å²	60	43%	0.429	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-30.1	-177.7	-28	34.6	0	0	0	114.7	R480 P481	P478-R480 VanDerWaalsContact C-N 3.31Å; P478-R480 PolarHBondContact O-N 2.99Å; P478-P481 WeakPolarHBondContact O-CD 3.34Å
479	R	81.4	Confident	91.5	Very high	171 Å²	171	59.9 Å²	59.9	65%	0.645	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-18.5	179.5	-166	175	179.6	-169.4	1	113.8	Y477	Y477-R479 PolarHBondContact O-N 3.29Å
480	R	85.1	Confident	91.4	Very high	150 Å²	150	62.9 Å²	62.9	57%	0.566	32%	0.32	S	S	*	.			trans	-142.9	61.9	-177.6	-64.6	-177.2	-178.2	156.4	0	110.2	Y477 P478 E482 K483	Y477-R480 CarbonylContact O-C 3.53Å; Y477-R480 PolarHBondContact O-N 3.34Å; P478-R480 VanDerWaalsContact C-N 3.31Å; P478-R480 PolarHBondContact O-N 2.99Å; R480-E482 WeakPolarHBondContact CA-OE1 3.49Å; R480-E482 PolarHBondContact O-N 3.23Å; R480-K483 HydrophobicContact CB-CB 4.44Å; R480-K483 PolarHBondContact O-N 3.06Å; R480-K483 VanDerWaalsContact O-N 3.1Å
481	P	84.5	Confident	91.4	Very high	84 Å²	84	63.4 Å²	63.4	55%	0.545	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-31.5	-177.5	24.8	-34.2	0	0	0	112.2	S476 P478 K483	S476-P481 WeakPolarHBondContact CB-O 3.44Å; S476-P481 PolarHBondContact OG-O 2.93Å; S476-P481 VanDerWaalsContact OG-O 3.04Å; P478-P481 WeakPolarHBondContact O-CD 3.34Å; P481-K483 PolarHBondContact O-N 2.98Å
482	E	87.9	Confident	91.3	Very high	128 Å²	128	61.3 Å²	61.3	60%	0.598	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-12.1	179.4	68.2	-69.4	157.1	0	0	115	R480 P484	R480-E482 WeakPolarHBondContact CA-OE1 3.49Å; R480-E482 PolarHBondContact O-N 3.23Å; E482-P484 WeakPolarHBondContact O-CD 3.46Å
483	K	88.8	Confident	91.4	Very high	133 Å²	133	56.5 Å²	56.5	58%	0.578	29%	0.289	S	S	*	.	S	Bend	trans	-114.7	91.9	178.8	-70.1	-171.2	179.3	-175.3	0	110.6	R480 P481 V485	R480-K483 HydrophobicContact CB-CB 4.44Å; R480-K483 PolarHBondContact O-N 3.06Å; R480-K483 VanDerWaalsContact O-N 3.1Å; P481-K483 PolarHBondContact O-N 2.98Å; K483-V485 PolarHBondContact O-N 3.35Å
484	P	89.6	Confident	91.2	Very high	66 Å²	66	60.5 Å²	60.5	43%	0.429	31%	0.308	S	S	.	.			trans	-63.9	124.2	176.5	26.8	-33.5	0	0	0	110.5	S476 E482 Q487	S476-P484 VanDerWaalsContact OG-CA 3.3Å; S476-P484 WeakPolarHBondContact OG-CA 3.25Å; E482-P484 WeakPolarHBondContact O-CD 3.46Å; P484-Q487 HydrophobicContact CB-CG 4.01Å; P484-Q487 HydrophobicContact CG-CG 4.31Å
485	V	93.6	Very high	91.1	Very high	37 Å²	37	60.8 Å²	60.8	22%	0.224	31%	0.309	C	S	.	.	S	Bend	trans	-87.5	-36	177.9	177.7	0	0	0	0	110.8	F475 Y477 K483 T511 G678	F475-V485 PolarHBondContact O-N 3.11Å; Y477-V485 HydrophobicContact CD2-CG2 3.82Å; Y477-V485 HydrophobicContact CE2-CG2 4.07Å; K483-V485 PolarHBondContact O-N 3.35Å; V485-T511 HydrophobicContact CG1-CG2 4.31Å; V485-G678 WeakPolarHBondContact O-CA 3.32Å
486	L	94.8	Very high	90.8	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	136.3	177.5	-64.4	-175.2	0	0	0	108.9	S474 F475 L489 T511 V512 L515 L675	S474-L486 WeakPolarHBondContact CA-O 3.48Å; F475-L486 HydrophobicContact CB-CB 4.06Å; F475-L486 HydrophobicContact CB-CD1 4.22Å; F475-L486 HydrophobicContact CB-CG 4.39Å; F475-L486 PolarHBondContact N-O 2.93Å; F475-L486 PolarHBondContact O-N 3.37Å; F475-L486 VanDerWaalsContact O-N 3.12Å; L486-L489 HydrophobicContact CB-CD1 3.46Å; L486-L489 VanDerWaalsContact CB-CD1 3.46Å; L486-L489 HydrophobicContact CD1-CD1 4.19Å; L486-L489 HydrophobicContact CD2-CD1 3.64Å; L486-L489 HydrophobicContact CD2-CD2 4.44Å; L486-L489 HydrophobicContact CG-CD1 3.92Å; L486-T511 HydrophobicContact CD1-CG2 3.84Å; L486-T511 HydrophobicContact CG-CG2 4.12Å; L486-V512 HydrophobicContact CD1-CG2 4.17Å; L486-V512 HydrophobicContact CD2-CG2 4.18Å; L486-L515 HydrophobicContact CD1-CD1 3.47Å; L486-L515 VanDerWaalsContact CD1-CD1 3.47Å; L486-L675 HydrophobicContact CD2-CD2 4.37Å
487	Q	94	Very high	90.8	Very high	61 Å²	61	62.1 Å²	62.1	29%	0.285	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	94.7	-171.7	-62.6	175.9	31.2	0	0	109.7	P484 G678 R679	P484-Q487 HydrophobicContact CB-CG 4.01Å; P484-Q487 HydrophobicContact CG-CG 4.31Å; Q487-G678 PolarHBondContact N-O 3.19Å; Q487-R679 HydrophobicContact CB-CG 3.88Å; Q487-R679 VanDerWaalsContact OE1-CZ 3.28Å
488	G	92.6	Very high	90.8	Very high	27 Å²	27	60.2 Å²	60.2	28%	0.278	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	61.3	44.9	173.9	0	0	0	0	0	114.9	D472 V473 S474 T490	D472-G488 WeakPolarHBondContact OD1-CA 3.26Å; V473-G488 PolarHBondContact O-N 2.98Å; V473-G488 VanDerWaalsContact O-N 3.14Å; S474-G488 PolarHBondContact OG-N 3.27Å; G488-T490 PolarHBondContact O-N 3.27Å
489	L	94	Very high	91.2	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	127.7	177.4	-77.5	93.7	0	0	0	111.1	F470 D472 V473 L486 F491 V512 L675 G678 L680	F470-L489 HydrophobicContact CD1-CB 4.47Å; D472-L489 PolarHBondContact N-O 3.25Å; V473-L489 HydrophobicContact CB-CB 4.47Å; V473-L489 PolarHBondContact N-O 2.99Å; V473-L489 PolarHBondContact O-N 2.92Å; L486-L489 HydrophobicContact CB-CD1 3.46Å; L486-L489 VanDerWaalsContact CB-CD1 3.46Å; L486-L489 HydrophobicContact CD1-CD1 4.19Å; L486-L489 HydrophobicContact CD2-CD1 3.64Å; L486-L489 HydrophobicContact CD2-CD2 4.44Å; L486-L489 HydrophobicContact CG-CD1 3.92Å; L489-F491 HydrophobicContact CB-CD1 4.4Å; L489-F491 HydrophobicContact CB-CE1 4.31Å; L489-F491 HydrophobicContact CD2-CD1 4.39Å; L489-F491 HydrophobicContact CD2-CE1 3.85Å; L489-V512 HydrophobicContact CD2-CG2 4.21Å; L489-L675 HydrophobicContact CD2-CD1 3.61Å; L489-L675 HydrophobicContact CG-CD1 4.31Å; L489-G678 WeakPolarHBondContact CD1-O 3.18Å; L489-L680 HydrophobicContact CD2-CG 4.3Å
490	T	94.8	Very high	91.6	Very high	88 Å²	88	49 Å²	49	54%	0.54	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	116.4	172.8	-57.9	0	0	0	0	109.9	F470 D472 G488 L680	F470-T490 VanDerWaalsContact O-CA 3.26Å; F470-T490 WeakPolarHBondContact O-CA 3.49Å; D472-T490 PolarHBondContact N-OG1 2.93Å; G488-T490 PolarHBondContact O-N 3.27Å; T490-L680 WeakPolarHBondContact O-CD1 3.42Å
491	F	94.7	Very high	91.9	Very high	14 Å²	14	41.8 Å²	41.8	6%	0.061	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	166.7	175.3	65.5	-84.2	0	0	0	110.7	F470 L489 L493 V512 L673 L680	F470-F491 HydrophobicContact CB-CD1 3.77Å; F470-F491 HydrophobicContact CB-CE1 3.79Å; F470-F491 HydrophobicContact CB-CG 4.35Å; F470-F491 HydrophobicContact CB-CZ 4.36Å; F470-F491 HydrophobicContact CD1-CD1 4.43Å; F470-F491 AromaticContact CD1-CE1 3.62Å; F470-F491 HydrophobicContact CD1-CE1 3.62Å; F470-F491 AromaticContact CD1-CZ 3.95Å; F470-F491 HydrophobicContact CD1-CZ 3.95Å; F470-F491 HydrophobicContact CD2-CD1 4.15Å; F470-F491 HydrophobicContact CD2-CD2 4.19Å; F470-F491 AromaticContact CD2-CE1 3.54Å; F470-F491 HydrophobicContact CD2-CE1 3.54Å; F470-F491 AromaticContact CD2-CE2 3.57Å; F470-F491 HydrophobicContact CD2-CE2 3.57Å; F470-F491 HydrophobicContact CD2-CG 4.47Å; F470-F491 AromaticContact CD2-CZ 3.22Å; F470-F491 HydrophobicContact CD2-CZ 3.22Å; F470-F491 HydrophobicContact CE1-CE1 4.08Å; F470-F491 HydrophobicContact CE1-CZ 4.04Å; F470-F491 AromaticContact CE2-CE1 3.99Å; F470-F491 HydrophobicContact CE2-CE1 3.99Å; F470-F491 AromaticContact CE2-CE2 3.77Å; F470-F491 HydrophobicContact CE2-CE2 3.77Å; F470-F491 AromaticContact CE2-CZ 3.31Å; F470-F491 HydrophobicContact CE2-CZ 3.31Å; F470-F491 AromaticContact CG-CD1 3.88Å; F470-F491 HydrophobicContact CG-CD1 3.88Å; F470-F491 AromaticContact CG-CE1 3.35Å; F470-F491 HydrophobicContact CG-CE1 3.35Å; F470-F491 HydrophobicContact CG-CE2 4.25Å; F470-F491 AromaticContact CG-CZ 3.58Å; F470-F491 HydrophobicContact CG-CZ 3.58Å; F470-F491 HydrophobicContact CZ-CE1 4.26Å; F470-F491 AromaticContact CZ-CZ 3.75Å; F470-F491 HydrophobicContact CZ-CZ 3.75Å; F470-F491 PolarHBondContact N-O 2.87Å; F470-F491 PolarHBondContact O-N 3.24Å; L489-F491 HydrophobicContact CB-CD1 4.4Å; L489-F491 HydrophobicContact CB-CE1 4.31Å; L489-F491 HydrophobicContact CD2-CD1 4.39Å; L489-F491 HydrophobicContact CD2-CE1 3.85Å; F491-L493 HydrophobicContact CD2-CD2 4.09Å; F491-L493 HydrophobicContact CD2-CG 4.41Å; F491-L493 HydrophobicContact CE2-CD2 3.83Å; F491-L493 HydrophobicContact CE2-CG 4.04Å; F491-V512 HydrophobicContact CZ-CG1 4.02Å; F491-L673 HydrophobicContact CB-CD1 4.18Å; F491-L673 HydrophobicContact CB-CD2 4.42Å; F491-L673 HydrophobicContact CD1-CD1 4.46Å; F491-L673 HydrophobicContact CD2-CD1 3.38Å; F491-L673 HydrophobicContact CE2-CD1 3.77Å; F491-L673 HydrophobicContact CG-CD1 3.77Å; F491-L673 HydrophobicContact CZ-CD1 4.43Å; F491-L680 HydrophobicContact CB-CD1 3.91Å; F491-L680 HydrophobicContact CD1-CD1 3.65Å; F491-L680 HydrophobicContact CG-CD1 4.14Å
492	T	95.6	Very high	92.1	Very high	35 Å²	35	38.3 Å²	38.3	22%	0.215	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135.5	179	-54.5	0	0	0	0	110.3	R467 V468 E469 Q671	R467-T492 HydrophobicContact CG-CG2 4.23Å; V468-T492 CarbonylContact O-C 3.38Å; V468-T492 VanDerWaalsContact O-CA 3.31Å; V468-T492 WeakPolarHBondContact O-CA 3.01Å; E469-T492 HydrophobicContact CG-CG2 4.08Å; T492-Q671 PolarHBondContact O-OE1 3.49Å
493	L	95.2	Very high	91.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	121.7	166.8	-54.2	179.4	0	0	0	108	V468 F491 T499 L516 T655 L657	V468-L493 HydrophobicContact CB-CB 4.05Å; V468-L493 HydrophobicContact CB-CD1 4.1Å; V468-L493 HydrophobicContact CB-CG 4.27Å; V468-L493 HydrophobicContact CG2-CB 4.49Å; V468-L493 HydrophobicContact CG2-CD1 4.36Å; V468-L493 PolarHBondContact N-O 3.26Å; V468-L493 PolarHBondContact O-N 3Å; F491-L493 HydrophobicContact CD2-CD2 4.09Å; F491-L493 HydrophobicContact CD2-CG 4.41Å; F491-L493 HydrophobicContact CE2-CD2 3.83Å; F491-L493 HydrophobicContact CE2-CG 4.04Å; L493-T499 HydrophobicContact CD2-CG2 3.68Å; L493-T499 WeakPolarHBondContact CD2-OG1 3.15Å; L493-L516 HydrophobicContact CD1-CD1 4.39Å; L493-T655 HydrophobicContact CB-CG2 3.68Å; L493-L657 HydrophobicContact CD1-CB 4.22Å; L493-L657 HydrophobicContact CD1-CD2 4.38Å; L493-L657 HydrophobicContact CD2-CD1 4.15Å
494	H	93.3	Very high	91.6	Very high	84 Å²	84	29 Å²	29	39%	0.389	18%	0.18	S	C	.	.	P	Polyproline II helix	trans	-92.2	143.3	-175.7	-67.7	-82.9	0	0	0	111.7	G496 T497 T655	H494-G496 PolarHBondContact O-N 3.18Å; H494-T497 HydrophobicContact CB-CG2 3.79Å; H494-T497 PolarHBondContact O-N 3.2Å; H494-T497 PolarHBondContact O-OG1 3.4Å; H494-T655 PolarHBondContact O-OG1 3.43Å
495	P	92.4	Very high	91.3	Very high	44 Å²	44	32.5 Å²	32.5	29%	0.286	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	137.5	169.5	-26.3	35.8	0	0	0	111.3	E465 R467 T497 T655	E465-P495 HydrophobicContact CB-CG 4.25Å; R467-P495 HydrophobicContact CB-CG 3.98Å; P495-T497 PolarHBondContact O-N 2.68Å; P495-T655 WeakPolarHBondContact CA-OG1 3.32Å
496	G	89.1	Confident	90.7	Very high	24 Å²	24	34.6 Å²	34.6	25%	0.247	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	9.7	178.5	0	0	0	0	0	115.9	H494 R649 D653	H494-G496 PolarHBondContact O-N 3.18Å; G496-R649 VanDerWaalsContact C-NH2 3.31Å; G496-R649 PolarHBondContact O-NH2 3.44Å; G496-D653 PolarHBondContact N-O 3.42Å
497	T	90.8	Very high	90.3	Very high	32 Å²	32	34.8 Å²	34.8	20%	0.196	23%	0.226	C	C	.	.			trans	-111.9	147	177.3	72.9	0	0	0	0	113	H494 P495 R649 M656 D670	H494-T497 HydrophobicContact CB-CG2 3.79Å; H494-T497 PolarHBondContact O-N 3.2Å; H494-T497 PolarHBondContact O-OG1 3.4Å; P495-T497 PolarHBondContact O-N 2.68Å; T497-R649 VanDerWaalsContact C-CZ 3.5Å; T497-R649 VanDerWaalsContact CA-NH2 3.3Å; T497-R649 PolarHBondContact O-NH1 2.81Å; T497-M656 PolarHBondContact O-N 3.32Å; T497-M656 VanDerWaalsContact O-N 3.16Å; T497-D670 WeakPolarHBondContact CA-OD2 3.47Å
498	V	90.5	Very high	90.1	Very high	20 Å²	20	32.1 Å²	32.1	12%	0.121	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	116.2	171.1	-177.1	0	0	0	0	107.5	R649 M656 V658 A669 D670 Q671	V498-R649 VanDerWaalsContact CG2-NH2 3.33Å; V498-R649 VanDerWaalsContact N-NH2 3.14Å; V498-M656 WeakPolarHBondContact CA-O 3.35Å; V498-M656 HydrophobicContact CG2-CB 4.48Å; V498-M656 HydrophobicContact CG2-SD 4.43Å; V498-V658 HydrophobicContact CG1-CG2 3.92Å; V498-A669 HydrophobicContact CG1-CB 4.21Å; V498-D670 PolarHBondContact N-OD2 3.07Å; V498-D670 PolarHBondContact O-N 3.39Å; V498-Q671 PolarHBondContact O-N 3.36Å; V498-Q671 VanDerWaalsContact O-N 3.12Å
499	T	91.9	Very high	90	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	122.3	173	-53.6	0	0	0	0	109.8	L493 M656 L657 V658 Q671 L673	L493-T499 HydrophobicContact CD2-CG2 3.68Å; L493-T499 WeakPolarHBondContact CD2-OG1 3.15Å; T499-M656 PolarHBondContact N-O 3.34Å; T499-L657 HydrophobicContact CG2-CD1 4.23Å; T499-L657 WeakPolarHBondContact O-CA 3.4Å; T499-V658 PolarHBondContact O-N 3.49Å; T499-Q671 CarbonylContact C-O 3.54Å; T499-Q671 VanDerWaalsContact CA-O 3.3Å; T499-Q671 WeakPolarHBondContact CA-O 3.28Å; T499-Q671 HydrophobicContact CG2-CB 4.16Å; T499-Q671 HydrophobicContact CG2-CG 4.14Å; T499-Q671 PolarHBondContact OG1-OE1 3.43Å; T499-L673 HydrophobicContact CG2-CD1 3.6Å; T499-L673 HydrophobicContact CG2-CG 3.8Å
500	A	90.6	Very high	89.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	123.6	172.4	0	0	0	0	0	110.7	V502 V658 V666 A669 Q671 V672 L673	A500-V502 HydrophobicContact CB-CG2 4.42Å; A500-V658 CarbonylContact C-O 3.48Å; A500-V658 VanDerWaalsContact CA-O 3.32Å; A500-V658 WeakPolarHBondContact CA-O 3.21Å; A500-V666 HydrophobicContact CB-CG2 4.44Å; A500-A669 HydrophobicContact CB-CB 3.57Å; A500-Q671 PolarHBondContact N-O 3.41Å; A500-V672 HydrophobicContact CB-CG2 4.44Å; A500-V672 CarbonylContact O-C 3.54Å; A500-V672 WeakPolarHBondContact O-CA 3.18Å; A500-L673 PolarHBondContact O-N 3.11Å
501	L	90.9	Very high	89.7	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	115.8	173.1	-176.8	65.8	0	0	0	109.9	K509 V512 L657 V658 I659 A660 L673 L675	L501-K509 HydrophobicContact CD2-CB 4.08Å; L501-K509 HydrophobicContact CD2-CG 4.34Å; L501-K509 HydrophobicContact CG-CG 4.32Å; L501-V512 HydrophobicContact CD2-CB 4.05Å; L501-V512 HydrophobicContact CD2-CG1 4.13Å; L501-V512 HydrophobicContact CD2-CG2 4.17Å; L501-L657 HydrophobicContact CB-CD1 4.03Å; L501-V658 PolarHBondContact N-O 3.29Å; L501-I659 HydrophobicContact CB-CG1 4.42Å; L501-I659 HydrophobicContact CD2-CG1 4.35Å; L501-I659 WeakPolarHBondContact O-CA 3.36Å; L501-A660 PolarHBondContact O-N 3Å; L501-L673 WeakPolarHBondContact CA-O 3.45Å; L501-L673 HydrophobicContact CD1-CB 3.81Å; L501-L675 HydrophobicContact CD1-CB 4.06Å
502	V	87.9	Confident	89.7	Confident	11 Å²	11	30.1 Å²	30.1	7%	0.067	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	150.1	-172.1	-164.7	0	0	0	0	110.8	A500 V666 V672 L673 V674 L675 L696	A500-V502 HydrophobicContact CB-CG2 4.42Å; V502-V666 HydrophobicContact CG2-CG1 4.28Å; V502-V666 HydrophobicContact CG2-CG2 3.56Å; V502-V672 HydrophobicContact CG2-CG1 4.28Å; V502-L673 PolarHBondContact N-O 2.91Å; V502-V674 CarbonylContact O-C 3.59Å; V502-V674 WeakPolarHBondContact O-CA 3.43Å; V502-L675 PolarHBondContact O-N 2.98Å; V502-L696 HydrophobicContact CB-CD1 4.49Å; V502-L696 HydrophobicContact CB-CD2 4.2Å; V502-L696 HydrophobicContact CG1-CD1 4.07Å; V502-L696 HydrophobicContact CG1-CD2 3.37Å; V502-L696 HydrophobicContact CG1-CG 4.38Å
503	G	85.2	Confident	89.6	Confident	6 Å²	6	28.5 Å²	28.5	6%	0.062	19%	0.19	C	C	.	.			trans	164.3	169.7	175.5	0	0	0	0	0	112.8	K509 L675	G503-K509 PolarHBondContact O-NZ 3.49Å; G503-L675 WeakPolarHBondContact CA-O 3.24Å
504	P	81.8	Confident	89.5	Confident	58 Å²	58	29.1 Å²	29.1	38%	0.377	20%	0.195	S	C	.	.			trans	-64.3	165.3	179.9	26.5	-33.8	0	0	0	112.5	G506 S507 K509	P504-G506 PolarHBondContact O-N 2.87Å; P504-S507 WeakPolarHBondContact O-CB 3.46Å; P504-S507 PolarHBondContact O-N 3.32Å; P504-S507 PolarHBondContact O-OG 3.27Å; P504-K509 PolarHBondContact O-NZ 3.41Å; P504-K509 VanDerWaalsContact O-NZ 3.1Å
505	N	82.8	Confident	89.5	Confident	141 Å²	141	25.2 Å²	25.2	75%	0.754	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	136.4	173.9	-70.3	-9.9	0	0	0	110.1	S507	N505-S507 VanDerWaalsContact C-N 3.34Å
506	G	82.2	Confident	89.6	Confident	81 Å²	81	23.3 Å²	23.3	84%	0.835	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.2	6.8	-176.1	0	0	0	0	0	115.6	P504 G508	P504-G506 PolarHBondContact O-N 2.87Å; G506-G508 VanDerWaalsContact C-N 3.27Å; G506-G508 PolarHBondContact O-N 2.98Å
507	S	85.9	Confident	89.7	Confident	3 Å²	3	23.4 Å²	23.4	2%	0.021	16%	0.158	C	C	.	.	S	Bend	trans	-72.4	-14.4	177.3	67.5	0	0	0	0	115.1	P504 N505 K509 L675 G678	P504-S507 WeakPolarHBondContact O-CB 3.46Å; P504-S507 PolarHBondContact O-N 3.32Å; P504-S507 PolarHBondContact O-OG 3.27Å; N505-S507 VanDerWaalsContact C-N 3.34Å; S507-K509 WeakPolarHBondContact OG-CG 3.37Å; S507-L675 WeakPolarHBondContact CB-O 3.46Å; S507-L675 WeakPolarHBondContact O-CD2 3.17Å; S507-L675 WeakPolarHBondContact O-CG 3.38Å; S507-L675 PolarHBondContact OG-O 2.96Å; S507-G678 WeakPolarHBondContact O-CA 3.47Å; S507-G678 PolarHBondContact O-N 3.29Å; S507-G678 VanDerWaalsContact O-N 3.15Å
508	G	89.1	Confident	89.8	Confident	6 Å²	6	23 Å²	23	6%	0.062	16%	0.155	C	C	.	.	S	Bend	trans	111.7	6.9	178.2	0	0	0	0	0	115.9	G506 S510 T511 V512	G506-G508 VanDerWaalsContact C-N 3.27Å; G506-G508 PolarHBondContact O-N 2.98Å; G508-S510 PolarHBondContact O-N 2.9Å; G508-T511 WeakPolarHBondContact O-CA 3.42Å; G508-T511 WeakPolarHBondContact O-CB 3.49Å; G508-T511 PolarHBondContact O-N 2.93Å; G508-V512 PolarHBondContact O-N 3.39Å; G508-V512 VanDerWaalsContact O-N 3.08Å
509	K	91	Very high	89.8	Confident	14 Å²	14	24.7 Å²	24.7	6%	0.061	16%	0.163	C	C	.	.	H	α-helix	trans	-57	-52.1	-175.3	-50.5	-174.8	-59.3	-83.4	0	113.7	L501 G503 P504 S507 T511 V512 A513 I659 H661 L675	L501-K509 HydrophobicContact CD2-CB 4.08Å; L501-K509 HydrophobicContact CD2-CG 4.34Å; L501-K509 HydrophobicContact CG-CG 4.32Å; G503-K509 PolarHBondContact O-NZ 3.49Å; P504-K509 PolarHBondContact O-NZ 3.41Å; P504-K509 VanDerWaalsContact O-NZ 3.1Å; S507-K509 WeakPolarHBondContact OG-CG 3.37Å; K509-T511 PolarHBondContact O-N 3.32Å; K509-V512 WeakPolarHBondContact O-CB 3.35Å; K509-V512 PolarHBondContact O-N 3.23Å; K509-V512 VanDerWaalsContact O-N 3.09Å; K509-A513 PolarHBondContact O-N 3.24Å; K509-I659 HydrophobicContact CB-CD1 4.26Å; K509-I659 HydrophobicContact CB-CG1 4.43Å; K509-I659 HydrophobicContact CB-CG2 3.75Å; K509-I659 HydrophobicContact CD-CG2 3.81Å; K509-I659 HydrophobicContact CG-CG2 4.37Å; K509-H661 WeakPolarHBondContact CE-NE2 3.32Å; K509-H661 PolarHBondContact NZ-CE1 2.71Å; K509-H661 PolarHBondContact NZ-NE2 3.02Å; K509-H661 VanDerWaalsContact NZ-NE2 3.17Å; K509-L675 HydrophobicContact CG-CD2 4.19Å
510	S	90.2	Very high	89.7	Confident	65 Å²	65	25.8 Å²	25.8	46%	0.455	17%	0.167	S	C	.	.	H	α-helix	trans	-66.1	-24.4	177.2	-47.3	0	0	0	0	112.5	G508 A513 A514 D631	G508-S510 PolarHBondContact O-N 2.9Å; S510-A513 PolarHBondContact O-N 3.32Å; S510-A514 PolarHBondContact O-N 2.9Å; S510-D631 PolarHBondContact OG-OD2 3.01Å
511	T	92.9	Very high	89.7	Confident	8 Å²	8	28.5 Å²	28.5	5%	0.049	18%	0.18	C	C	.	.	H	α-helix	trans	-68	-39.4	172.5	-50.2	0	0	0	0	111.3	F475 Y477 V485 L486 G508 K509 A513 A514 L515	F475-T511 HydrophobicContact CD1-CG2 3.35Å; F475-T511 HydrophobicContact CE1-CG2 3.64Å; F475-T511 HydrophobicContact CG-CG2 4.29Å; Y477-T511 HydrophobicContact CE2-CG2 4.23Å; Y477-T511 PolarHBondContact OH-OG1 3.36Å; V485-T511 HydrophobicContact CG1-CG2 4.31Å; L486-T511 HydrophobicContact CD1-CG2 3.84Å; L486-T511 HydrophobicContact CG-CG2 4.12Å; G508-T511 WeakPolarHBondContact O-CA 3.42Å; G508-T511 WeakPolarHBondContact O-CB 3.49Å; G508-T511 PolarHBondContact O-N 2.93Å; K509-T511 PolarHBondContact O-N 3.32Å; T511-A513 VanDerWaalsContact C-N 3.34Å; T511-A513 PolarHBondContact O-N 3.47Å; T511-A514 PolarHBondContact O-N 3.46Å; T511-L515 HydrophobicContact CG2-CD1 4.5Å; T511-L515 WeakPolarHBondContact O-CG 3.39Å; T511-L515 PolarHBondContact O-N 3.03Å
512	V	94.4	Very high	89.8	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.1	-46.4	173.4	174.5	0	0	0	0	110.4	F470 L486 L489 F491 L501 G508 K509 A514 L515 L516 L657 L675	F470-V512 HydrophobicContact CE1-CG1 4.05Å; F470-V512 HydrophobicContact CE2-CG1 4.38Å; F470-V512 HydrophobicContact CZ-CG1 3.61Å; L486-V512 HydrophobicContact CD1-CG2 4.17Å; L486-V512 HydrophobicContact CD2-CG2 4.18Å; L489-V512 HydrophobicContact CD2-CG2 4.21Å; F491-V512 HydrophobicContact CZ-CG1 4.02Å; L501-V512 HydrophobicContact CD2-CB 4.05Å; L501-V512 HydrophobicContact CD2-CG1 4.13Å; L501-V512 HydrophobicContact CD2-CG2 4.17Å; G508-V512 PolarHBondContact O-N 3.39Å; G508-V512 VanDerWaalsContact O-N 3.08Å; K509-V512 WeakPolarHBondContact O-CB 3.35Å; K509-V512 PolarHBondContact O-N 3.23Å; K509-V512 VanDerWaalsContact O-N 3.09Å; V512-A514 VanDerWaalsContact C-N 3.35Å; V512-A514 PolarHBondContact O-N 2.81Å; V512-L515 PolarHBondContact O-N 3.4Å; V512-L516 HydrophobicContact CG1-CD1 4.26Å; V512-L516 WeakPolarHBondContact O-CG 3.23Å; V512-L516 PolarHBondContact O-N 3.5Å; V512-L657 HydrophobicContact CG1-CD2 4.37Å; V512-L675 HydrophobicContact CG2-CD2 4.48Å
513	A	93.6	Very high	89.9	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.008	22%	0.218	C	C	.	.	H	α-helix	trans	-60.3	-42.4	175.7	0	0	0	0	0	112.6	K509 S510 T511 L515 L516 Q517 L548 I629 I659	K509-A513 PolarHBondContact O-N 3.24Å; S510-A513 PolarHBondContact O-N 3.32Å; T511-A513 VanDerWaalsContact C-N 3.34Å; T511-A513 PolarHBondContact O-N 3.47Å; A513-L515 PolarHBondContact O-N 3.46Å; A513-L516 PolarHBondContact O-N 2.92Å; A513-Q517 WeakPolarHBondContact O-CG 3.35Å; A513-Q517 PolarHBondContact O-N 3.1Å; A513-Q517 VanDerWaalsContact O-N 3.15Å; A513-L548 HydrophobicContact CB-CD1 4.1Å; A513-L548 HydrophobicContact CB-CD2 4.43Å; A513-I629 HydrophobicContact CB-CG2 4Å; A513-I659 HydrophobicContact CB-CD1 4.04Å
514	A	92.6	Very high	90.3	Very high	13 Å²	13	35.5 Å²	35.5	11%	0.107	23%	0.228	C	C	.	.	H	α-helix	trans	-66.4	-36.5	179	0	0	0	0	0	113	S510 T511 V512 Q517 N518 L519 Y520	S510-A514 PolarHBondContact O-N 2.9Å; T511-A514 PolarHBondContact O-N 3.46Å; V512-A514 VanDerWaalsContact C-N 3.35Å; V512-A514 PolarHBondContact O-N 2.81Å; A514-Q517 PolarHBondContact O-N 3.49Å; A514-N518 PolarHBondContact O-N 3.45Å; A514-L519 WeakPolarHBondContact O-CB 3.43Å; A514-L519 PolarHBondContact O-N 2.89Å; A514-Y520 HydrophobicContact CB-CD2 3.9Å; A514-Y520 HydrophobicContact CB-CE2 4.24Å
515	L	93.9	Very high	90.8	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-68.6	-40.7	174.4	-70.8	174.9	0	0	0	112	V473 F475 L486 T511 V512 A513 Q517 N518 Y520 L527	V473-L515 HydrophobicContact CG1-CD1 4.06Å; F475-L515 HydrophobicContact CB-CD1 4.12Å; F475-L515 HydrophobicContact CD2-CD2 3.94Å; F475-L515 HydrophobicContact CE2-CD2 4.24Å; F475-L515 HydrophobicContact CG-CD1 4.33Å; F475-L515 HydrophobicContact CG-CD2 4.29Å; L486-L515 HydrophobicContact CD1-CD1 3.47Å; L486-L515 VanDerWaalsContact CD1-CD1 3.47Å; T511-L515 HydrophobicContact CG2-CD1 4.5Å; T511-L515 WeakPolarHBondContact O-CG 3.39Å; T511-L515 PolarHBondContact O-N 3.03Å; V512-L515 PolarHBondContact O-N 3.4Å; A513-L515 PolarHBondContact O-N 3.46Å; L515-Q517 PolarHBondContact O-N 3.29Å; L515-N518 WeakPolarHBondContact O-CA 3.44Å; L515-N518 PolarHBondContact O-N 2.84Å; L515-Y520 WeakPolarHBondContact CD2-O 3.46Å; L515-L527 HydrophobicContact CB-CD2 4.5Å
516	L	94.2	Very high	91.4	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-59.3	-35.7	174.9	-79	172	0	0	0	112.9	V468 F470 L493 V512 A513 N518 L527 L534 I629 L657	V468-L516 HydrophobicContact CB-CD2 4.45Å; V468-L516 HydrophobicContact CG1-CD2 3.45Å; V468-L516 VanDerWaalsContact CG1-CD2 3.45Å; F470-L516 HydrophobicContact CE2-CD1 4.45Å; F470-L516 HydrophobicContact CE2-CD2 3.63Å; F470-L516 HydrophobicContact CE2-CG 4.04Å; F470-L516 HydrophobicContact CZ-CD1 4.41Å; F470-L516 HydrophobicContact CZ-CD2 3.88Å; F470-L516 HydrophobicContact CZ-CG 3.84Å; L493-L516 HydrophobicContact CD1-CD1 4.39Å; V512-L516 HydrophobicContact CG1-CD1 4.26Å; V512-L516 WeakPolarHBondContact O-CG 3.23Å; V512-L516 PolarHBondContact O-N 3.5Å; A513-L516 PolarHBondContact O-N 2.92Å; L516-N518 PolarHBondContact O-N 3.38Å; L516-L527 HydrophobicContact CD2-CD2 3.99Å; L516-L534 WeakPolarHBondContact O-CD1 3.49Å; L516-I629 HydrophobicContact CB-CD1 3.64Å; L516-I629 HydrophobicContact CD1-CD1 3.71Å; L516-I629 HydrophobicContact CD1-CG1 4.28Å; L516-I629 HydrophobicContact CG-CD1 4.31Å; L516-L657 HydrophobicContact CD1-CD2 3.38Å
517	Q	92	Very high	92	Very high	26 Å²	26	29.9 Å²	29.9	12%	0.121	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	6	174.3	-66.7	-162.9	-61.1	0	0	113.3	A513 A514 L515 L519 H543 L548 I629	A513-Q517 WeakPolarHBondContact O-CG 3.35Å; A513-Q517 PolarHBondContact O-N 3.1Å; A513-Q517 VanDerWaalsContact O-N 3.15Å; A514-Q517 PolarHBondContact O-N 3.49Å; L515-Q517 PolarHBondContact O-N 3.29Å; Q517-L519 HydrophobicContact CB-CD1 4.03Å; Q517-L519 HydrophobicContact CB-CG 3.74Å; Q517-L519 PolarHBondContact O-N 3.46Å; Q517-H543 PolarHBondContact O-CE1 3.4Å; Q517-H543 PolarHBondContact O-NE2 3.01Å; Q517-L548 HydrophobicContact CG-CB 4.24Å; Q517-L548 VanDerWaalsContact OE1-CD2 3.29Å; Q517-I629 HydrophobicContact CG-CD1 4.37Å
518	N	91.8	Very high	92.5	Very high	25 Å²	25	30.4 Å²	30.4	13%	0.134	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	27.5	-177	-159.1	25.4	0	0	0	113.5	A514 L515 L516 Y520 Q521 L534 L542	A514-N518 PolarHBondContact O-N 3.45Å; L515-N518 WeakPolarHBondContact O-CA 3.44Å; L515-N518 PolarHBondContact O-N 2.84Å; L516-N518 PolarHBondContact O-N 3.38Å; N518-Y520 VanDerWaalsContact C-N 3.31Å; N518-Q521 PolarHBondContact OD1-NE2 3.32Å; N518-L534 HydrophobicContact CB-CB 4.5Å; N518-L534 HydrophobicContact CB-CD1 4.33Å; N518-L534 PolarHBondContact ND2-O 3.19Å; N518-L542 HydrophobicContact CB-CD2 3.57Å
519	L	90.3	Very high	92.8	Very high	54 Å²	54	30.1 Å²	30.1	28%	0.283	18%	0.181	S	C	.	.	S	Bend	trans	-77.7	-23	178	-64.8	179	0	0	0	111.9	L238 A514 Q517	L238-L519 HydrophobicContact CD1-CB 3.74Å; L238-L519 HydrophobicContact CD1-CD1 4.06Å; L238-L519 HydrophobicContact CD1-CD2 4.23Å; L238-L519 HydrophobicContact CD1-CG 4.22Å; A514-L519 WeakPolarHBondContact O-CB 3.43Å; A514-L519 PolarHBondContact O-N 2.89Å; Q517-L519 HydrophobicContact CB-CD1 4.03Å; Q517-L519 HydrophobicContact CB-CG 3.74Å; Q517-L519 PolarHBondContact O-N 3.46Å
520	Y	90.6	Very high	93	Very high	23 Å²	23	31.8 Å²	31.8	9%	0.09	19%	0.19	C	C	.	.	S	Bend	trans	-133	153.7	170.4	-65.9	-79.1	0	0	0	109.5	L238 Q242 F475 Y477 A514 L515 N518	L238-Y520 HydrophobicContact CB-CE1 4.15Å; L238-Y520 WeakPolarHBondContact CB-OH 3.38Å; L238-Y520 HydrophobicContact CD1-CE2 4.17Å; Q242-Y520 VanDerWaalsContact CD-OH 3.23Å; Q242-Y520 PolarHBondContact NE2-OH 3.41Å; Q242-Y520 PolarHBondContact OE1-OH 3.24Å; F475-Y520 HydrophobicContact CE2-CD1 4.36Å; F475-Y520 HydrophobicContact CE2-CG 4.16Å; F475-Y520 AromaticContact CZ-CD1 3.88Å; F475-Y520 HydrophobicContact CZ-CD1 3.88Å; F475-Y520 HydrophobicContact CZ-CD2 4.38Å; F475-Y520 AromaticContact CZ-CG 3.72Å; F475-Y520 HydrophobicContact CZ-CG 3.72Å; Y477-Y520 HydrophobicContact CD1-CE1 4.3Å; Y477-Y520 HydrophobicContact CE1-CD2 4.39Å; Y477-Y520 HydrophobicContact CE1-CE1 4.43Å; Y477-Y520 AromaticContact CE1-CE2 3.89Å; Y477-Y520 HydrophobicContact CE1-CE2 3.89Å; Y477-Y520 AromaticContact CE1-CZ 3.92Å; A514-Y520 HydrophobicContact CB-CD2 3.9Å; A514-Y520 HydrophobicContact CB-CE2 4.24Å; L515-Y520 WeakPolarHBondContact CD2-O 3.46Å; N518-Y520 VanDerWaalsContact C-N 3.31Å
521	Q	90.2	Very high	93.2	Very high	58 Å²	58	30.6 Å²	30.6	27%	0.271	19%	0.188	S	C	.	.			trans	-93.3	139.9	171.4	-63.6	-56.5	-43.4	0	0	110.3	P454 F475 N518	P454-Q521 HydrophobicContact CG-CG 4.23Å; F475-Q521 WeakPolarHBondContact CD2-O 3.47Å; F475-Q521 VanDerWaalsContact CE2-O 3.27Å; F475-Q521 WeakPolarHBondContact CE2-O 3.48Å; N518-Q521 PolarHBondContact OD1-NE2 3.32Å
522	P	92.5	Very high	93.3	Very high	36 Å²	36	34.1 Å²	34.1	23%	0.234	20%	0.204	C	C	.	.			trans	-61.2	145.4	171.5	29	-34.6	0	0	0	110.4	V473	V473-P522 HydrophobicContact CG1-CB 3.95Å
523	T	91.5	Very high	93.2	Very high	100 Å²	100	35.5 Å²	35.5	61%	0.613	21%	0.213	S	C	*	.	S	Bend	trans	-81.6	-24.1	176.7	-44.8	0	0	0	0	111.5	S474 S476	S474-T523 WeakPolarHBondContact O-CA 3.5Å; S474-T523 PolarHBondContact O-N 3.45Å; S476-T523 PolarHBondContact N-OG1 3.19Å
524	G	92.1	Very high	93.2	Very high	28 Å²	28	35.9 Å²	35.9	29%	0.289	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	162.3	171.9	0	0	0	0	0	110.5	V473 S474	V473-G524 WeakPolarHBondContact CA-O 3.36Å; S474-G524 PolarHBondContact N-O 2.81Å; S474-G524 PolarHBondContact O-N 3.46Å; S474-G524 VanDerWaalsContact O-N 3.12Å
525	G	93.9	Very high	93.1	Very high	37 Å²	37	37.4 Å²	37.4	38%	0.381	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	75	-170.2	-172.2	0	0	0	0	0	113.2	Q471 D472	Q471-G525 CarbonylContact O-C 3.53Å; Q471-G525 WeakPolarHBondContact O-CA 3.12Å; D472-G525 VanDerWaalsContact O-CA 3.3Å; D472-G525 WeakPolarHBondContact O-CA 3.42Å
526	Q	94	Very high	93.1	Very high	112 Å²	112	41.6 Å²	41.6	52%	0.523	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	150.9	-178.4	-62.6	-175	8.1	0	0	112	Q471 V473	Q471-Q526 PolarHBondContact N-O 3.32Å; Q471-Q526 PolarHBondContact O-N 2.89Å; V473-Q526 VanDerWaalsContact CG2-O 3.23Å; V473-Q526 WeakPolarHBondContact CG2-O 3.44Å
527	L	95.2	Very high	93.1	Very high	12 Å²	12	41.8 Å²	41.8	6%	0.063	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118.8	175.4	-142.3	79	0	0	0	109.8	E469 F470 V473 L515 L516 P533 L534	E469-L527 WeakPolarHBondContact O-CA 3.49Å; F470-L527 HydrophobicContact CB-CD1 4.19Å; F470-L527 HydrophobicContact CD1-CD1 3.24Å; F470-L527 HydrophobicContact CD2-CD1 3.66Å; F470-L527 HydrophobicContact CE1-CD1 3.29Å; F470-L527 HydrophobicContact CE1-CD2 4.44Å; F470-L527 HydrophobicContact CE1-CG 4.48Å; F470-L527 HydrophobicContact CE2-CD1 3.71Å; F470-L527 HydrophobicContact CE2-CD2 4.36Å; F470-L527 HydrophobicContact CE2-CG 4.37Å; F470-L527 HydrophobicContact CG-CD1 3.41Å; F470-L527 VanDerWaalsContact CG-CD1 3.41Å; F470-L527 HydrophobicContact CZ-CD1 3.51Å; F470-L527 HydrophobicContact CZ-CD2 4.05Å; F470-L527 HydrophobicContact CZ-CG 4.33Å; V473-L527 HydrophobicContact CG2-CD1 3.75Å; L515-L527 HydrophobicContact CB-CD2 4.5Å; L516-L527 HydrophobicContact CD2-CD2 3.99Å; L527-P533 WeakPolarHBondContact O-CA 3.43Å; L527-L534 HydrophobicContact CB-CD1 4.33Å; L527-L534 HydrophobicContact CB-CG 4.35Å; L527-L534 HydrophobicContact CD2-CD1 3.42Å; L527-L534 VanDerWaalsContact CD2-CD1 3.42Å; L527-L534 HydrophobicContact CD2-CG 4.22Å; L527-L534 HydrophobicContact CG-CD1 4.26Å; L527-L534 PolarHBondContact O-N 3.06Å
528	L	96.1	Very high	93.2	Very high	14 Å²	14	43 Å²	43	7%	0.073	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	140.3	-175.4	-49.2	177	0	0	0	110.9	V468 E469 E532 P533	V468-L528 WeakPolarHBondContact CA-O 3.42Å; E469-L528 HydrophobicContact CB-CB 4.25Å; E469-L528 PolarHBondContact N-O 3.49Å; E469-L528 PolarHBondContact O-N 3.25Å; L528-E532 CarbonylContact C-O 3.57Å; L528-E532 VanDerWaalsContact CA-O 3.29Å; L528-E532 WeakPolarHBondContact CA-O 3.27Å; L528-P533 HydrophobicContact CD2-CB 4.21Å; L528-P533 HydrophobicContact CD2-CG 3.9Å
529	L	96	Very high	93.1	Very high	1 Å²	1	46 Å²	46	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	118.4	168	179.7	67.9	0	0	0	107.3	L464 R467 V468 G531 E532 L534 Y537 L542 V546 V627	L464-L529 HydrophobicContact CD1-CD2 3.83Å; L464-L529 HydrophobicContact CD1-CG 4.28Å; L464-L529 HydrophobicContact CD2-CD1 3.98Å; L464-L529 HydrophobicContact CD2-CD2 4.1Å; L464-L529 HydrophobicContact CD2-CG 4.09Å; R467-L529 WeakPolarHBondContact O-CA 3.44Å; V468-L529 HydrophobicContact CG2-CD1 3.78Å; L529-G531 PolarHBondContact O-N 3.37Å; L529-G531 VanDerWaalsContact O-N 3.17Å; L529-E532 PolarHBondContact N-O 3Å; L529-E532 PolarHBondContact O-N 3.42Å; L529-L534 HydrophobicContact CB-CD2 3.63Å; L529-L534 HydrophobicContact CD2-CD2 4.19Å; L529-Y537 HydrophobicContact CB-CE2 3.86Å; L529-Y537 HydrophobicContact CD2-CE1 4.12Å; L529-Y537 HydrophobicContact CD2-CE2 4.23Å; L529-Y537 HydrophobicContact CG-CE2 4.38Å; L529-Y537 PolarHBondContact O-OH 3.45Å; L529-L542 HydrophobicContact CD2-CD1 3.84Å; L529-V546 HydrophobicContact CD2-CG2 4.23Å; L529-V627 HydrophobicContact CD1-CG2 4.17Å
530	D	94.9	Very high	93.1	Very high	48 Å²	48	50.6 Å²	50.6	26%	0.257	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	35.5	-174.4	-65.2	-4.9	0	0	0	113.7	L464 E465 G466 R467	L464-D530 WeakPolarHBondContact CA-OD2 3.39Å; L464-D530 VanDerWaalsContact CG-OD2 3.27Å; L464-D530 WeakPolarHBondContact CG-OD2 3.26Å; E465-D530 PolarHBondContact N-OD2 3.32Å; G466-D530 PolarHBondContact N-OD1 2.9Å; G466-D530 PolarHBondContact N-OD2 2.92Å; R467-D530 WeakPolarHBondContact CB-OD1 3.12Å; R467-D530 PolarHBondContact N-OD1 3.45Å; R467-D530 PolarHBondContact O-N 2.93Å
531	G	93.6	Very high	93.3	Very high	41 Å²	41	51.1 Å²	51.1	42%	0.423	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	-12.6	179	0	0	0	0	0	115.2	L529	L529-G531 PolarHBondContact O-N 3.37Å; L529-G531 VanDerWaalsContact O-N 3.17Å
532	E	94.9	Very high	93.4	Very high	81 Å²	81	48.3 Å²	48.3	38%	0.379	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	141.5	-180	-63.7	-63.3	170.2	0	0	111.8	L459 L528 L529 Y537	L459-E532 HydrophobicContact CD1-CG 4.16Å; L528-E532 CarbonylContact C-O 3.57Å; L528-E532 VanDerWaalsContact CA-O 3.29Å; L528-E532 WeakPolarHBondContact CA-O 3.27Å; L529-E532 PolarHBondContact N-O 3Å; L529-E532 PolarHBondContact O-N 3.42Å; E532-Y537 HydrophobicContact CB-CE2 3.8Å
533	P	94.1	Very high	93.5	Very high	29 Å²	29	48.7 Å²	48.7	19%	0.188	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	140.1	177.5	-20.7	31.2	0	0	0	112.7	L527 L528 T535 E536 Y537	L527-P533 WeakPolarHBondContact O-CA 3.43Å; L528-P533 HydrophobicContact CD2-CB 4.21Å; L528-P533 HydrophobicContact CD2-CG 3.9Å; P533-T535 PolarHBondContact O-N 3.41Å; P533-E536 HydrophobicContact CB-CG 4.23Å; P533-E536 HydrophobicContact CG-CG 4.31Å; P533-E536 WeakPolarHBondContact O-CB 3.12Å; P533-E536 PolarHBondContact O-N 3.03Å; P533-Y537 WeakPolarHBondContact O-CD2 3.33Å
534	L	92.6	Very high	93.6	Very high	9 Å²	9	50.3 Å²	50.3	5%	0.047	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-55.5	-26.1	178.9	-77.1	-166.7	0	0	0	114.3	L516 N518 L527 L529 E536 L542	L516-L534 WeakPolarHBondContact O-CD1 3.49Å; N518-L534 HydrophobicContact CB-CB 4.5Å; N518-L534 HydrophobicContact CB-CD1 4.33Å; N518-L534 PolarHBondContact ND2-O 3.19Å; L527-L534 HydrophobicContact CB-CD1 4.33Å; L527-L534 HydrophobicContact CB-CG 4.35Å; L527-L534 HydrophobicContact CD2-CD1 3.42Å; L527-L534 VanDerWaalsContact CD2-CD1 3.42Å; L527-L534 HydrophobicContact CD2-CG 4.22Å; L527-L534 HydrophobicContact CG-CD1 4.26Å; L527-L534 PolarHBondContact O-N 3.06Å; L529-L534 HydrophobicContact CB-CD2 3.63Å; L529-L534 HydrophobicContact CD2-CD2 4.19Å; L534-E536 VanDerWaalsContact C-N 3.27Å; L534-E536 PolarHBondContact O-N 2.84Å; L534-L542 HydrophobicContact CD2-CD1 3.74Å; L534-L542 HydrophobicContact CD2-CD2 4.33Å
535	T	91	Very high	93.7	Very high	45 Å²	45	50.3 Å²	50.3	28%	0.276	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-70	-20.9	178.1	51	0	0	0	0	113.8	P454 G457 P533	P454-T535 HydrophobicContact CB-CG2 4.41Å; P454-T535 HydrophobicContact CG-CG2 3.71Å; G457-T535 PolarHBondContact N-O 3.03Å; P533-T535 PolarHBondContact O-N 3.41Å
536	E	93.3	Very high	93.7	Very high	91 Å²	91	48.7 Å²	48.7	43%	0.425	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-84.8	-15.5	-178.2	-60.2	-162.7	-171.6	0	0	113.5	G457 I458 L459 P533 L534	G457-E536 CarbonylContact C-O 3.58Å; G457-E536 WeakPolarHBondContact CA-O 2.85Å; I458-E536 PolarHBondContact N-O 3Å; I458-E536 VanDerWaalsContact N-O 3.12Å; L459-E536 WeakPolarHBondContact CB-O 3.27Å; L459-E536 PolarHBondContact N-O 3.23Å; P533-E536 HydrophobicContact CB-CG 4.23Å; P533-E536 HydrophobicContact CG-CG 4.31Å; P533-E536 WeakPolarHBondContact O-CB 3.12Å; P533-E536 PolarHBondContact O-N 3.03Å; L534-E536 VanDerWaalsContact C-N 3.27Å; L534-E536 PolarHBondContact O-N 2.84Å
537	Y	94	Very high	93.8	Very high	7 Å²	7	43.9 Å²	43.9	3%	0.027	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-75.1	145	176	-72.4	-94	0	0	0	112	G457 L459 P461 L464 L529 E532 P533 H539 Y541	G457-Y537 PolarHBondContact N-O 3.43Å; L459-Y537 HydrophobicContact CD2-CD1 3.41Å; L459-Y537 VanDerWaalsContact CD2-CD1 3.41Å; L459-Y537 HydrophobicContact CD2-CD2 4.37Å; L459-Y537 HydrophobicContact CD2-CE1 3.1Å; L459-Y537 HydrophobicContact CD2-CE2 4.12Å; L459-Y537 HydrophobicContact CD2-CG 4.06Å; L459-Y537 VanDerWaalsContact CD2-CZ 3.49Å; L459-Y537 WeakPolarHBondContact O-CA 3.5Å; P461-Y537 HydrophobicContact CG-CE1 4.34Å; L464-Y537 HydrophobicContact CD1-CE1 3.77Å; L529-Y537 HydrophobicContact CB-CE2 3.86Å; L529-Y537 HydrophobicContact CD2-CE1 4.12Å; L529-Y537 HydrophobicContact CD2-CE2 4.23Å; L529-Y537 HydrophobicContact CG-CE2 4.38Å; L529-Y537 PolarHBondContact O-OH 3.45Å; E532-Y537 HydrophobicContact CB-CE2 3.8Å; P533-Y537 WeakPolarHBondContact O-CD2 3.33Å; Y537-H539 PolarHBondContact O-N 3.2Å; Y537-Y541 AromaticContact CD1-CD1 3.93Å; Y537-Y541 HydrophobicContact CD1-CD1 3.93Å; Y537-Y541 AromaticContact CD1-CE1 3.92Å; Y537-Y541 HydrophobicContact CD1-CE1 3.92Å; Y537-Y541 HydrophobicContact CE1-CE1 4.14Å
538	D	94.1	Very high	93.7	Very high	51 Å²	51	45.6 Å²	45.6	27%	0.273	23%	0.228	S	C	.	.			trans	-60.6	133.9	165.2	170.9	-96.6	0	0	0	109.8	G457 L459 A460 H540 Y541 L542	G457-D538 WeakPolarHBondContact O-CA 3.28Å; L459-D538 PolarHBondContact O-N 3.23Å; A460-D538 HydrophobicContact CB-CB 4.46Å; D538-H540 PolarHBondContact O-N 2.72Å; D538-H540 WeakPolarHBondContact OD1-CA 3.26Å; D538-H540 WeakPolarHBondContact OD1-CB 3.32Å; D538-H540 PolarHBondContact OD1-N 2.62Å; D538-Y541 PolarHBondContact O-N 2.68Å; D538-Y541 PolarHBondContact OD1-N 3.22Å; D538-L542 WeakPolarHBondContact O-CB 3.19Å; D538-L542 PolarHBondContact O-N 3.3Å
539	H	89.9	Confident	93.6	Very high	90 Å²	90	45.1 Å²	45.1	42%	0.417	23%	0.225	S	C	.	.	H	α-helix	trans	-61.1	-42.2	-174.4	177.2	80	0	0	0	112.5	P456 Y537 H543	P456-H539 HydrophobicContact CB-CB 4.33Å; Y537-H539 PolarHBondContact O-N 3.2Å; H539-H543 AromaticContact CD2-CD2 3.94Å; H539-H543 AromaticContact CE1-CD2 3.12Å; H539-H543 PolarHBondContact CE1-CD2 2.63Å; H539-H543 AromaticContact CE1-NE2 2.97Å; H539-H543 PolarHBondContact CE1-NE2 2.76Å; H539-H543 AromaticContact CG-CD2 3.84Å; H539-H543 AromaticContact ND1-CD2 3.33Å; H539-H543 PolarHBondContact ND1-CD2 3.15Å; H539-H543 VanDerWaalsContact ND1-CD2 3.33Å; H539-H543 AromaticContact ND1-NE2 3.34Å; H539-H543 PolarHBondContact ND1-NE2 3.05Å; H539-H543 AromaticContact NE2-CD2 3.52Å; H539-H543 AromaticContact NE2-NE2 3.77Å; H539-H543 PolarHBondContact O-CD2 3.13Å; H539-H543 PolarHBondContact O-N 3.41Å; H539-H543 VanDerWaalsContact O-N 3.12Å
540	H	91.1	Very high	93.3	Very high	150 Å²	150	46.1 Å²	46.1	69%	0.694	24%	0.236	S	C	*	.	H	α-helix	trans	-69.3	-39.8	179.7	-73.6	-64.7	0	0	0	111.7	D538 R544	D538-H540 PolarHBondContact O-N 2.72Å; D538-H540 WeakPolarHBondContact OD1-CA 3.26Å; D538-H540 WeakPolarHBondContact OD1-CB 3.32Å; D538-H540 PolarHBondContact OD1-N 2.62Å; H540-R544 PolarHBondContact O-N 2.72Å
541	Y	93.3	Very high	92.8	Very high	33 Å²	33	48.3 Å²	48.3	13%	0.129	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-51.1	174.4	178.9	-91.9	0	0	0	111.4	A460 P461 L464 Y537 D538 H543 R544 Q545	A460-Y541 HydrophobicContact CB-CD1 4.37Å; A460-Y541 HydrophobicContact CB-CD2 3.72Å; A460-Y541 HydrophobicContact CB-CE2 4.33Å; A460-Y541 HydrophobicContact CB-CG 3.74Å; P461-Y541 HydrophobicContact CG-CE1 4.26Å; P461-Y541 WeakPolarHBondContact O-CE2 3.37Å; P461-Y541 PolarHBondContact O-OH 2.72Å; L464-Y541 HydrophobicContact CD1-CE1 3.67Å; L464-Y541 WeakPolarHBondContact CD1-OH 3.36Å; Y537-Y541 AromaticContact CD1-CD1 3.93Å; Y537-Y541 HydrophobicContact CD1-CD1 3.93Å; Y537-Y541 AromaticContact CD1-CE1 3.92Å; Y537-Y541 HydrophobicContact CD1-CE1 3.92Å; Y537-Y541 HydrophobicContact CE1-CE1 4.14Å; D538-Y541 PolarHBondContact O-N 2.68Å; D538-Y541 PolarHBondContact OD1-N 3.22Å; Y541-H543 PolarHBondContact O-N 2.96Å; Y541-R544 WeakPolarHBondContact O-CB 3.47Å; Y541-R544 PolarHBondContact O-N 3Å; Y541-Q545 HydrophobicContact CD1-CG 4.2Å; Y541-Q545 HydrophobicContact CE1-CG 3.71Å; Y541-Q545 HydrophobicContact CE2-CG 4.18Å; Y541-Q545 WeakPolarHBondContact O-CG 3.49Å; Y541-Q545 PolarHBondContact O-N 3.32Å; Y541-Q545 VanDerWaalsContact O-N 3.12Å
542	L	94.2	Very high	92.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-56.9	-48	-179.2	-179.9	64	0	0	0	111.8	N518 L529 L534 D538 R544 Q545 V546	N518-L542 HydrophobicContact CB-CD2 3.57Å; L529-L542 HydrophobicContact CD2-CD1 3.84Å; L534-L542 HydrophobicContact CD2-CD1 3.74Å; L534-L542 HydrophobicContact CD2-CD2 4.33Å; D538-L542 WeakPolarHBondContact O-CB 3.19Å; D538-L542 PolarHBondContact O-N 3.3Å; L542-R544 PolarHBondContact O-N 2.97Å; L542-Q545 PolarHBondContact O-N 3.28Å; L542-V546 HydrophobicContact CD1-CB 4.38Å; L542-V546 HydrophobicContact CD1-CG2 3.69Å; L542-V546 PolarHBondContact O-N 3.4Å
543	H	93.3	Very high	91.9	Very high	43 Å²	43	52 Å²	52	20%	0.199	25%	0.253	C	S	.	.	H	α-helix	trans	-72.8	-7.2	179.7	-75.9	-69.5	0	0	0	114.8	Q517 H539 Y541	Q517-H543 PolarHBondContact O-CE1 3.4Å; Q517-H543 PolarHBondContact O-NE2 3.01Å; H539-H543 AromaticContact CD2-CD2 3.94Å; H539-H543 AromaticContact CE1-CD2 3.12Å; H539-H543 PolarHBondContact CE1-CD2 2.63Å; H539-H543 AromaticContact CE1-NE2 2.97Å; H539-H543 PolarHBondContact CE1-NE2 2.76Å; H539-H543 AromaticContact CG-CD2 3.84Å; H539-H543 AromaticContact ND1-CD2 3.33Å; H539-H543 PolarHBondContact ND1-CD2 3.15Å; H539-H543 VanDerWaalsContact ND1-CD2 3.33Å; H539-H543 AromaticContact ND1-NE2 3.34Å; H539-H543 PolarHBondContact ND1-NE2 3.05Å; H539-H543 AromaticContact NE2-CD2 3.52Å; H539-H543 AromaticContact NE2-NE2 3.77Å; H539-H543 PolarHBondContact O-CD2 3.13Å; H539-H543 PolarHBondContact O-N 3.41Å; H539-H543 VanDerWaalsContact O-N 3.12Å; Y541-H543 PolarHBondContact O-N 2.96Å
544	R	93.2	Very high	91.6	Very high	135 Å²	135	54.8 Å²	54.8	51%	0.509	27%	0.27	S	S	.	.	H	α-helix	trans	-86.5	-34.6	166.7	-170.1	177.6	178.6	173.6	2	111.5	H540 Y541 L542 R623	H540-R544 PolarHBondContact O-N 2.72Å; Y541-R544 WeakPolarHBondContact O-CB 3.47Å; Y541-R544 PolarHBondContact O-N 3Å; L542-R544 PolarHBondContact O-N 2.97Å; R544-R623 HydrophobicContact CG-CB 4.25Å
545	Q	94.3	Very high	91.6	Very high	28 Å²	28	54.5 Å²	54.5	13%	0.131	27%	0.268	C	S	.	.	H	α-helix	trans	-87.2	-33	-177.9	-59.6	-56.1	-22.9	0	0	113.8	L464 Y541 L542 P625 R626 V627	L464-Q545 HydrophobicContact CD1-CG 4.46Å; Y541-Q545 HydrophobicContact CD1-CG 4.2Å; Y541-Q545 HydrophobicContact CE1-CG 3.71Å; Y541-Q545 HydrophobicContact CE2-CG 4.18Å; Y541-Q545 WeakPolarHBondContact O-CG 3.49Å; Y541-Q545 PolarHBondContact O-N 3.32Å; Y541-Q545 VanDerWaalsContact O-N 3.12Å; L542-Q545 PolarHBondContact O-N 3.28Å; Q545-P625 VanDerWaalsContact O-CB 3.26Å; Q545-P625 WeakPolarHBondContact O-CB 3.41Å; Q545-R626 PolarHBondContact O-N 2.79Å; Q545-V627 PolarHBondContact O-N 3.03Å
546	V	95.3	Very high	91.6	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.018	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	106.6	-179.7	-173.9	0	0	0	0	109.2	L529 L542 V627 I629	L529-V546 HydrophobicContact CD2-CG2 4.23Å; L542-V546 HydrophobicContact CD1-CB 4.38Å; L542-V546 HydrophobicContact CD1-CG2 3.69Å; L542-V546 PolarHBondContact O-N 3.4Å; V546-V627 WeakPolarHBondContact CA-O 3.34Å; V546-V627 HydrophobicContact CB-CB 4.44Å; V546-V627 HydrophobicContact CG1-CB 4.28Å; V546-V627 HydrophobicContact CG1-CG1 4.26Å; V546-V627 HydrophobicContact CG2-CB 4.08Å; V546-V627 HydrophobicContact CG2-CG2 4.28Å; V546-I629 HydrophobicContact CG1-CD1 4.05Å
547	V	94.9	Very high	91.4	Very high	11 Å²	11	56 Å²	56	7%	0.067	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	134.3	-171.2	-176.8	0	0	0	0	111.1	A620 R623 P625 V627 I629	V547-A620 HydrophobicContact CB-CB 4.46Å; V547-A620 HydrophobicContact CG1-CB 3.49Å; V547-A620 VanDerWaalsContact CG1-CB 3.49Å; V547-R623 HydrophobicContact CG2-CB 4.46Å; V547-P625 HydrophobicContact CB-CB 4.08Å; V547-P625 HydrophobicContact CB-CG 4.17Å; V547-P625 HydrophobicContact CG2-CB 3.67Å; V547-P625 HydrophobicContact CG2-CG 4.09Å; V547-V627 PolarHBondContact N-O 3.44Å; V547-I629 PolarHBondContact O-N 3.29Å
548	L	93.9	Very high	91.3	Very high	48 Å²	48	56.2 Å²	56.2	25%	0.251	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	135.2	176.8	175.6	66.3	0	0	0	110.7	A513 Q517 I629 D631	A513-L548 HydrophobicContact CB-CD1 4.1Å; A513-L548 HydrophobicContact CB-CD2 4.43Å; Q517-L548 HydrophobicContact CG-CB 4.24Å; Q517-L548 VanDerWaalsContact OE1-CD2 3.29Å; L548-I629 CarbonylContact C-O 3.57Å; L548-I629 WeakPolarHBondContact CA-O 3.48Å; L548-I629 HydrophobicContact CB-CB 4.42Å; L548-I629 HydrophobicContact CD1-CB 3.72Å; L548-I629 HydrophobicContact CD1-CG2 3.48Å; L548-I629 VanDerWaalsContact CD1-CG2 3.48Å; L548-D631 HydrophobicContact CD1-CB 4.1Å
549	V	93	Very high	91.3	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.018	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	108.9	159.2	-172.5	0	0	0	0	107.4	A616 I617 A620 L628 I629 L630 D631 A633	V549-A616 HydrophobicContact CG1-CB 4.1Å; V549-I617 HydrophobicContact CG1-CG1 3.91Å; V549-I617 HydrophobicContact CG2-CG1 4.21Å; V549-A620 HydrophobicContact CG2-CB 3.63Å; V549-L628 HydrophobicContact CG2-CD1 4.38Å; V549-I629 PolarHBondContact N-O 3.01Å; V549-L630 HydrophobicContact CB-CD2 3.85Å; V549-L630 HydrophobicContact CG2-CD2 3.76Å; V549-D631 PolarHBondContact O-N 2.93Å; V549-A633 HydrophobicContact CB-CB 3.95Å; V549-A633 HydrophobicContact CG1-CB 3.51Å
550	G	89.3	Confident	91.5	Very high	23 Å²	23	49.8 Å²	49.8	24%	0.237	25%	0.253	C	S	.	.			trans	-77	161.1	-179.7	0	0	0	0	0	113.2	E552 D631	G550-E552 PolarHBondContact O-N 3.18Å; G550-D631 CarbonylContact C-O 3.57Å
551	Q	85.3	Confident	91.7	Very high	93 Å²	93	45.4 Å²	45.4	44%	0.435	23%	0.232	S	C	.	.	S	Bend	trans	-56.2	-48	178.6	-176.7	-178.1	22.2	0	0	112.3	P553 Q613 D631 E632	Q551-P553 VanDerWaalsContact O-CD 3.27Å; Q551-P553 WeakPolarHBondContact O-CD 3.36Å; Q551-Q613 PolarHBondContact O-NE2 3.3Å; Q551-Q613 VanDerWaalsContact O-NE2 3.08Å; Q551-D631 WeakPolarHBondContact CA-O 3.35Å; Q551-D631 PolarHBondContact N-O 3.43Å; Q551-E632 HydrophobicContact CB-CB 4.31Å; Q551-E632 HydrophobicContact CG-CB 3.99Å; Q551-E632 VanDerWaalsContact NE2-CD 3.28Å; Q551-E632 PolarHBondContact NE2-OE2 3.47Å
552	E	83.8	Confident	91.7	Very high	173 Å²	173	47.9 Å²	47.9	81%	0.808	25%	0.247	S	C	*	.	S	Bend	trans	-110.9	86.9	173.8	-67.4	-172.6	172.7	0	0	110	G550 V554	G550-E552 PolarHBondContact O-N 3.18Å; E552-V554 PolarHBondContact O-N 2.95Å
553	P	85.3	Confident	91.7	Very high	26 Å²	26	47.9 Å²	47.9	17%	0.169	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-68.5	129.3	-177	24.6	-31.2	0	0	0	111.5	Q551 K612 Q613 A616	Q551-P553 VanDerWaalsContact O-CD 3.27Å; Q551-P553 WeakPolarHBondContact O-CD 3.36Å; P553-K612 HydrophobicContact CG-CB 4.39Å; P553-Q613 HydrophobicContact CG-CG 3.96Å; P553-A616 HydrophobicContact CB-CB 3.3Å; P553-A616 HydrophobicContact CG-CB 3.83Å
554	V	88.5	Confident	91.8	Very high	89 Å²	89	45.9 Å²	45.9	54%	0.539	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-85.9	121.2	174.8	-176.5	0	0	0	0	109.4	E552 R619	E552-V554 PolarHBondContact O-N 2.95Å; V554-R619 PolarHBondContact O-NH1 2.92Å
555	L	91.7	Very high	91.9	Very high	2 Å²	2	40 Å²	40	1%	0.01	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-99.2	152.8	170.2	-58.6	178.3	0	0	0	110	I600 K603 L607 K612 L615 R619	L555-I600 HydrophobicContact CB-CD1 3.86Å; L555-I600 HydrophobicContact CD1-CD1 3.8Å; L555-I600 HydrophobicContact CG-CD1 4.37Å; L555-K603 WeakPolarHBondContact O-CA 3.47Å; L555-L607 HydrophobicContact CD1-CD1 3.77Å; L555-K612 HydrophobicContact CD1-CB 4Å; L555-K612 HydrophobicContact CD1-CD 4.44Å; L555-K612 HydrophobicContact CD1-CG 3.84Å; L555-L615 HydrophobicContact CD1-CD2 3.82Å; L555-L615 HydrophobicContact CD2-CD2 3.98Å; L555-L615 HydrophobicContact CD2-CG 4.45Å; L555-R619 VanDerWaalsContact CD2-NH2 3.27Å
556	F	91.6	Very high	91.9	Very high	91 Å²	91	44 Å²	44	40%	0.399	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-103.9	153.7	177.4	-65.8	-78.7	0	0	0	110	N563 Y566	F556-N563 PolarHBondContact N-OD1 2.89Å; F556-N563 PolarHBondContact O-ND2 2.92Å; F556-N563 PolarHBondContact O-OD1 3.46Å; F556-Y566 AromaticContact CD2-CD2 3.88Å; F556-Y566 HydrophobicContact CD2-CD2 3.88Å; F556-Y566 HydrophobicContact CD2-CE1 4.37Å; F556-Y566 AromaticContact CD2-CE2 3.54Å; F556-Y566 HydrophobicContact CD2-CE2 3.54Å; F556-Y566 HydrophobicContact CD2-CG 4.42Å; F556-Y566 AromaticContact CD2-CZ 3.82Å; F556-Y566 HydrophobicContact CE2-CD1 4.33Å; F556-Y566 HydrophobicContact CE2-CD2 4.27Å; F556-Y566 AromaticContact CE2-CE1 3.78Å; F556-Y566 HydrophobicContact CE2-CE1 3.78Å; F556-Y566 AromaticContact CE2-CE2 3.71Å; F556-Y566 HydrophobicContact CE2-CE2 3.71Å; F556-Y566 AromaticContact CE2-CZ 3.44Å; F556-Y566 VanDerWaalsContact CE2-CZ 3.44Å; F556-Y566 HydrophobicContact CG-CE2 4.16Å; F556-Y566 HydrophobicContact CZ-CE1 4.47Å; F556-Y566 HydrophobicContact CZ-CE2 4.43Å; F556-Y566 AromaticContact CZ-CZ 3.95Å
557	S	90.1	Very high	91.6	Very high	78 Å²	78	47.4 Å²	47.4	55%	0.545	27%	0.269	S	S	.	.	S	Bend	trans	-59.9	139.1	169.2	-50.8	0	0	0	0	109.6	E602	S557-E602 WeakPolarHBondContact OG-CA 3.32Å
558	G	91.2	Very high	91.4	Very high	10 Å²	10	49.1 Å²	49.1	10%	0.103	28%	0.277	C	S	.	.	S	Bend	trans	135.4	-173.9	-171.7	0	0	0	0	0	111	E599 I600	G558-E599 WeakPolarHBondContact CA-OE2 3.37Å; G558-E599 PolarHBondContact N-OE2 3.01Å; G558-I600 WeakPolarHBondContact O-CG1 3.39Å; G558-I600 PolarHBondContact O-N 3.37Å; G558-I600 VanDerWaalsContact O-N 3.13Å
559	S	93.6	Very high	90.9	Very high	7 Å²	7	57.9 Å²	57.9	5%	0.049	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-74.6	165.1	-179.7	69.5	0	0	0	0	113.1	K561 D562 N563 T598	S559-K561 PolarHBondContact O-N 3.17Å; S559-K561 PolarHBondContact OG-N 3.12Å; S559-D562 WeakPolarHBondContact CB-OD2 3.35Å; S559-D562 PolarHBondContact N-OD2 2.95Å; S559-D562 PolarHBondContact O-N 3.05Å; S559-D562 PolarHBondContact OG-N 2.93Å; S559-D562 PolarHBondContact OG-OD2 3.04Å; S559-N563 PolarHBondContact O-N 3.22Å; S559-N563 VanDerWaalsContact O-N 3.09Å; S559-N563 PolarHBondContact O-ND2 3.48Å; S559-T598 CarbonylContact C-O 3.32Å; S559-T598 VanDerWaalsContact CA-O 3.25Å; S559-T598 WeakPolarHBondContact CA-O 3.46Å
560	V	94.9	Very high	90.4	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-53	-45.3	167.6	167	0	0	0	0	110.4	N563 I564 I589 M592 I596 T598 I600 L615	V560-N563 PolarHBondContact O-N 3.37Å; V560-I564 HydrophobicContact CG1-CD1 3.94Å; V560-I564 WeakPolarHBondContact O-CG1 3.27Å; V560-I564 PolarHBondContact O-N 3.5Å; V560-I589 HydrophobicContact CG1-CD1 3.66Å; V560-I589 HydrophobicContact CG1-CG1 3.97Å; V560-I589 HydrophobicContact CG1-CG2 4.44Å; V560-M592 HydrophobicContact CG2-SD 4.04Å; V560-I596 WeakPolarHBondContact CB-O 3.15Å; V560-I596 PolarHBondContact N-O 2.99Å; V560-T598 PolarHBondContact N-O 3.38Å; V560-I600 HydrophobicContact CG2-CG2 3.6Å; V560-L615 HydrophobicContact CG1-CD1 3.75Å
561	K	94.9	Very high	90.4	Very high	57 Å²	57	65.1 Å²	65.1	25%	0.248	34%	0.341	C	S	.	.	H	α-helix	trans	-58.4	-49.9	176.6	178.1	179.2	172.1	175.5	0	111.9	S559 N563 I564 A565 D573 V576 I596	S559-K561 PolarHBondContact O-N 3.17Å; S559-K561 PolarHBondContact OG-N 3.12Å; K561-N563 PolarHBondContact O-N 3.37Å; K561-I564 PolarHBondContact O-N 3.17Å; K561-A565 WeakPolarHBondContact O-CB 3.46Å; K561-A565 PolarHBondContact O-N 2.77Å; K561-D573 WeakPolarHBondContact CD-OD1 3.37Å; K561-D573 WeakPolarHBondContact CE-OD1 3.46Å; K561-D573 IonicContact NZ-OD1 3.95Å; K561-D573 PolarHBondContact NZ-OD1 2.77Å; K561-D573 IonicContact NZ-OD2 3.28Å; K561-V576 HydrophobicContact CG-CG2 4.36Å; K561-I596 HydrophobicContact CB-CB 4.27Å; K561-I596 WeakPolarHBondContact CB-O 3.45Å; K561-I596 HydrophobicContact CD-CD1 4.44Å; K561-I596 PolarHBondContact N-O 2.93Å
562	D	93.9	Very high	90.7	Very high	85 Å²	85	66.9 Å²	66.9	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-60.8	-34.4	-179.4	-60.3	-39.4	0	0	0	111.7	S559 Y566	S559-D562 WeakPolarHBondContact CB-OD2 3.35Å; S559-D562 PolarHBondContact N-OD2 2.95Å; S559-D562 PolarHBondContact O-N 3.05Å; S559-D562 PolarHBondContact OG-N 2.93Å; S559-D562 PolarHBondContact OG-OD2 3.04Å; D562-Y566 WeakPolarHBondContact O-CA 3.35Å; D562-Y566 WeakPolarHBondContact O-CB 3.27Å; D562-Y566 PolarHBondContact O-N 3.38Å; D562-Y566 VanDerWaalsContact O-N 3.08Å
563	N	94.8	Very high	91.2	Very high	1 Å²	1	62 Å²	62	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-73.3	-40	177	-85.4	-87	0	0	0	112.9	F556 S559 V560 K561 Y566 I600 L615 R619	F556-N563 PolarHBondContact N-OD1 2.89Å; F556-N563 PolarHBondContact O-ND2 2.92Å; F556-N563 PolarHBondContact O-OD1 3.46Å; S559-N563 PolarHBondContact O-N 3.22Å; S559-N563 VanDerWaalsContact O-N 3.09Å; S559-N563 PolarHBondContact O-ND2 3.48Å; V560-N563 PolarHBondContact O-N 3.37Å; K561-N563 PolarHBondContact O-N 3.37Å; N563-Y566 WeakPolarHBondContact O-CB 3.39Å; N563-I600 HydrophobicContact CB-CD1 4.34Å; N563-I600 VanDerWaalsContact ND2-CD1 3.33Å; N563-I600 WeakPolarHBondContact ND2-CD1 3.32Å; N563-L615 HydrophobicContact CB-CD2 4.05Å; N563-R619 PolarHBondContact O-NE 3.17Å; N563-R619 PolarHBondContact O-NH2 3.37Å; N563-R619 PolarHBondContact OD1-NH2 3.01Å
564	I	95.4	Very high	91.6	Very high	0 Å²	0	64 Å²	64	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-68.9	-49.9	176.7	-66.3	169.3	0	0	0	109.8	V560 K561 Y566 V576 A580 I589 L615 A618 V622	V560-I564 HydrophobicContact CG1-CD1 3.94Å; V560-I564 WeakPolarHBondContact O-CG1 3.27Å; V560-I564 PolarHBondContact O-N 3.5Å; K561-I564 PolarHBondContact O-N 3.17Å; I564-Y566 PolarHBondContact O-N 3.21Å; I564-V576 HydrophobicContact CB-CG1 4.04Å; I564-V576 HydrophobicContact CD1-CG1 3.67Å; I564-V576 HydrophobicContact CG1-CG1 4.45Å; I564-V576 HydrophobicContact CG2-CB 4.49Å; I564-V576 HydrophobicContact CG2-CG1 3.98Å; I564-V576 HydrophobicContact CG2-CG2 4.45Å; I564-A580 HydrophobicContact CD1-CB 4.35Å; I564-I589 HydrophobicContact CD1-CD1 4.48Å; I564-L615 HydrophobicContact CD1-CD1 3.62Å; I564-L615 HydrophobicContact CG1-CD1 3.5Å; I564-L615 VanDerWaalsContact CG1-CD1 3.5Å; I564-L615 HydrophobicContact CG1-CG 4.24Å; I564-A618 HydrophobicContact CD1-CB 4.13Å; I564-A618 HydrophobicContact CG1-CB 4.06Å; I564-A618 HydrophobicContact CG2-CB 4.42Å; I564-V622 HydrophobicContact CG2-CB 4.01Å; I564-V622 HydrophobicContact CG2-CG1 3.92Å; I564-V622 HydrophobicContact CG2-CG2 4.33Å; I564-V622 WeakPolarHBondContact O-CG1 3.28Å
565	A	94.8	Very high	91.8	Very high	13 Å²	13	64.5 Å²	64.5	11%	0.107	34%	0.344	C	S	.	.	S	Bend	trans	-79.5	6.9	-177.7	0	0	0	0	0	114.2	K561 G567 L568 C571 V576	K561-A565 WeakPolarHBondContact O-CB 3.46Å; K561-A565 PolarHBondContact O-N 2.77Å; A565-G567 PolarHBondContact O-N 3.49Å; A565-L568 WeakPolarHBondContact O-CB 3.33Å; A565-L568 PolarHBondContact O-N 2.91Å; A565-C571 HydrophobicContact CB-CB 3.75Å; A565-V576 HydrophobicContact CB-CG2 4.4Å
566	Y	94	Very high	91.9	Very high	112 Å²	112	64.4 Å²	64.4	44%	0.439	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	123	-174.2	-174.2	-99.9	0	0	0	111.9	F556 D562 N563 I564 L568 R623	F556-Y566 AromaticContact CD2-CD2 3.88Å; F556-Y566 HydrophobicContact CD2-CD2 3.88Å; F556-Y566 HydrophobicContact CD2-CE1 4.37Å; F556-Y566 AromaticContact CD2-CE2 3.54Å; F556-Y566 HydrophobicContact CD2-CE2 3.54Å; F556-Y566 HydrophobicContact CD2-CG 4.42Å; F556-Y566 AromaticContact CD2-CZ 3.82Å; F556-Y566 HydrophobicContact CE2-CD1 4.33Å; F556-Y566 HydrophobicContact CE2-CD2 4.27Å; F556-Y566 AromaticContact CE2-CE1 3.78Å; F556-Y566 HydrophobicContact CE2-CE1 3.78Å; F556-Y566 AromaticContact CE2-CE2 3.71Å; F556-Y566 HydrophobicContact CE2-CE2 3.71Å; F556-Y566 AromaticContact CE2-CZ 3.44Å; F556-Y566 VanDerWaalsContact CE2-CZ 3.44Å; F556-Y566 HydrophobicContact CG-CE2 4.16Å; F556-Y566 HydrophobicContact CZ-CE1 4.47Å; F556-Y566 HydrophobicContact CZ-CE2 4.43Å; F556-Y566 AromaticContact CZ-CZ 3.95Å; D562-Y566 WeakPolarHBondContact O-CA 3.35Å; D562-Y566 WeakPolarHBondContact O-CB 3.27Å; D562-Y566 PolarHBondContact O-N 3.38Å; D562-Y566 VanDerWaalsContact O-N 3.08Å; N563-Y566 WeakPolarHBondContact O-CB 3.39Å; I564-Y566 PolarHBondContact O-N 3.21Å; Y566-L568 VanDerWaalsContact C-N 3.28Å; Y566-L568 PolarHBondContact O-N 3.46Å; Y566-R623 PolarHBondContact O-NH2 3.23Å
567	G	88.8	Confident	92	Very high	74 Å²	74	63 Å²	63	76%	0.763	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-0.7	178.8	0	0	0	0	0	116.1	A565	A565-G567 PolarHBondContact O-N 3.49Å
568	L	90.4	Very high	92.1	Very high	46 Å²	46	61.8 Å²	61.8	24%	0.241	33%	0.334	C	S	.	.			trans	-94.6	142.7	168.5	-64.4	174.2	0	0	0	109.9	A565 Y566 C571 V622 R623	A565-L568 WeakPolarHBondContact O-CB 3.33Å; A565-L568 PolarHBondContact O-N 2.91Å; Y566-L568 VanDerWaalsContact C-N 3.28Å; Y566-L568 PolarHBondContact O-N 3.46Å; L568-C571 HydrophobicContact CB-CB 4.47Å; L568-V622 HydrophobicContact CD1-CG1 3.79Å; L568-V622 HydrophobicContact CD1-CG2 4.41Å; L568-R623 HydrophobicContact CD1-CG 4.1Å; L568-R623 HydrophobicContact CD2-CG 4.26Å; L568-R623 HydrophobicContact CG-CG 4.44Å
569	R	84.5	Confident	92.2	Very high	233 Å²	233	61.6 Å²	61.6	88%	0.879	33%	0.332	S	S	*	.	S	Bend	trans	-92.5	138.7	170.9	-63.4	-175.9	-177	178.4	2.1	108.8	C571	R569-C571 PolarHBondContact O-N 3.36Å
570	D	80.6	Confident	92.1	Very high	160 Å²	160	61.3 Å²	61.3	86%	0.856	33%	0.329	S	S	*	.	S	Bend	trans	54.3	47.2	170.5	-49.6	-45.2	0	0	0	114.5
571	C	89.3	Confident	92	Very high	17 Å²	17	67.4 Å²	67.4	12%	0.115	36%	0.358	C	S	.	.			trans	-79.6	121.1	175.5	-168.2	0	0	0	0	110.7	A565 L568 R569	A565-C571 HydrophobicContact CB-CB 3.75Å; L568-C571 HydrophobicContact CB-CB 4.47Å; R569-C571 PolarHBondContact O-N 3.36Å
572	E	92.6	Very high	91.6	Very high	130 Å²	130	65.8 Å²	65.8	61%	0.607	36%	0.355	S	S	*	.			trans	-72.2	146.9	178.7	-66.1	-174.5	169.7	0	0	112.1	A574 Q575 V576	E572-A574 PolarHBondContact O-N 2.94Å; E572-A574 VanDerWaalsContact O-N 3.15Å; E572-Q575 HydrophobicContact CB-CG 4.39Å; E572-Q575 WeakPolarHBondContact O-CB 3.3Å; E572-Q575 PolarHBondContact O-N 3.4Å; E572-V576 PolarHBondContact O-N 2.95Å; E572-V576 VanDerWaalsContact O-N 3.15Å
573	D	93.6	Very high	91.4	Very high	71 Å²	71	61.9 Å²	61.9	38%	0.38	34%	0.335	S	S	.	.	H	α-helix	trans	-58.2	-32.1	178.8	-69.2	-6.3	0	0	0	112.3	K561 Q575 V576 M577 I596	K561-D573 WeakPolarHBondContact CD-OD1 3.37Å; K561-D573 WeakPolarHBondContact CE-OD1 3.46Å; K561-D573 IonicContact NZ-OD1 3.95Å; K561-D573 PolarHBondContact NZ-OD1 2.77Å; K561-D573 IonicContact NZ-OD2 3.28Å; D573-Q575 PolarHBondContact O-N 3.43Å; D573-V576 PolarHBondContact O-N 2.91Å; D573-M577 WeakPolarHBondContact O-CB 3.44Å; D573-M577 WeakPolarHBondContact O-CG 3.33Å; D573-M577 PolarHBondContact O-N 3.2Å; D573-I596 HydrophobicContact CB-CD1 3.89Å
574	A	93.4	Very high	91.2	Very high	68 Å²	68	62.8 Å²	62.8	56%	0.562	34%	0.341	S	S	*	.	H	α-helix	trans	-62.6	-40.5	175.2	0	0	0	0	0	112.2	E572 M577 A578	E572-A574 PolarHBondContact O-N 2.94Å; E572-A574 VanDerWaalsContact O-N 3.15Å; A574-M577 PolarHBondContact O-N 3.28Å; A574-A578 WeakPolarHBondContact O-CB 3.4Å; A574-A578 PolarHBondContact O-N 2.88Å
575	Q	93.1	Very high	91	Very high	100 Å²	100	62.8 Å²	62.8	47%	0.467	34%	0.341	S	S	.	.	H	α-helix	trans	-69.1	-40.1	177	-65	179.8	-10.1	0	0	111.2	E572 D573 A578 A579 V622	E572-Q575 HydrophobicContact CB-CG 4.39Å; E572-Q575 WeakPolarHBondContact O-CB 3.3Å; E572-Q575 PolarHBondContact O-N 3.4Å; D573-Q575 PolarHBondContact O-N 3.43Å; Q575-A578 PolarHBondContact O-N 3.45Å; Q575-A579 WeakPolarHBondContact O-CB 3.14Å; Q575-A579 PolarHBondContact O-N 3.36Å; Q575-V622 HydrophobicContact CB-CG2 4.36Å
576	V	94.6	Very high	90.8	Very high	0 Å²	0	63 Å²	63	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-60.7	-46.4	175.2	174.7	0	0	0	0	110.7	K561 I564 A565 E572 D573 A579 A580 I596	K561-V576 HydrophobicContact CG-CG2 4.36Å; I564-V576 HydrophobicContact CB-CG1 4.04Å; I564-V576 HydrophobicContact CD1-CG1 3.67Å; I564-V576 HydrophobicContact CG1-CG1 4.45Å; I564-V576 HydrophobicContact CG2-CB 4.49Å; I564-V576 HydrophobicContact CG2-CG1 3.98Å; I564-V576 HydrophobicContact CG2-CG2 4.45Å; A565-V576 HydrophobicContact CB-CG2 4.4Å; E572-V576 PolarHBondContact O-N 2.95Å; E572-V576 VanDerWaalsContact O-N 3.15Å; D573-V576 PolarHBondContact O-N 2.91Å; V576-A579 PolarHBondContact O-N 2.98Å; V576-A580 WeakPolarHBondContact O-CB 3.37Å; V576-A580 PolarHBondContact O-N 3.24Å; V576-I596 HydrophobicContact CG1-CG2 4.38Å
577	M	93.6	Very high	90.6	Very high	60 Å²	60	63.4 Å²	63.4	30%	0.296	35%	0.353	S	S	.	.	H	α-helix	trans	-68.2	-39.5	178.5	-74.8	-57.1	-62.5	0	0	112.8	D573 A574 A579 A580 Q581 A586 I596	D573-M577 WeakPolarHBondContact O-CB 3.44Å; D573-M577 WeakPolarHBondContact O-CG 3.33Å; D573-M577 PolarHBondContact O-N 3.2Å; A574-M577 PolarHBondContact O-N 3.28Å; M577-A579 VanDerWaalsContact C-N 3.34Å; M577-A579 PolarHBondContact O-N 2.98Å; M577-A580 PolarHBondContact O-N 3.45Å; M577-Q581 WeakPolarHBondContact O-CG 3.43Å; M577-Q581 PolarHBondContact O-N 3.47Å; M577-A586 HydrophobicContact CE-CB 4.46Å; M577-I596 HydrophobicContact CG-CG2 4.3Å; M577-I596 HydrophobicContact SD-CG2 3.31Å; M577-I596 WeakPolarHBondContact SD-CG2 3.4Å
578	A	91.6	Very high	90.7	Very high	54 Å²	54	60.7 Å²	60.7	45%	0.446	32%	0.32	S	S	.	.	H	α-helix	trans	-61.8	-42.5	175.1	0	0	0	0	0	111.6	A574 Q575 Q581 A582	A574-A578 WeakPolarHBondContact O-CB 3.4Å; A574-A578 PolarHBondContact O-N 2.88Å; Q575-A578 PolarHBondContact O-N 3.45Å; A578-Q581 PolarHBondContact O-N 2.94Å; A578-A582 PolarHBondContact O-N 3.42Å
579	A	92.8	Very high	90.9	Very high	6 Å²	6	58.6 Å²	58.6	5%	0.05	31%	0.309	C	S	.	.	H	α-helix	trans	-66.2	-38.9	174.6	0	0	0	0	0	112.3	Q575 V576 M577 A582 A583 L621 V622	Q575-A579 WeakPolarHBondContact O-CB 3.14Å; Q575-A579 PolarHBondContact O-N 3.36Å; V576-A579 PolarHBondContact O-N 2.98Å; M577-A579 VanDerWaalsContact C-N 3.34Å; M577-A579 PolarHBondContact O-N 2.98Å; A579-A582 PolarHBondContact O-N 2.96Å; A579-A583 WeakPolarHBondContact O-CB 3.25Å; A579-A583 PolarHBondContact O-N 3.4Å; A579-A583 VanDerWaalsContact O-N 3.08Å; A579-L621 HydrophobicContact CB-CB 4.38Å; A579-V622 HydrophobicContact CB-CB 3.63Å; A579-V622 HydrophobicContact CB-CG2 4.15Å
580	A	93.5	Very high	91.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.4	-39.4	174.8	0	0	0	0	0	112.2	I564 V576 M577 A583 C584 A585 A586 I589	I564-A580 HydrophobicContact CD1-CB 4.35Å; V576-A580 WeakPolarHBondContact O-CB 3.37Å; V576-A580 PolarHBondContact O-N 3.24Å; M577-A580 PolarHBondContact O-N 3.45Å; A580-A583 CarbonylContact O-C 3.57Å; A580-A583 PolarHBondContact O-N 3.48Å; A580-C584 PolarHBondContact O-N 2.98Å; A580-A585 HydrophobicContact CB-CB 4.2Å; A580-A585 WeakPolarHBondContact O-CA 3.41Å; A580-A585 PolarHBondContact O-N 3.11Å; A580-A586 PolarHBondContact O-N 2.9Å; A580-I589 HydrophobicContact CB-CD1 3.93Å
581	Q	91.3	Very high	91.7	Very high	128 Å²	128	50.8 Å²	50.8	60%	0.598	29%	0.294	S	S	*	.	H	α-helix	trans	-63.9	-47.9	174.2	-75.3	174.5	-3.4	0	0	111.4	M577 A578 A583 C584 A586	M577-Q581 WeakPolarHBondContact O-CG 3.43Å; M577-Q581 PolarHBondContact O-N 3.47Å; A578-Q581 PolarHBondContact O-N 2.94Å; Q581-A583 PolarHBondContact O-N 3.33Å; Q581-A583 VanDerWaalsContact O-N 3.16Å; Q581-C584 PolarHBondContact O-N 3.42Å; Q581-A586 HydrophobicContact CB-CB 4.43Å; Q581-A586 HydrophobicContact CG-CB 3.65Å
582	A	87.7	Confident	91.9	Very high	23 Å²	23	51.8 Å²	51.8	19%	0.19	30%	0.297	C	S	.	.	H	α-helix	trans	-61.3	-24.3	177.4	0	0	0	0	0	113.2	A578 A579 L621	A578-A582 PolarHBondContact O-N 3.42Å; A579-A582 PolarHBondContact O-N 2.96Å; A582-L621 HydrophobicContact CB-CD1 3.64Å
583	A	89.9	Confident	91.6	Very high	4 Å²	4	52.3 Å²	52.3	3%	0.033	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	8.6	177.4	0	0	0	0	0	114.6	A579 A580 Q581 A585 R614 I617 A618 L621	A579-A583 WeakPolarHBondContact O-CB 3.25Å; A579-A583 PolarHBondContact O-N 3.4Å; A579-A583 VanDerWaalsContact O-N 3.08Å; A580-A583 CarbonylContact O-C 3.57Å; A580-A583 PolarHBondContact O-N 3.48Å; Q581-A583 PolarHBondContact O-N 3.33Å; Q581-A583 VanDerWaalsContact O-N 3.16Å; A583-A585 PolarHBondContact O-N 3.47Å; A583-R614 WeakPolarHBondContact CB-O 3.31Å; A583-I617 HydrophobicContact CB-CB 4.06Å; A583-I617 HydrophobicContact CB-CG2 3.78Å; A583-A618 HydrophobicContact CB-CB 3.79Å; A583-L621 HydrophobicContact CB-CD1 4.33Å
584	C	89.8	Confident	91.5	Very high	20 Å²	20	54 Å²	54	14%	0.135	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	53	30	-171.9	-64.3	0	0	0	0	114.7	A580 Q581 R614 C641	A580-C584 PolarHBondContact O-N 2.98Å; Q581-C584 PolarHBondContact O-N 3.42Å; C584-R614 WeakPolarHBondContact O-CD 3.49Å; C584-R614 PolarHBondContact O-NH1 3.43Å; C584-C641 HydrophobicContact CB-CB 3.91Å; C584-C641 WeakPolarHBondContact CB-SG 3.3Å; C584-C641 WeakPolarHBondContact SG-CA 3.3Å; C584-C641 WeakPolarHBondContact SG-CB 3.29Å; C584-C641 CovalentContact SG-SG 2.04Å; C584-C641 PolarHBondContact SG-SG 3.06Å
585	A	91.1	Very high	91.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.302	C	S	.	.			trans	-94.3	-17.2	177	0	0	0	0	0	112.6	A580 A583 D587 F588 I589 R614	A580-A585 HydrophobicContact CB-CB 4.2Å; A580-A585 WeakPolarHBondContact O-CA 3.41Å; A580-A585 PolarHBondContact O-N 3.11Å; A583-A585 PolarHBondContact O-N 3.47Å; A585-D587 VanDerWaalsContact C-N 3.31Å; A585-D587 PolarHBondContact O-N 3.46Å; A585-F588 VanDerWaalsContact CA-CE1 3.43Å; A585-F588 HydrophobicContact CB-CD1 4.39Å; A585-F588 HydrophobicContact CB-CE1 3.56Å; A585-F588 HydrophobicContact CB-CZ 3.99Å; A585-F588 WeakPolarHBondContact O-CD1 3.46Å; A585-I589 HydrophobicContact CB-CD1 3.8Å; A585-I589 WeakPolarHBondContact O-CB 3.33Å; A585-I589 VanDerWaalsContact O-CD1 3.3Å; A585-I589 WeakPolarHBondContact O-CD1 3.26Å; A585-I589 WeakPolarHBondContact O-CG1 3.46Å; A585-I589 PolarHBondContact O-N 3.46Å; A585-I589 VanDerWaalsContact O-N 3.12Å; A585-R614 HydrophobicContact CB-CB 4.21Å
586	A	91.3	Very high	91.5	Very high	17 Å²	17	47.9 Å²	47.9	14%	0.14	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-38	-174.2	0	0	0	0	0	113.6	M577 A580 Q581 I589 G590	M577-A586 HydrophobicContact CE-CB 4.46Å; A580-A586 PolarHBondContact O-N 2.9Å; Q581-A586 HydrophobicContact CB-CB 4.43Å; Q581-A586 HydrophobicContact CG-CB 3.65Å; A586-I589 PolarHBondContact O-N 3.19Å; A586-G590 PolarHBondContact O-N 2.93Å
587	D	89.7	Confident	91.5	Very high	121 Å²	121	52.2 Å²	52.2	65%	0.647	31%	0.308	S	S	*	.	H	α-helix	trans	-63.9	-56.3	-175.8	-56	-31.1	0	0	0	111.5	A585 I589 G590 E591	A585-D587 VanDerWaalsContact C-N 3.31Å; A585-D587 PolarHBondContact O-N 3.46Å; D587-I589 VanDerWaalsContact C-N 3.28Å; D587-I589 PolarHBondContact O-N 3.46Å; D587-G590 PolarHBondContact O-N 2.94Å; D587-G590 VanDerWaalsContact O-N 3.07Å; D587-E591 PolarHBondContact O-N 3.22Å; D587-E591 VanDerWaalsContact O-N 3.13Å
588	F	90.8	Very high	91.6	Very high	16 Å²	16	50.4 Å²	50.4	7%	0.07	30%	0.3	C	S	.	.	H	α-helix	trans	-69.5	-28.1	-179.6	81.2	-101.6	0	0	0	112.1	A585 G590 E591 M592 L607 Q611 R614	A585-F588 VanDerWaalsContact CA-CE1 3.43Å; A585-F588 HydrophobicContact CB-CD1 4.39Å; A585-F588 HydrophobicContact CB-CE1 3.56Å; A585-F588 HydrophobicContact CB-CZ 3.99Å; A585-F588 WeakPolarHBondContact O-CD1 3.46Å; F588-G590 VanDerWaalsContact C-N 3.33Å; F588-E591 PolarHBondContact O-N 3.38Å; F588-M592 HydrophobicContact CD2-CE 3.68Å; F588-M592 HydrophobicContact CE2-CE 3.78Å; F588-M592 WeakPolarHBondContact O-CG 3.29Å; F588-M592 PolarHBondContact O-N 3.15Å; F588-L607 HydrophobicContact CE2-CD2 4.36Å; F588-Q611 HydrophobicContact CD1-CG 4.03Å; F588-Q611 HydrophobicContact CD2-CG 4.12Å; F588-Q611 HydrophobicContact CE1-CB 4.13Å; F588-Q611 HydrophobicContact CE1-CG 4.11Å; F588-Q611 HydrophobicContact CE2-CB 4.13Å; F588-Q611 HydrophobicContact CE2-CG 4.24Å; F588-Q611 HydrophobicContact CG-CG 4.04Å; F588-Q611 HydrophobicContact CZ-CB 3.93Å; F588-Q611 HydrophobicContact CZ-CG 4.23Å; F588-R614 HydrophobicContact CE1-CB 4.31Å
589	I	93.3	Very high	91.6	Very high	2 Å²	2	53 Å²	53	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-66.3	-40.2	172.3	-69.2	167.9	0	0	0	109.6	V560 I564 A580 A585 A586 D587 E591 M592 G595 I596 L615	V560-I589 HydrophobicContact CG1-CD1 3.66Å; V560-I589 HydrophobicContact CG1-CG1 3.97Å; V560-I589 HydrophobicContact CG1-CG2 4.44Å; I564-I589 HydrophobicContact CD1-CD1 4.48Å; A580-I589 HydrophobicContact CB-CD1 3.93Å; A585-I589 HydrophobicContact CB-CD1 3.8Å; A585-I589 WeakPolarHBondContact O-CB 3.33Å; A585-I589 VanDerWaalsContact O-CD1 3.3Å; A585-I589 WeakPolarHBondContact O-CD1 3.26Å; A585-I589 WeakPolarHBondContact O-CG1 3.46Å; A585-I589 PolarHBondContact O-N 3.46Å; A585-I589 VanDerWaalsContact O-N 3.12Å; A586-I589 PolarHBondContact O-N 3.19Å; D587-I589 VanDerWaalsContact C-N 3.28Å; D587-I589 PolarHBondContact O-N 3.46Å; I589-E591 VanDerWaalsContact C-N 3.28Å; I589-E591 PolarHBondContact O-N 3.49Å; I589-M592 WeakPolarHBondContact O-CB 3.25Å; I589-M592 PolarHBondContact O-N 3.01Å; I589-M592 VanDerWaalsContact O-N 3.17Å; I589-G595 WeakPolarHBondContact O-CA 3.32Å; I589-I596 HydrophobicContact CG2-CG2 3.81Å; I589-L615 HydrophobicContact CD1-CD1 4.46Å
590	G	91.3	Very high	91.5	Very high	63 Å²	63	52.7 Å²	52.7	65%	0.649	30%	0.3	S	S	*	.	H	α-helix	trans	-65	-28.5	176.5	0	0	0	0	0	113.9	A586 D587 F588 M592	A586-G590 PolarHBondContact O-N 2.93Å; D587-G590 PolarHBondContact O-N 2.94Å; D587-G590 VanDerWaalsContact O-N 3.07Å; F588-G590 VanDerWaalsContact C-N 3.33Å; G590-M592 VanDerWaalsContact C-N 3.3Å
591	E	91.6	Very high	91.2	Very high	166 Å²	166	53.7 Å²	53.7	78%	0.776	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-16.8	174.6	-68.1	176.6	175.7	0	0	113.5	D587 F588 I589	D587-E591 PolarHBondContact O-N 3.22Å; D587-E591 VanDerWaalsContact O-N 3.13Å; F588-E591 PolarHBondContact O-N 3.38Å; I589-E591 VanDerWaalsContact C-N 3.28Å; I589-E591 PolarHBondContact O-N 3.49Å
592	M	92.6	Very high	90.8	Very high	38 Å²	38	55.4 Å²	55.4	19%	0.187	32%	0.319	C	S	.	.	S	Bend	trans	-76.5	142.1	178.5	-66.1	173.6	170.8	0	0	111.7	V560 F588 I589 G590 N594 G595 T598 L607	V560-M592 HydrophobicContact CG2-SD 4.04Å; F588-M592 HydrophobicContact CD2-CE 3.68Å; F588-M592 HydrophobicContact CE2-CE 3.78Å; F588-M592 WeakPolarHBondContact O-CG 3.29Å; F588-M592 PolarHBondContact O-N 3.15Å; I589-M592 WeakPolarHBondContact O-CB 3.25Å; I589-M592 PolarHBondContact O-N 3.01Å; I589-M592 VanDerWaalsContact O-N 3.17Å; G590-M592 VanDerWaalsContact C-N 3.3Å; M592-N594 PolarHBondContact O-N 3.04Å; M592-G595 PolarHBondContact O-N 3.36Å; M592-T598 HydrophobicContact CB-CG2 4.09Å; M592-T598 VanDerWaalsContact CB-OG1 3.28Å; M592-T598 WeakPolarHBondContact CB-OG1 2.94Å; M592-T598 HydrophobicContact CG-CG2 4.23Å; M592-T598 HydrophobicContact SD-CG2 3.82Å; M592-L607 HydrophobicContact CE-CD2 3.44Å; M592-L607 VanDerWaalsContact CE-CD2 3.44Å
593	T	87.7	Confident	90.5	Very high	142 Å²	142	61.9 Å²	61.9	87%	0.871	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-35.6	-177.2	-41.9	0	0	0	0	114.1
594	N	91.7	Very high	90.1	Very high	106 Å²	106	61.7 Å²	61.7	57%	0.567	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	14.6	-177.9	-67.3	-16	0	0	0	113.2	M592 I596 N597 T598	M592-N594 PolarHBondContact O-N 3.04Å; N594-I596 PolarHBondContact O-N 2.9Å; N594-N597 HydrophobicContact CB-CB 4.34Å; N594-N597 WeakPolarHBondContact O-CB 3.38Å; N594-N597 PolarHBondContact O-N 2.95Å; N594-T598 PolarHBondContact N-OG1 3.43Å
595	G	92.6	Very high	89.8	Confident	20 Å²	20	63.5 Å²	63.5	21%	0.206	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	53.6	-129.2	-179	0	0	0	0	0	112.8	I589 M592 N597 T598	I589-G595 WeakPolarHBondContact O-CA 3.32Å; M592-G595 PolarHBondContact O-N 3.36Å; G595-N597 PolarHBondContact O-N 3.36Å; G595-T598 PolarHBondContact N-OG1 3.07Å; G595-T598 VanDerWaalsContact O-CB 3.27Å; G595-T598 WeakPolarHBondContact O-CB 3.49Å; G595-T598 PolarHBondContact O-N 3.49Å; G595-T598 VanDerWaalsContact O-N 3.11Å; G595-T598 PolarHBondContact O-OG1 3.28Å
596	I	93.6	Very high	89.4	Confident	20 Å²	20	70.1 Å²	70.1	10%	0.103	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-63.5	-17.4	177	60.4	174	0	0	0	114.5	V560 K561 D573 V576 M577 I589 N594 T598	V560-I596 WeakPolarHBondContact CB-O 3.15Å; V560-I596 PolarHBondContact N-O 2.99Å; K561-I596 HydrophobicContact CB-CB 4.27Å; K561-I596 WeakPolarHBondContact CB-O 3.45Å; K561-I596 HydrophobicContact CD-CD1 4.44Å; K561-I596 PolarHBondContact N-O 2.93Å; D573-I596 HydrophobicContact CB-CD1 3.89Å; V576-I596 HydrophobicContact CG1-CG2 4.38Å; M577-I596 HydrophobicContact CG-CG2 4.3Å; M577-I596 HydrophobicContact SD-CG2 3.31Å; M577-I596 WeakPolarHBondContact SD-CG2 3.4Å; I589-I596 HydrophobicContact CG2-CG2 3.81Å; N594-I596 PolarHBondContact O-N 2.9Å; I596-T598 VanDerWaalsContact C-N 3.29Å
597	N	94.6	Very high	89.2	Confident	91 Å²	91	70 Å²	70	49%	0.487	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-91.4	8.5	178	-61.6	-42.1	0	0	0	112.3	N594 G595	N594-N597 HydrophobicContact CB-CB 4.34Å; N594-N597 WeakPolarHBondContact O-CB 3.38Å; N594-N597 PolarHBondContact O-N 2.95Å; G595-N597 PolarHBondContact O-N 3.36Å
598	T	94.6	Very high	89.1	Confident	22 Å²	22	67 Å²	67	14%	0.135	38%	0.383	C	S	.	.			trans	-72.2	128.3	178	-54.6	0	0	0	0	110.9	S559 V560 M592 N594 G595 I596	S559-T598 CarbonylContact C-O 3.32Å; S559-T598 VanDerWaalsContact CA-O 3.25Å; S559-T598 WeakPolarHBondContact CA-O 3.46Å; V560-T598 PolarHBondContact N-O 3.38Å; M592-T598 HydrophobicContact CB-CG2 4.09Å; M592-T598 VanDerWaalsContact CB-OG1 3.28Å; M592-T598 WeakPolarHBondContact CB-OG1 2.94Å; M592-T598 HydrophobicContact CG-CG2 4.23Å; M592-T598 HydrophobicContact SD-CG2 3.82Å; N594-T598 PolarHBondContact N-OG1 3.43Å; G595-T598 PolarHBondContact N-OG1 3.07Å; G595-T598 VanDerWaalsContact O-CB 3.27Å; G595-T598 WeakPolarHBondContact O-CB 3.49Å; G595-T598 PolarHBondContact O-N 3.49Å; G595-T598 VanDerWaalsContact O-N 3.11Å; G595-T598 PolarHBondContact O-OG1 3.28Å; I596-T598 VanDerWaalsContact C-N 3.29Å
599	E	93.3	Very high	88.8	Confident	107 Å²	107	71.4 Å²	71.4	50%	0.5	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-74.2	124.2	175.1	-74.3	-69.1	157.8	0	0	111	G558 Q606	G558-E599 WeakPolarHBondContact CA-OE2 3.37Å; G558-E599 PolarHBondContact N-OE2 3.01Å; E599-Q606 PolarHBondContact O-OE1 3.5Å; E599-Q606 VanDerWaalsContact O-OE1 3.14Å
600	I	90.4	Very high	88.5	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.005	42%	0.421	C	S	.	.			trans	-96.9	-2.3	-173.5	60	164.9	0	0	0	114.3	L555 G558 V560 N563 G604 G605 Q606 L607 L615	L555-I600 HydrophobicContact CB-CD1 3.86Å; L555-I600 HydrophobicContact CD1-CD1 3.8Å; L555-I600 HydrophobicContact CG-CD1 4.37Å; G558-I600 WeakPolarHBondContact O-CG1 3.39Å; G558-I600 PolarHBondContact O-N 3.37Å; G558-I600 VanDerWaalsContact O-N 3.13Å; V560-I600 HydrophobicContact CG2-CG2 3.6Å; N563-I600 HydrophobicContact CB-CD1 4.34Å; N563-I600 VanDerWaalsContact ND2-CD1 3.33Å; N563-I600 WeakPolarHBondContact ND2-CD1 3.32Å; I600-G604 CarbonylContact O-C 3.21Å; I600-G604 VanDerWaalsContact O-C 3.32Å; I600-G604 VanDerWaalsContact O-CA 3.28Å; I600-G604 WeakPolarHBondContact O-CA 3.34Å; I600-G605 PolarHBondContact O-N 2.95Å; I600-Q606 PolarHBondContact O-N 2.94Å; I600-L607 HydrophobicContact CB-CD1 4.16Å; I600-L607 HydrophobicContact CB-CG 4.33Å; I600-L607 HydrophobicContact CD1-CD1 4.24Å; I600-L607 HydrophobicContact CG2-CD1 3.93Å; I600-L607 HydrophobicContact CG2-CD2 4.33Å; I600-L607 HydrophobicContact CG2-CG 4.22Å; I600-L615 HydrophobicContact CD1-CD2 4.1Å
601	G	86.3	Confident	88.4	Confident	21 Å²	21	72 Å²	72	22%	0.216	40%	0.403	C	S	.	.			trans	71.1	-179.2	179.3	0	0	0	0	0	114.8	K603 G604	G601-K603 PolarHBondContact O-N 3.47Å; G601-G604 PolarHBondContact O-N 3.31Å; G601-G604 VanDerWaalsContact O-N 3.1Å
602	E	84.3	Confident	88.4	Confident	164 Å²	164	66.3 Å²	66.3	77%	0.766	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-58.5	126.3	-177.9	-67.9	-170.5	171.2	0	0	111.9	S557 G604 G605	S557-E602 WeakPolarHBondContact OG-CA 3.32Å; E602-G604 PolarHBondContact O-N 3.3Å; E602-G605 PolarHBondContact O-N 3.41Å
603	K	81.2	Confident	88.2	Confident	158 Å²	158	64.9 Å²	64.9	69%	0.687	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	52.4	28	-177.9	-59.8	-177.4	178.7	-178.8	0	113.7	L555 G601 G605 K612	L555-K603 WeakPolarHBondContact O-CA 3.47Å; G601-K603 PolarHBondContact O-N 3.47Å; K603-G605 VanDerWaalsContact C-N 3.3Å; K603-G605 PolarHBondContact O-N 3.26Å; K603-K612 PolarHBondContact O-NZ 3.41Å
604	G	81.4	Confident	88.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	62.7	33.9	-175.1	0	0	0	0	0	112.9	I600 G601 E602 Q606 L607 K612	I600-G604 CarbonylContact O-C 3.21Å; I600-G604 VanDerWaalsContact O-C 3.32Å; I600-G604 VanDerWaalsContact O-CA 3.28Å; I600-G604 WeakPolarHBondContact O-CA 3.34Å; G601-G604 PolarHBondContact O-N 3.31Å; G601-G604 VanDerWaalsContact O-N 3.1Å; E602-G604 PolarHBondContact O-N 3.3Å; G604-Q606 PolarHBondContact O-N 2.89Å; G604-L607 PolarHBondContact O-N 3.41Å; G604-K612 WeakPolarHBondContact O-CE 3.35Å; G604-K612 PolarHBondContact O-NZ 3.21Å
605	G	82.6	Confident	88.5	Confident	59 Å²	59	55.2 Å²	55.2	61%	0.608	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-19	-175	0	0	0	0	0	115.3	I600 E602 K603	I600-G605 PolarHBondContact O-N 2.95Å; E602-G605 PolarHBondContact O-N 3.41Å; K603-G605 VanDerWaalsContact C-N 3.3Å; K603-G605 PolarHBondContact O-N 3.26Å
606	Q	82.4	Confident	88.5	Confident	139 Å²	139	54.7 Å²	54.7	65%	0.65	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-7.2	178.1	-58.3	-177.4	8.6	0	0	114.1	E599 I600 G604	E599-Q606 PolarHBondContact O-OE1 3.5Å; E599-Q606 VanDerWaalsContact O-OE1 3.14Å; I600-Q606 PolarHBondContact O-N 2.94Å; G604-Q606 PolarHBondContact O-N 2.89Å
607	L	87.4	Confident	88.4	Confident	13 Å²	13	53.9 Å²	53.9	7%	0.068	30%	0.297	C	S	.	.	S	Bend	trans	-102.5	141.3	-176.7	-61.1	179.3	0	0	0	111.9	L555 F588 M592 I600 G604 Q611 K612 L615	L555-L607 HydrophobicContact CD1-CD1 3.77Å; F588-L607 HydrophobicContact CE2-CD2 4.36Å; M592-L607 HydrophobicContact CE-CD2 3.44Å; M592-L607 VanDerWaalsContact CE-CD2 3.44Å; I600-L607 HydrophobicContact CB-CD1 4.16Å; I600-L607 HydrophobicContact CB-CG 4.33Å; I600-L607 HydrophobicContact CD1-CD1 4.24Å; I600-L607 HydrophobicContact CG2-CD1 3.93Å; I600-L607 HydrophobicContact CG2-CD2 4.33Å; I600-L607 HydrophobicContact CG2-CG 4.22Å; G604-L607 PolarHBondContact O-N 3.41Å; L607-Q611 HydrophobicContact CB-CB 4.18Å; L607-Q611 HydrophobicContact CD2-CB 4.47Å; L607-K612 HydrophobicContact CB-CG 3.77Å; L607-K612 HydrophobicContact CD1-CG 4.42Å; L607-K612 WeakPolarHBondContact O-CE 3.28Å; L607-L615 HydrophobicContact CD1-CD2 4.09Å
608	A	88.4	Confident	88.4	Confident	58 Å²	58	49.5 Å²	49.5	48%	0.479	27%	0.274	S	S	.	.			trans	-63.8	153.5	167.5	0	0	0	0	0	110.8	G610 Q611 K612	A608-G610 VanDerWaalsContact C-N 3.28Å; A608-G610 PolarHBondContact O-N 3.36Å; A608-Q611 HydrophobicContact CB-CG 4.26Å; A608-Q611 WeakPolarHBondContact O-CB 3.28Å; A608-Q611 PolarHBondContact O-N 3.4Å; A608-K612 WeakPolarHBondContact O-CG 3.4Å; A608-K612 PolarHBondContact O-N 3.14Å
609	V	84.4	Confident	88.4	Confident	109 Å²	109	50.2 Å²	50.2	66%	0.661	27%	0.274	S	S	*	.	H	α-helix	trans	-53.8	-43.9	-177.2	178.1	0	0	0	0	112.2	K612 Q613	V609-K612 WeakPolarHBondContact O-CB 3.42Å; V609-K612 PolarHBondContact O-N 2.64Å; V609-Q613 PolarHBondContact O-N 3.01Å; V609-Q613 VanDerWaalsContact O-N 3.15Å
610	G	85.7	Confident	88.5	Confident	22 Å²	22	45.2 Å²	45.2	23%	0.227	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-38.3	176.7	0	0	0	0	0	113.7	A608 K612 Q613 R614	A608-G610 VanDerWaalsContact C-N 3.28Å; A608-G610 PolarHBondContact O-N 3.36Å; G610-K612 VanDerWaalsContact C-N 3.32Å; G610-K612 PolarHBondContact O-N 3.42Å; G610-Q613 PolarHBondContact O-N 2.86Å; G610-R614 WeakPolarHBondContact O-CG 3.27Å; G610-R614 PolarHBondContact O-N 3.03Å
611	Q	89.9	Confident	88.6	Confident	56 Å²	56	45.5 Å²	45.5	26%	0.262	25%	0.253	S	S	.	.	H	α-helix	trans	-63.9	-38.5	174.7	-68.4	171.7	-27.9	0	0	111.4	F588 L607 A608 Q613 R614 L615	F588-Q611 HydrophobicContact CD1-CG 4.03Å; F588-Q611 HydrophobicContact CD2-CG 4.12Å; F588-Q611 HydrophobicContact CE1-CB 4.13Å; F588-Q611 HydrophobicContact CE1-CG 4.11Å; F588-Q611 HydrophobicContact CE2-CB 4.13Å; F588-Q611 HydrophobicContact CE2-CG 4.24Å; F588-Q611 HydrophobicContact CG-CG 4.04Å; F588-Q611 HydrophobicContact CZ-CB 3.93Å; F588-Q611 HydrophobicContact CZ-CG 4.23Å; L607-Q611 HydrophobicContact CB-CB 4.18Å; L607-Q611 HydrophobicContact CD2-CB 4.47Å; A608-Q611 HydrophobicContact CB-CG 4.26Å; A608-Q611 WeakPolarHBondContact O-CB 3.28Å; A608-Q611 PolarHBondContact O-N 3.4Å; Q611-Q613 VanDerWaalsContact C-N 3.35Å; Q611-Q613 PolarHBondContact O-N 3.48Å; Q611-R614 PolarHBondContact O-N 3.45Å; Q611-L615 WeakPolarHBondContact O-CB 3.13Å; Q611-L615 PolarHBondContact O-N 3.08Å
612	K	91.2	Very high	89	Confident	46 Å²	46	45.4 Å²	45.4	20%	0.2	25%	0.248	C	C	.	.	H	α-helix	trans	-61.8	-42.6	175.1	-61.4	-173.8	-171.1	-159.3	0	112	P553 L555 K603 G604 L607 A608 V609 G610 L615 A616	P553-K612 HydrophobicContact CG-CB 4.39Å; L555-K612 HydrophobicContact CD1-CB 4Å; L555-K612 HydrophobicContact CD1-CD 4.44Å; L555-K612 HydrophobicContact CD1-CG 3.84Å; K603-K612 PolarHBondContact O-NZ 3.41Å; G604-K612 WeakPolarHBondContact O-CE 3.35Å; G604-K612 PolarHBondContact O-NZ 3.21Å; L607-K612 HydrophobicContact CB-CG 3.77Å; L607-K612 HydrophobicContact CD1-CG 4.42Å; L607-K612 WeakPolarHBondContact O-CE 3.28Å; A608-K612 WeakPolarHBondContact O-CG 3.4Å; A608-K612 PolarHBondContact O-N 3.14Å; V609-K612 WeakPolarHBondContact O-CB 3.42Å; V609-K612 PolarHBondContact O-N 2.64Å; G610-K612 VanDerWaalsContact C-N 3.32Å; G610-K612 PolarHBondContact O-N 3.42Å; K612-L615 PolarHBondContact O-N 3.24Å; K612-A616 WeakPolarHBondContact O-CB 3.22Å; K612-A616 PolarHBondContact O-N 3.43Å
613	Q	89.4	Confident	89.4	Confident	9 Å²	9	39.2 Å²	39.2	4%	0.042	22%	0.218	C	C	.	.	H	α-helix	trans	-64.3	-47.9	176.4	-77.8	-170.7	-9.6	0	0	112.1	Q551 P553 V609 G610 Q611 L615 A616 I617 A633 A636	Q551-Q613 PolarHBondContact O-NE2 3.3Å; Q551-Q613 VanDerWaalsContact O-NE2 3.08Å; P553-Q613 HydrophobicContact CG-CG 3.96Å; V609-Q613 PolarHBondContact O-N 3.01Å; V609-Q613 VanDerWaalsContact O-N 3.15Å; G610-Q613 PolarHBondContact O-N 2.86Å; Q611-Q613 VanDerWaalsContact C-N 3.35Å; Q611-Q613 PolarHBondContact O-N 3.48Å; Q613-L615 VanDerWaalsContact C-N 3.28Å; Q613-L615 PolarHBondContact O-N 3.11Å; Q613-A616 WeakPolarHBondContact O-CB 3.07Å; Q613-A616 PolarHBondContact O-N 2.86Å; Q613-A616 VanDerWaalsContact O-N 3.09Å; Q613-I617 WeakPolarHBondContact O-CG1 3.49Å; Q613-I617 PolarHBondContact O-N 3.44Å; Q613-A633 PolarHBondContact OE1-O 3.49Å; Q613-A636 HydrophobicContact CB-CB 4.49Å; Q613-A636 VanDerWaalsContact OE1-N 3.15Å
614	R	90.9	Very high	89.9	Confident	45 Å²	45	35.7 Å²	35.7	17%	0.17	21%	0.206	C	C	.	.	H	α-helix	trans	-58.9	-40	176.2	-66	-179.4	-159.8	-173.3	0.3	112.1	A583 C584 A585 F588 G610 Q611 I617 A618 L637 D638	A583-R614 WeakPolarHBondContact CB-O 3.31Å; C584-R614 WeakPolarHBondContact O-CD 3.49Å; C584-R614 PolarHBondContact O-NH1 3.43Å; A585-R614 HydrophobicContact CB-CB 4.21Å; F588-R614 HydrophobicContact CE1-CB 4.31Å; G610-R614 WeakPolarHBondContact O-CG 3.27Å; G610-R614 PolarHBondContact O-N 3.03Å; Q611-R614 PolarHBondContact O-N 3.45Å; R614-I617 PolarHBondContact O-N 3.03Å; R614-A618 PolarHBondContact O-N 3.29Å; R614-L637 HydrophobicContact CG-CD2 3.98Å; R614-D638 IonicContact CZ-OD1 2.85Å; R614-D638 IonicContact CZ-OD2 2.61Å; R614-D638 IonicContact NH2-OD1 3.64Å; R614-D638 PolarHBondContact NH2-OD1 3.41Å; R614-D638 IonicContact NH2-OD2 3.69Å; R614-D638 PolarHBondContact NH2-OD2 3.02Å
615	L	93.3	Very high	90.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66.6	-37.4	175.8	-164.9	69.1	0	0	0	112.6	L555 V560 N563 I564 I589 I600 L607 Q611 K612 Q613 I617 A618 R619	L555-L615 HydrophobicContact CD1-CD2 3.82Å; L555-L615 HydrophobicContact CD2-CD2 3.98Å; L555-L615 HydrophobicContact CD2-CG 4.45Å; V560-L615 HydrophobicContact CG1-CD1 3.75Å; N563-L615 HydrophobicContact CB-CD2 4.05Å; I564-L615 HydrophobicContact CD1-CD1 3.62Å; I564-L615 HydrophobicContact CG1-CD1 3.5Å; I564-L615 VanDerWaalsContact CG1-CD1 3.5Å; I564-L615 HydrophobicContact CG1-CG 4.24Å; I589-L615 HydrophobicContact CD1-CD1 4.46Å; I600-L615 HydrophobicContact CD1-CD2 4.1Å; L607-L615 HydrophobicContact CD1-CD2 4.09Å; Q611-L615 WeakPolarHBondContact O-CB 3.13Å; Q611-L615 PolarHBondContact O-N 3.08Å; K612-L615 PolarHBondContact O-N 3.24Å; Q613-L615 VanDerWaalsContact C-N 3.28Å; Q613-L615 PolarHBondContact O-N 3.11Å; L615-I617 VanDerWaalsContact C-N 3.35Å; L615-A618 PolarHBondContact O-N 3Å; L615-R619 WeakPolarHBondContact O-CB 3.42Å; L615-R619 PolarHBondContact O-N 3.36Å
616	A	93.1	Very high	91	Very high	8 Å²	8	34.9 Å²	34.9	7%	0.066	19%	0.185	C	C	.	.	H	α-helix	trans	-68.1	-34.8	174.8	0	0	0	0	0	112.6	V549 P553 K612 Q613 R619 A620	V549-A616 HydrophobicContact CG1-CB 4.1Å; P553-A616 HydrophobicContact CB-CB 3.3Å; P553-A616 HydrophobicContact CG-CB 3.83Å; K612-A616 WeakPolarHBondContact O-CB 3.22Å; K612-A616 PolarHBondContact O-N 3.43Å; Q613-A616 WeakPolarHBondContact O-CB 3.07Å; Q613-A616 PolarHBondContact O-N 2.86Å; Q613-A616 VanDerWaalsContact O-N 3.09Å; A616-R619 WeakPolarHBondContact O-CB 3.44Å; A616-R619 PolarHBondContact O-N 2.9Å; A616-A620 PolarHBondContact O-N 3.48Å
617	I	92.7	Very high	91.6	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.015	15%	0.154	C	C	.	.	H	α-helix	trans	-65.3	-48.3	171.1	-65.1	161.7	0	0	0	109.5	V549 A583 Q613 R614 L615 R619 A620 L621 L637 L645	V549-I617 HydrophobicContact CG1-CG1 3.91Å; V549-I617 HydrophobicContact CG2-CG1 4.21Å; A583-I617 HydrophobicContact CB-CB 4.06Å; A583-I617 HydrophobicContact CB-CG2 3.78Å; Q613-I617 WeakPolarHBondContact O-CG1 3.49Å; Q613-I617 PolarHBondContact O-N 3.44Å; R614-I617 PolarHBondContact O-N 3.03Å; L615-I617 VanDerWaalsContact C-N 3.35Å; I617-R619 VanDerWaalsContact C-N 3.27Å; I617-R619 PolarHBondContact O-N 3.44Å; I617-A620 CarbonylContact O-C 3.55Å; I617-A620 WeakPolarHBondContact O-CA 3.41Å; I617-A620 WeakPolarHBondContact O-CB 3.48Å; I617-A620 PolarHBondContact O-N 3.25Å; I617-L621 HydrophobicContact CG2-CD1 3.9Å; I617-L621 HydrophobicContact CG2-CG 3.97Å; I617-L621 WeakPolarHBondContact O-CG 3.25Å; I617-L621 PolarHBondContact O-N 2.83Å; I617-L637 HydrophobicContact CD1-CD1 3.69Å; I617-L637 HydrophobicContact CD1-CD2 3.67Å; I617-L637 HydrophobicContact CD1-CG 3.96Å; I617-L645 HydrophobicContact CG2-CD1 4.36Å
618	A	93.9	Very high	92	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-55.4	-43	175.1	0	0	0	0	0	112	I564 A583 R614 L615 A620 L621 V622	I564-A618 HydrophobicContact CD1-CB 4.13Å; I564-A618 HydrophobicContact CG1-CB 4.06Å; I564-A618 HydrophobicContact CG2-CB 4.42Å; A583-A618 HydrophobicContact CB-CB 3.79Å; R614-A618 PolarHBondContact O-N 3.29Å; L615-A618 PolarHBondContact O-N 3Å; A618-A620 VanDerWaalsContact C-N 3.26Å; A618-A620 PolarHBondContact O-N 2.92Å; A618-L621 PolarHBondContact O-N 3.47Å; A618-V622 PolarHBondContact O-N 2.74Å
619	R	94.9	Very high	92.3	Very high	36 Å²	36	25 Å²	25	14%	0.136	13%	0.129	C	C	.	.	H	α-helix	trans	-57.2	-38.3	171.9	178	-168.4	-66.8	169.9	-2.4	111.9	V554 L555 N563 L615 A616 I617 V622 R623	V554-R619 PolarHBondContact O-NH1 2.92Å; L555-R619 VanDerWaalsContact CD2-NH2 3.27Å; N563-R619 PolarHBondContact O-NE 3.17Å; N563-R619 PolarHBondContact O-NH2 3.37Å; N563-R619 PolarHBondContact OD1-NH2 3.01Å; L615-R619 WeakPolarHBondContact O-CB 3.42Å; L615-R619 PolarHBondContact O-N 3.36Å; A616-R619 WeakPolarHBondContact O-CB 3.44Å; A616-R619 PolarHBondContact O-N 2.9Å; I617-R619 VanDerWaalsContact C-N 3.27Å; I617-R619 PolarHBondContact O-N 3.44Å; R619-V622 WeakPolarHBondContact O-CG1 3.4Å; R619-R623 PolarHBondContact O-NH1 2.66Å
620	A	93.8	Very high	92.7	Very high	2 Å²	2	20 Å²	20	2%	0.017	10%	0.098	C	C	.	.	H	α-helix	trans	-70.9	-47.1	175.6	0	0	0	0	0	112.2	V547 V549 A616 I617 A618 V622 R623 P625 L628	V547-A620 HydrophobicContact CB-CB 4.46Å; V547-A620 HydrophobicContact CG1-CB 3.49Å; V547-A620 VanDerWaalsContact CG1-CB 3.49Å; V549-A620 HydrophobicContact CG2-CB 3.63Å; A616-A620 PolarHBondContact O-N 3.48Å; I617-A620 CarbonylContact O-C 3.55Å; I617-A620 WeakPolarHBondContact O-CA 3.41Å; I617-A620 WeakPolarHBondContact O-CB 3.48Å; I617-A620 PolarHBondContact O-N 3.25Å; A618-A620 VanDerWaalsContact C-N 3.26Å; A618-A620 PolarHBondContact O-N 2.92Å; A620-V622 PolarHBondContact O-N 3.42Å; A620-R623 PolarHBondContact O-N 2.91Å; A620-P625 WeakPolarHBondContact O-CD 3.43Å; A620-L628 HydrophobicContact CB-CD1 3.92Å
621	L	93.3	Very high	92.9	Very high	7 Å²	7	19.6 Å²	19.6	4%	0.037	9%	0.091	C	C	.	.	H	α-helix	trans	-67.8	-33.7	-173.8	-60.2	-172.7	0	0	0	113.4	A579 A582 A583 I617 A618 R623 N624 L628 L645 W648	A579-L621 HydrophobicContact CB-CB 4.38Å; A582-L621 HydrophobicContact CB-CD1 3.64Å; A583-L621 HydrophobicContact CB-CD1 4.33Å; I617-L621 HydrophobicContact CG2-CD1 3.9Å; I617-L621 HydrophobicContact CG2-CG 3.97Å; I617-L621 WeakPolarHBondContact O-CG 3.25Å; I617-L621 PolarHBondContact O-N 2.83Å; A618-L621 PolarHBondContact O-N 3.47Å; L621-R623 PolarHBondContact O-N 3.36Å; L621-R623 VanDerWaalsContact O-N 3.09Å; L621-N624 PolarHBondContact O-N 3.41Å; L621-L628 HydrophobicContact CD2-CD2 4.09Å; L621-L645 HydrophobicContact CD1-CD1 4.15Å; L621-L645 HydrophobicContact CD2-CD1 3.91Å; L621-W648 HydrophobicContact CB-CZ2 4.49Å; L621-W648 HydrophobicContact CD2-CD2 3.71Å; L621-W648 HydrophobicContact CD2-CE3 3.66Å; L621-W648 HydrophobicContact CD2-CH2 3.64Å; L621-W648 HydrophobicContact CD2-CZ2 3.68Å; L621-W648 HydrophobicContact CD2-CZ3 3.62Å
622	V	94.5	Very high	92.4	Very high	19 Å²	19	18.9 Å²	18.9	12%	0.115	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.9	179.7	74	0	0	0	0	112.9	I564 L568 Q575 A579 A618 R619 A620 N624	I564-V622 HydrophobicContact CG2-CB 4.01Å; I564-V622 HydrophobicContact CG2-CG1 3.92Å; I564-V622 HydrophobicContact CG2-CG2 4.33Å; I564-V622 WeakPolarHBondContact O-CG1 3.28Å; L568-V622 HydrophobicContact CD1-CG1 3.79Å; L568-V622 HydrophobicContact CD1-CG2 4.41Å; Q575-V622 HydrophobicContact CB-CG2 4.36Å; A579-V622 HydrophobicContact CB-CB 3.63Å; A579-V622 HydrophobicContact CB-CG2 4.15Å; A618-V622 PolarHBondContact O-N 2.74Å; R619-V622 WeakPolarHBondContact O-CG1 3.4Å; A620-V622 PolarHBondContact O-N 3.42Å; V622-N624 VanDerWaalsContact C-N 3.29Å
623	R	92.6	Very high	91.4	Very high	35 Å²	35	16.7 Å²	16.7	13%	0.132	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-15.8	176.4	-68.1	162.7	167.8	60.5	2	113.4	R544 V547 Y566 L568 R619 A620 L621	R544-R623 HydrophobicContact CG-CB 4.25Å; V547-R623 HydrophobicContact CG2-CB 4.46Å; Y566-R623 PolarHBondContact O-NH2 3.23Å; L568-R623 HydrophobicContact CD1-CG 4.1Å; L568-R623 HydrophobicContact CD2-CG 4.26Å; L568-R623 HydrophobicContact CG-CG 4.44Å; R619-R623 PolarHBondContact O-NH1 2.66Å; A620-R623 PolarHBondContact O-N 2.91Å; L621-R623 PolarHBondContact O-N 3.36Å; L621-R623 VanDerWaalsContact O-N 3.09Å
624	N	91.3	Very high	90.2	Very high	84 Å²	84	16.9 Å²	16.9	45%	0.449	8%	0.08	S	C	.	.			trans	52.1	57.9	-170.5	-169.4	26.6	0	0	0	113.2	L621 V622 R654	L621-N624 PolarHBondContact O-N 3.41Å; V622-N624 VanDerWaalsContact C-N 3.29Å; N624-R654 VanDerWaalsContact OD1-CZ 3.32Å; N624-R654 PolarHBondContact OD1-NE 2.81Å; N624-R654 PolarHBondContact OD1-NH2 2.74Å
625	P	94.3	Very high	89.1	Confident	1 Å²	1	16.5 Å²	16.5	1%	0.006	8%	0.084	C	C	.	.			trans	-71.4	152.1	-174	29.7	-35.3	0	0	0	113.1	Q545 V547 A620 L628 W648 R654	Q545-P625 VanDerWaalsContact O-CB 3.26Å; Q545-P625 WeakPolarHBondContact O-CB 3.41Å; V547-P625 HydrophobicContact CB-CB 4.08Å; V547-P625 HydrophobicContact CB-CG 4.17Å; V547-P625 HydrophobicContact CG2-CB 3.67Å; V547-P625 HydrophobicContact CG2-CG 4.09Å; A620-P625 WeakPolarHBondContact O-CD 3.43Å; P625-L628 HydrophobicContact CG-CD1 4.41Å; P625-W648 HydrophobicContact CG-CH2 4Å; P625-R654 WeakPolarHBondContact O-CD 3.34Å
626	R	94.3	Very high	87.6	Confident	41 Å²	41	17.9 Å²	17.9	16%	0.155	10%	0.095	C	C	.	.	S	Bend	trans	-82.7	-30.8	171.2	-71.4	-68.7	176.8	-174.7	0.9	113.4	W463 L464 Q545 G652 T655	W463-R626 VanDerWaalsContact CE3-NH2 3.35Å; L464-R626 HydrophobicContact CB-CG 4.29Å; L464-R626 HydrophobicContact CD2-CB 3.92Å; L464-R626 HydrophobicContact CD2-CG 4.16Å; L464-R626 WeakPolarHBondContact O-CD 3.43Å; L464-R626 PolarHBondContact O-NE 3.19Å; Q545-R626 PolarHBondContact O-N 2.79Å; R626-G652 PolarHBondContact NH1-O 3.38Å; R626-T655 PolarHBondContact O-N 3.43Å
627	V	95.3	Very high	86.6	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	113.9	177.7	-174.2	0	0	0	0	108.3	V468 L529 Q545 V546 V547 T655	V468-V627 HydrophobicContact CG2-CG1 4.29Å; V468-V627 HydrophobicContact CG2-CG2 3.95Å; L529-V627 HydrophobicContact CD1-CG2 4.17Å; Q545-V627 PolarHBondContact O-N 3.03Å; V546-V627 WeakPolarHBondContact CA-O 3.34Å; V546-V627 HydrophobicContact CB-CB 4.44Å; V546-V627 HydrophobicContact CG1-CB 4.28Å; V546-V627 HydrophobicContact CG1-CG1 4.26Å; V546-V627 HydrophobicContact CG2-CB 4.08Å; V546-V627 HydrophobicContact CG2-CG2 4.28Å; V547-V627 PolarHBondContact N-O 3.44Å; V627-T655 WeakPolarHBondContact CA-O 3.22Å
628	L	95	Very high	85.8	Confident	2 Å²	2	21.8 Å²	21.8	1%	0.01	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125.6	177.1	-177.6	62.9	0	0	0	110.2	V549 A620 L621 P625 L630 L645 W648 T655 M656 L657	V549-L628 HydrophobicContact CG2-CD1 4.38Å; A620-L628 HydrophobicContact CB-CD1 3.92Å; L621-L628 HydrophobicContact CD2-CD2 4.09Å; P625-L628 HydrophobicContact CG-CD1 4.41Å; L628-L630 HydrophobicContact CD1-CD2 4.3Å; L628-L630 HydrophobicContact CD2-CD2 4.17Å; L628-L630 HydrophobicContact CG-CD2 4.05Å; L628-L630 HydrophobicContact CG-CG 4.31Å; L628-L645 HydrophobicContact CD2-CD1 4.27Å; L628-W648 HydrophobicContact CD2-CH2 4.46Å; L628-W648 HydrophobicContact CD2-CZ3 3.86Å; L628-T655 PolarHBondContact N-O 2.91Å; L628-M656 HydrophobicContact CD2-CE 3.87Å; L628-M656 CarbonylContact O-C 3.57Å; L628-M656 WeakPolarHBondContact O-CA 3.36Å; L628-L657 PolarHBondContact O-N 3.23Å
629	I	94.8	Very high	84.9	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.2	177.9	-48.9	165.8	0	0	0	108.3	A513 L516 Q517 V546 V547 L548 V549 L657	A513-I629 HydrophobicContact CB-CG2 4Å; L516-I629 HydrophobicContact CB-CD1 3.64Å; L516-I629 HydrophobicContact CD1-CD1 3.71Å; L516-I629 HydrophobicContact CD1-CG1 4.28Å; L516-I629 HydrophobicContact CG-CD1 4.31Å; Q517-I629 HydrophobicContact CG-CD1 4.37Å; V546-I629 HydrophobicContact CG1-CD1 4.05Å; V547-I629 PolarHBondContact O-N 3.29Å; L548-I629 CarbonylContact C-O 3.57Å; L548-I629 WeakPolarHBondContact CA-O 3.48Å; L548-I629 HydrophobicContact CB-CB 4.42Å; L548-I629 HydrophobicContact CD1-CB 3.72Å; L548-I629 HydrophobicContact CD1-CG2 3.48Å; L548-I629 VanDerWaalsContact CD1-CG2 3.48Å; V549-I629 PolarHBondContact N-O 3.01Å; I629-L657 CarbonylContact C-O 3.49Å; I629-L657 VanDerWaalsContact CA-O 3.3Å; I629-L657 WeakPolarHBondContact CA-O 3.15Å; I629-L657 HydrophobicContact CG1-CB 4.4Å; I629-L657 HydrophobicContact CG2-CB 4.35Å; I629-L657 HydrophobicContact CG2-CD2 4.11Å; I629-L657 HydrophobicContact CG2-CG 4.35Å
630	L	91.8	Very high	84	Confident	3 Å²	3	31.2 Å²	31.2	2%	0.016	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	108	178.3	-58.8	176.5	0	0	0	108.7	V549 L628 A633 T634 L645 M656 L657 V658 I659	V549-L630 HydrophobicContact CB-CD2 3.85Å; V549-L630 HydrophobicContact CG2-CD2 3.76Å; L628-L630 HydrophobicContact CD1-CD2 4.3Å; L628-L630 HydrophobicContact CD2-CD2 4.17Å; L628-L630 HydrophobicContact CG-CD2 4.05Å; L628-L630 HydrophobicContact CG-CG 4.31Å; L630-A633 HydrophobicContact CB-CB 4.37Å; L630-A633 HydrophobicContact CD2-CB 4.33Å; L630-T634 HydrophobicContact CD1-CG2 4.17Å; L630-L645 HydrophobicContact CD1-CD2 3.7Å; L630-M656 HydrophobicContact CD1-CE 4.28Å; L630-M656 HydrophobicContact CD1-CG 4.42Å; L630-M656 HydrophobicContact CD1-SD 3.95Å; L630-L657 PolarHBondContact N-O 3.21Å; L630-V658 HydrophobicContact CB-CG1 4.3Å; L630-V658 HydrophobicContact CD1-CG2 4.28Å; L630-I659 PolarHBondContact O-N 3.4Å
631	D	90.3	Very high	83.3	Confident	15 Å²	15	31.3 Å²	31.3	8%	0.08	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	96.1	176.4	-164.1	0.4	0	0	0	110	S510 L548 V549 G550 Q551 A633 I659	S510-D631 PolarHBondContact OG-OD2 3.01Å; L548-D631 HydrophobicContact CD1-CB 4.1Å; V549-D631 PolarHBondContact O-N 2.93Å; G550-D631 CarbonylContact C-O 3.57Å; Q551-D631 WeakPolarHBondContact CA-O 3.35Å; Q551-D631 PolarHBondContact N-O 3.43Å; D631-A633 PolarHBondContact O-N 2.96Å; D631-I659 HydrophobicContact CB-CD1 4.03Å; D631-I659 WeakPolarHBondContact OD1-CB 3.34Å; D631-I659 WeakPolarHBondContact OD1-CG2 3.41Å
632	E	79.1	Confident	82.6	Confident	40 Å²	40	32.3 Å²	32.3	19%	0.187	18%	0.179	C	C	.	.	S	Bend	trans	51.9	12.9	-174.4	-67.3	-172	-157.5	0	0	115.8	Q551 T634 S635 I659 H661	Q551-E632 HydrophobicContact CB-CB 4.31Å; Q551-E632 HydrophobicContact CG-CB 3.99Å; Q551-E632 VanDerWaalsContact NE2-CD 3.28Å; Q551-E632 PolarHBondContact NE2-OE2 3.47Å; E632-T634 PolarHBondContact O-N 3.43Å; E632-S635 VanDerWaalsContact O-CB 3.22Å; E632-S635 WeakPolarHBondContact O-CB 3.44Å; E632-S635 PolarHBondContact O-N 3.3Å; E632-S635 PolarHBondContact O-OG 3.15Å; E632-I659 PolarHBondContact N-O 3.03Å; E632-I659 VanDerWaalsContact N-O 3.12Å; E632-H661 IonicContact OE1-CD2 2.67Å; E632-H661 PolarHBondContact OE1-CD2 2.6Å; E632-H661 IonicContact OE1-CG 3.81Å; E632-H661 IonicContact OE1-NE2 2.7Å; E632-H661 PolarHBondContact OE1-NE2 3.46Å
633	A	70.1	Confident	82	Confident	1 Å²	1	37 Å²	37	1%	0.008	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-68	-20.1	-175.7	0	0	0	0	0	113.3	V549 Q613 L630 D631 S635	V549-A633 HydrophobicContact CB-CB 3.95Å; V549-A633 HydrophobicContact CG1-CB 3.51Å; Q613-A633 PolarHBondContact OE1-O 3.49Å; L630-A633 HydrophobicContact CB-CB 4.37Å; L630-A633 HydrophobicContact CD2-CB 4.33Å; D631-A633 PolarHBondContact O-N 2.96Å; A633-S635 PolarHBondContact O-N 3.36Å
634	T	64.9	Low	81.5	Confident	12 Å²	12	36.8 Å²	36.8	7%	0.074	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-73.8	-7.4	173.5	57.8	0	0	0	0	112.7	L630 E632 A636 L637 R662	L630-T634 HydrophobicContact CD1-CG2 4.17Å; E632-T634 PolarHBondContact O-N 3.43Å; T634-A636 PolarHBondContact O-N 3.09Å; T634-L637 HydrophobicContact CG2-CD1 4.3Å; T634-L637 PolarHBondContact O-N 3.06Å; T634-R662 PolarHBondContact O-NH1 3.31Å
635	S	67.6	Low	81.2	Confident	38 Å²	38	33.2 Å²	33.2	27%	0.266	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-66.8	-34.6	-177.3	61.8	0	0	0	0	113.7	E632 A633 R662	E632-S635 VanDerWaalsContact O-CB 3.22Å; E632-S635 WeakPolarHBondContact O-CB 3.44Å; E632-S635 PolarHBondContact O-N 3.3Å; E632-S635 PolarHBondContact O-OG 3.15Å; A633-S635 PolarHBondContact O-N 3.36Å; S635-R662 PolarHBondContact O-NH1 3.14Å; S635-R662 PolarHBondContact O-NH2 3.41Å
636	A	62.5	Low	80.6	Confident	28 Å²	28	37.7 Å²	37.7	23%	0.231	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-98.9	14.4	173	0	0	0	0	0	113.6	Q613 T634	Q613-A636 HydrophobicContact CB-CB 4.49Å; Q613-A636 VanDerWaalsContact OE1-N 3.15Å; T634-A636 PolarHBondContact O-N 3.09Å
637	L	71.9	Confident	80.1	Confident	14 Å²	14	40 Å²	40	7%	0.073	22%	0.222	C	C	.	.			trans	-92.5	131.5	173.2	-65.4	-178.1	0	0	0	111	R614 I617 T634 C641 E642 L645	R614-L637 HydrophobicContact CG-CD2 3.98Å; I617-L637 HydrophobicContact CD1-CD1 3.69Å; I617-L637 HydrophobicContact CD1-CD2 3.67Å; I617-L637 HydrophobicContact CD1-CG 3.96Å; T634-L637 HydrophobicContact CG2-CD1 4.3Å; T634-L637 PolarHBondContact O-N 3.06Å; L637-C641 HydrophobicContact CB-CB 4.27Å; L637-C641 HydrophobicContact CD2-CB 3.98Å; L637-E642 HydrophobicContact CB-CG 4.16Å; L637-L645 HydrophobicContact CD1-CD2 4.39Å
638	D	76	Confident	79.7	Confident	79 Å²	79	41.3 Å²	41.3	42%	0.422	23%	0.227	S	C	.	.			trans	-76.2	158.4	173.3	-30.7	-11	0	0	0	108.3	R614 Q640 C641 E642	R614-D638 IonicContact CZ-OD1 2.85Å; R614-D638 IonicContact CZ-OD2 2.61Å; R614-D638 IonicContact NH2-OD1 3.64Å; R614-D638 PolarHBondContact NH2-OD1 3.41Å; R614-D638 IonicContact NH2-OD2 3.69Å; R614-D638 PolarHBondContact NH2-OD2 3.02Å; D638-Q640 PolarHBondContact O-N 3.5Å; D638-Q640 VanDerWaalsContact O-N 3.14Å; D638-C641 WeakPolarHBondContact O-CA 3.31Å; D638-C641 WeakPolarHBondContact O-CB 3.47Å; D638-C641 PolarHBondContact O-N 3.04Å; D638-E642 PolarHBondContact O-N 3.42Å; D638-E642 VanDerWaalsContact O-N 3.11Å
639	A	74.9	Confident	79.2	Confident	78 Å²	78	42.5 Å²	42.5	65%	0.645	23%	0.232	S	C	*	.	H	α-helix	trans	-55.6	-36.3	-176.6	0	0	0	0	0	113.7	C641 E642 Q643	A639-C641 VanDerWaalsContact C-N 3.26Å; A639-C641 PolarHBondContact O-N 3.48Å; A639-E642 PolarHBondContact O-N 3.02Å; A639-Q643 PolarHBondContact O-N 3.19Å; A639-Q643 VanDerWaalsContact O-N 3.16Å
640	Q	75.7	Confident	78.5	Confident	156 Å²	156	46.5 Å²	46.5	73%	0.729	26%	0.26	S	S	*	.	H	α-helix	trans	-62.6	-33.8	176	-68.7	179.4	-12	0	0	112.3	D638 Q643 A644	D638-Q640 PolarHBondContact O-N 3.5Å; D638-Q640 VanDerWaalsContact O-N 3.14Å; Q640-Q643 PolarHBondContact O-N 3.01Å; Q640-A644 PolarHBondContact O-N 3.24Å
641	C	78.7	Confident	77.9	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.034	29%	0.292	C	S	.	.	H	α-helix	trans	-82	-33.6	-178.1	-59.1	0	0	0	0	112.7	C584 L637 D638 A639 Q643 A644 L645	C584-C641 HydrophobicContact CB-CB 3.91Å; C584-C641 WeakPolarHBondContact CB-SG 3.3Å; C584-C641 WeakPolarHBondContact SG-CA 3.3Å; C584-C641 WeakPolarHBondContact SG-CB 3.29Å; C584-C641 CovalentContact SG-SG 2.04Å; C584-C641 PolarHBondContact SG-SG 3.06Å; L637-C641 HydrophobicContact CB-CB 4.27Å; L637-C641 HydrophobicContact CD2-CB 3.98Å; D638-C641 WeakPolarHBondContact O-CA 3.31Å; D638-C641 WeakPolarHBondContact O-CB 3.47Å; D638-C641 PolarHBondContact O-N 3.04Å; A639-C641 VanDerWaalsContact C-N 3.26Å; A639-C641 PolarHBondContact O-N 3.48Å; C641-Q643 VanDerWaalsContact C-N 3.26Å; C641-Q643 PolarHBondContact O-N 3.15Å; C641-A644 PolarHBondContact O-N 2.86Å; C641-L645 WeakPolarHBondContact O-CB 3.28Å; C641-L645 PolarHBondContact O-N 3.36Å
642	E	79.3	Confident	77.1	Confident	28 Å²	28	53.8 Å²	53.8	13%	0.131	30%	0.3	C	S	.	.	H	α-helix	trans	-58.3	-42.9	167.2	-66.9	-169.5	157.9	0	0	110.6	L637 D638 A639 L645 Q646 H664	L637-E642 HydrophobicContact CB-CG 4.16Å; D638-E642 PolarHBondContact O-N 3.42Å; D638-E642 VanDerWaalsContact O-N 3.11Å; A639-E642 PolarHBondContact O-N 3.02Å; E642-L645 PolarHBondContact O-N 3.02Å; E642-Q646 WeakPolarHBondContact O-CG 3.34Å; E642-Q646 PolarHBondContact O-N 2.95Å; E642-H664 IonicContact OE2-CE1 2.91Å; E642-H664 IonicContact OE2-ND1 2.81Å; E642-H664 PolarHBondContact OE2-ND1 3.03Å
643	Q	80.8	Confident	77.2	Confident	118 Å²	118	57.4 Å²	57.4	55%	0.551	32%	0.32	S	S	*	.	H	α-helix	trans	-67.2	-41	178	-165	174	12.9	0	0	112.7	A639 Q640 C641 L645 Q646 N647	A639-Q643 PolarHBondContact O-N 3.19Å; A639-Q643 VanDerWaalsContact O-N 3.16Å; Q640-Q643 PolarHBondContact O-N 3.01Å; C641-Q643 VanDerWaalsContact C-N 3.26Å; C641-Q643 PolarHBondContact O-N 3.15Å; Q643-L645 VanDerWaalsContact C-N 3.3Å; Q643-L645 PolarHBondContact O-N 3.39Å; Q643-Q646 PolarHBondContact O-N 3.2Å; Q643-N647 WeakPolarHBondContact O-CB 2.99Å; Q643-N647 VanDerWaalsContact O-CG 3.26Å; Q643-N647 PolarHBondContact O-N 2.99Å; Q643-N647 PolarHBondContact O-ND2 3.29Å
644	A	83.3	Confident	78.2	Confident	29 Å²	29	58.2 Å²	58.2	24%	0.24	32%	0.323	C	S	.	.	H	α-helix	trans	-60	-41.1	174.1	0	0	0	0	0	112	Q640 C641 N647 W648	Q640-A644 PolarHBondContact O-N 3.24Å; C641-A644 PolarHBondContact O-N 2.86Å; A644-N647 PolarHBondContact O-N 3.17Å; A644-W648 PolarHBondContact O-N 3.45Å
645	L	84.3	Confident	79.6	Confident	9 Å²	9	57.7 Å²	57.7	5%	0.047	32%	0.32	C	S	.	.	H	α-helix	trans	-68.1	-38.4	177.2	-173.1	63	0	0	0	112.4	I617 L621 L628 L630 L637 C641 E642 Q643 W648 R649 M656	I617-L645 HydrophobicContact CG2-CD1 4.36Å; L621-L645 HydrophobicContact CD1-CD1 4.15Å; L621-L645 HydrophobicContact CD2-CD1 3.91Å; L628-L645 HydrophobicContact CD2-CD1 4.27Å; L630-L645 HydrophobicContact CD1-CD2 3.7Å; L637-L645 HydrophobicContact CD1-CD2 4.39Å; C641-L645 WeakPolarHBondContact O-CB 3.28Å; C641-L645 PolarHBondContact O-N 3.36Å; E642-L645 PolarHBondContact O-N 3.02Å; Q643-L645 VanDerWaalsContact C-N 3.3Å; Q643-L645 PolarHBondContact O-N 3.39Å; L645-W648 HydrophobicContact CD1-CE3 4.31Å; L645-W648 PolarHBondContact O-N 3.35Å; L645-R649 WeakPolarHBondContact O-CB 3.43Å; L645-R649 PolarHBondContact O-N 2.81Å; L645-M656 HydrophobicContact CD1-CE 4.48Å; L645-M656 HydrophobicContact CD2-CE 4.3Å; L645-M656 HydrophobicContact CG-CE 4.05Å
646	Q	81.8	Confident	80.8	Confident	96 Å²	96	56.5 Å²	56.5	45%	0.449	31%	0.31	S	S	.	.	H	α-helix	trans	-62.7	-44.3	172.2	-75.4	176.7	-6.8	0	0	111.8	E642 Q643 W648 R649 S650	E642-Q646 WeakPolarHBondContact O-CG 3.34Å; E642-Q646 PolarHBondContact O-N 2.95Å; Q643-Q646 PolarHBondContact O-N 3.2Å; Q646-W648 VanDerWaalsContact C-N 3.34Å; Q646-W648 PolarHBondContact O-N 3.05Å; Q646-R649 WeakPolarHBondContact O-CB 3.32Å; Q646-R649 PolarHBondContact O-N 3.46Å; Q646-S650 PolarHBondContact O-N 2.86Å; Q646-S650 PolarHBondContact O-OG 3.39Å
647	N	83.5	Confident	82.3	Confident	89 Å²	89	55.1 Å²	55.1	48%	0.476	30%	0.299	S	S	.	.	H	α-helix	trans	-64.1	-38.9	176.6	-72.4	-17.8	0	0	0	112.2	Q643 A644 S650 Q651	Q643-N647 WeakPolarHBondContact O-CB 2.99Å; Q643-N647 VanDerWaalsContact O-CG 3.26Å; Q643-N647 PolarHBondContact O-N 2.99Å; Q643-N647 PolarHBondContact O-ND2 3.29Å; A644-N647 PolarHBondContact O-N 3.17Å; N647-S650 PolarHBondContact O-OG 3.43Å; N647-Q651 WeakPolarHBondContact O-CG 3.38Å
648	W	86.6	Confident	83.2	Confident	27 Å²	27	54.7 Å²	54.7	10%	0.102	30%	0.297	C	S	.	.	H	α-helix	trans	-59.6	-54.1	172.3	175.3	84.4	0	0	0	109.1	L621 P625 L628 A644 L645 Q646 S650 Q651 R654	L621-W648 HydrophobicContact CB-CZ2 4.49Å; L621-W648 HydrophobicContact CD2-CD2 3.71Å; L621-W648 HydrophobicContact CD2-CE3 3.66Å; L621-W648 HydrophobicContact CD2-CH2 3.64Å; L621-W648 HydrophobicContact CD2-CZ2 3.68Å; L621-W648 HydrophobicContact CD2-CZ3 3.62Å; P625-W648 HydrophobicContact CG-CH2 4Å; L628-W648 HydrophobicContact CD2-CH2 4.46Å; L628-W648 HydrophobicContact CD2-CZ3 3.86Å; A644-W648 PolarHBondContact O-N 3.45Å; L645-W648 HydrophobicContact CD1-CE3 4.31Å; L645-W648 PolarHBondContact O-N 3.35Å; Q646-W648 VanDerWaalsContact C-N 3.34Å; Q646-W648 PolarHBondContact O-N 3.05Å; W648-S650 VanDerWaalsContact C-N 3.31Å; W648-S650 PolarHBondContact O-N 2.9Å; W648-Q651 WeakPolarHBondContact O-CB 3.32Å; W648-Q651 PolarHBondContact O-N 3.07Å; W648-Q651 VanDerWaalsContact O-N 3.11Å; W648-R654 VanDerWaalsContact C-NH1 3.28Å; W648-R654 VanDerWaalsContact CE2-CZ 3.42Å; W648-R654 VanDerWaalsContact CZ2-CZ 3.44Å; W648-R654 VanDerWaalsContact CZ3-CD 3.49Å; W648-R654 PolarHBondContact O-NH1 3.05Å
649	R	84.4	Confident	83.9	Confident	27 Å²	27	50.9 Å²	50.9	10%	0.102	28%	0.276	C	S	.	.	H	α-helix	trans	-53	-42.8	-177.8	-176.9	-172	120.4	93.8	-9.6	113.7	G496 T497 V498 L645 Q646 Q651 R654 M656 D670	G496-R649 VanDerWaalsContact C-NH2 3.31Å; G496-R649 PolarHBondContact O-NH2 3.44Å; T497-R649 VanDerWaalsContact C-CZ 3.5Å; T497-R649 VanDerWaalsContact CA-NH2 3.3Å; T497-R649 PolarHBondContact O-NH1 2.81Å; V498-R649 VanDerWaalsContact CG2-NH2 3.33Å; V498-R649 VanDerWaalsContact N-NH2 3.14Å; L645-R649 WeakPolarHBondContact O-CB 3.43Å; L645-R649 PolarHBondContact O-N 2.81Å; Q646-R649 WeakPolarHBondContact O-CB 3.32Å; Q646-R649 PolarHBondContact O-N 3.46Å; R649-Q651 PolarHBondContact O-N 3.3Å; R649-R654 HydrophobicContact CG-CB 4.29Å; R649-R654 PolarHBondContact NH1-O 3.03Å; R649-M656 HydrophobicContact CB-CE 4.27Å; R649-M656 HydrophobicContact CG-CE 4.26Å; R649-D670 IonicContact NH2-OD2 3.5Å; R649-D670 PolarHBondContact NH2-OD2 3.42Å
650	S	81.5	Confident	84.1	Confident	84 Å²	84	47.2 Å²	47.2	59%	0.587	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-11.8	-177	59.1	0	0	0	0	114.4	Q646 N647 W648 G652	Q646-S650 PolarHBondContact O-N 2.86Å; Q646-S650 PolarHBondContact O-OG 3.39Å; N647-S650 PolarHBondContact O-OG 3.43Å; W648-S650 VanDerWaalsContact C-N 3.31Å; W648-S650 PolarHBondContact O-N 2.9Å; S650-G652 VanDerWaalsContact C-N 3.26Å; S650-G652 PolarHBondContact O-N 3.4Å
651	Q	79.2	Confident	83.9	Confident	148 Å²	148	42.5 Å²	42.5	69%	0.692	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	8.2	-179.6	-66.7	171.7	0.5	0	0	114.9	N647 W648 R649	N647-Q651 WeakPolarHBondContact O-CG 3.38Å; W648-Q651 WeakPolarHBondContact O-CB 3.32Å; W648-Q651 PolarHBondContact O-N 3.07Å; W648-Q651 VanDerWaalsContact O-N 3.11Å; R649-Q651 PolarHBondContact O-N 3.3Å
652	G	74	Confident	83.4	Confident	24 Å²	24	47.4 Å²	47.4	25%	0.247	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	179.3	38.8	-180	0	0	0	0	0	116.9	R626 S650 R654	R626-G652 PolarHBondContact NH1-O 3.38Å; S650-G652 VanDerWaalsContact C-N 3.26Å; S650-G652 PolarHBondContact O-N 3.4Å; G652-R654 VanDerWaalsContact C-N 3.25Å; G652-R654 PolarHBondContact O-N 3.31Å; G652-R654 VanDerWaalsContact O-N 3.15Å
653	D	81.3	Confident	82.9	Confident	115 Å²	115	48 Å²	48	62%	0.615	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.4	43.9	175.9	-61.8	-25.1	0	0	0	114.1	G496	G496-D653 PolarHBondContact N-O 3.42Å
654	R	90.6	Very high	82.3	Confident	19 Å²	19	47 Å²	47	7%	0.072	24%	0.241	C	C	.	.			trans	-78.6	128.6	-175.8	-58.1	-173.7	-176.7	108.2	-0.1	111.5	N624 P625 W648 R649 G652	N624-R654 VanDerWaalsContact OD1-CZ 3.32Å; N624-R654 PolarHBondContact OD1-NE 2.81Å; N624-R654 PolarHBondContact OD1-NH2 2.74Å; P625-R654 WeakPolarHBondContact O-CD 3.34Å; W648-R654 VanDerWaalsContact C-NH1 3.28Å; W648-R654 VanDerWaalsContact CE2-CZ 3.42Å; W648-R654 VanDerWaalsContact CZ2-CZ 3.44Å; W648-R654 VanDerWaalsContact CZ3-CD 3.49Å; W648-R654 PolarHBondContact O-NH1 3.05Å; R649-R654 HydrophobicContact CG-CB 4.29Å; R649-R654 PolarHBondContact NH1-O 3.03Å; G652-R654 VanDerWaalsContact C-N 3.25Å; G652-R654 PolarHBondContact O-N 3.31Å; G652-R654 VanDerWaalsContact O-N 3.15Å
655	T	94.1	Very high	81.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	131.9	174.7	-53.3	0	0	0	0	110.3	G466 L493 H494 P495 R626 V627 L628	G466-T655 WeakPolarHBondContact O-CB 3.37Å; G466-T655 PolarHBondContact O-OG1 3.32Å; L493-T655 HydrophobicContact CB-CG2 3.68Å; H494-T655 PolarHBondContact O-OG1 3.43Å; P495-T655 WeakPolarHBondContact CA-OG1 3.32Å; R626-T655 PolarHBondContact O-N 3.43Å; V627-T655 WeakPolarHBondContact CA-O 3.22Å; L628-T655 PolarHBondContact N-O 2.91Å
656	M	93	Very high	81.5	Confident	13 Å²	13	46.9 Å²	46.9	6%	0.064	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	123.7	179.2	-171.7	-178.2	-81.3	0	0	111.1	T497 V498 T499 L628 L630 L645 R649 V658	T497-M656 PolarHBondContact O-N 3.32Å; T497-M656 VanDerWaalsContact O-N 3.16Å; V498-M656 WeakPolarHBondContact CA-O 3.35Å; V498-M656 HydrophobicContact CG2-CB 4.48Å; V498-M656 HydrophobicContact CG2-SD 4.43Å; T499-M656 PolarHBondContact N-O 3.34Å; L628-M656 HydrophobicContact CD2-CE 3.87Å; L628-M656 CarbonylContact O-C 3.57Å; L628-M656 WeakPolarHBondContact O-CA 3.36Å; L630-M656 HydrophobicContact CD1-CE 4.28Å; L630-M656 HydrophobicContact CD1-CG 4.42Å; L630-M656 HydrophobicContact CD1-SD 3.95Å; L645-M656 HydrophobicContact CD1-CE 4.48Å; L645-M656 HydrophobicContact CD2-CE 4.3Å; L645-M656 HydrophobicContact CG-CE 4.05Å; R649-M656 HydrophobicContact CB-CE 4.27Å; R649-M656 HydrophobicContact CG-CE 4.26Å; M656-V658 HydrophobicContact CG-CG2 3.82Å; M656-V658 HydrophobicContact SD-CG2 3.91Å
657	L	93.7	Very high	81.2	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	119.3	170.9	178.1	65.5	0	0	0	109	L493 T499 L501 V512 L516 L628 I629 L630	L493-L657 HydrophobicContact CD1-CB 4.22Å; L493-L657 HydrophobicContact CD1-CD2 4.38Å; L493-L657 HydrophobicContact CD2-CD1 4.15Å; T499-L657 HydrophobicContact CG2-CD1 4.23Å; T499-L657 WeakPolarHBondContact O-CA 3.4Å; L501-L657 HydrophobicContact CB-CD1 4.03Å; V512-L657 HydrophobicContact CG1-CD2 4.37Å; L516-L657 HydrophobicContact CD1-CD2 3.38Å; L628-L657 PolarHBondContact O-N 3.23Å; I629-L657 CarbonylContact C-O 3.49Å; I629-L657 VanDerWaalsContact CA-O 3.3Å; I629-L657 WeakPolarHBondContact CA-O 3.15Å; I629-L657 HydrophobicContact CG1-CB 4.4Å; I629-L657 HydrophobicContact CG2-CB 4.35Å; I629-L657 HydrophobicContact CG2-CD2 4.11Å; I629-L657 HydrophobicContact CG2-CG 4.35Å; L630-L657 PolarHBondContact N-O 3.21Å
658	V	91.4	Very high	80.9	Confident	4 Å²	4	46.7 Å²	46.7	2%	0.024	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	115.3	178.9	-169.4	0	0	0	0	109.5	V498 T499 A500 L501 L630 M656 A660 T665	V498-V658 HydrophobicContact CG1-CG2 3.92Å; T499-V658 PolarHBondContact O-N 3.49Å; A500-V658 CarbonylContact C-O 3.48Å; A500-V658 VanDerWaalsContact CA-O 3.32Å; A500-V658 WeakPolarHBondContact CA-O 3.21Å; L501-V658 PolarHBondContact N-O 3.29Å; L630-V658 HydrophobicContact CB-CG1 4.3Å; L630-V658 HydrophobicContact CD1-CG2 4.28Å; M656-V658 HydrophobicContact CG-CG2 3.82Å; M656-V658 HydrophobicContact SD-CG2 3.91Å; V658-A660 HydrophobicContact CG1-CB 4.23Å; V658-A660 PolarHBondContact O-N 3.04Å; V658-T665 HydrophobicContact CB-CG2 4.41Å; V658-T665 HydrophobicContact CG1-CG2 3.57Å
659	I	90.3	Very high	80.7	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	99	168.7	-57.9	168.4	0	0	0	106.1	L501 K509 A513 L630 D631 E632	L501-I659 HydrophobicContact CB-CG1 4.42Å; L501-I659 HydrophobicContact CD2-CG1 4.35Å; L501-I659 WeakPolarHBondContact O-CA 3.36Å; K509-I659 HydrophobicContact CB-CD1 4.26Å; K509-I659 HydrophobicContact CB-CG1 4.43Å; K509-I659 HydrophobicContact CB-CG2 3.75Å; K509-I659 HydrophobicContact CD-CG2 3.81Å; K509-I659 HydrophobicContact CG-CG2 4.37Å; A513-I659 HydrophobicContact CB-CD1 4.04Å; L630-I659 PolarHBondContact O-N 3.4Å; D631-I659 HydrophobicContact CB-CD1 4.03Å; D631-I659 WeakPolarHBondContact OD1-CB 3.34Å; D631-I659 WeakPolarHBondContact OD1-CG2 3.41Å; E632-I659 PolarHBondContact N-O 3.03Å; E632-I659 VanDerWaalsContact N-O 3.12Å
660	A	78.5	Confident	80.9	Confident	1 Å²	1	50 Å²	50	1%	0.008	26%	0.26	C	S	.	.			trans	-107	130.2	-170.6	0	0	0	0	0	110.6	L501 V658 T665 V666	L501-A660 PolarHBondContact O-N 3Å; V658-A660 HydrophobicContact CG1-CB 4.23Å; V658-A660 PolarHBondContact O-N 3.04Å; A660-T665 HydrophobicContact CB-CG2 4Å; A660-V666 HydrophobicContact CB-CG2 3.82Å
661	H	72.8	Confident	81.2	Confident	57 Å²	57	48.6 Å²	48.6	26%	0.264	24%	0.244	S	C	.	.			trans	-99.4	-14.3	161.6	-79.1	-95.1	0	0	0	111.8	K509 E632 R700	K509-H661 WeakPolarHBondContact CE-NE2 3.32Å; K509-H661 PolarHBondContact NZ-CE1 2.71Å; K509-H661 PolarHBondContact NZ-NE2 3.02Å; K509-H661 VanDerWaalsContact NZ-NE2 3.17Å; E632-H661 IonicContact OE1-CD2 2.67Å; E632-H661 PolarHBondContact OE1-CD2 2.6Å; E632-H661 IonicContact OE1-CG 3.81Å; E632-H661 IonicContact OE1-NE2 2.7Å; E632-H661 PolarHBondContact OE1-NE2 3.46Å; H661-R700 PolarHBondContact O-NE 3.11Å; H661-R700 PolarHBondContact O-NH2 3.05Å
662	R	67.1	Low	81.6	Confident	107 Å²	107	43.4 Å²	43.4	40%	0.404	22%	0.223	S	C	.	.	S	Bend	trans	-92.9	135	-175.3	-69.6	-174.7	170.6	-176.8	-1.3	112.5	T634 S635 H664 T665 V666	T634-R662 PolarHBondContact O-NH1 3.31Å; S635-R662 PolarHBondContact O-NH1 3.14Å; S635-R662 PolarHBondContact O-NH2 3.41Å; R662-H664 PolarHBondContact O-N 3.18Å; R662-T665 PolarHBondContact O-N 3.31Å; R662-V666 WeakPolarHBondContact O-CG2 3.45Å; R662-V666 PolarHBondContact O-N 3.33Å
663	L	68.3	Low	82.4	Confident	41 Å²	41	43.1 Å²	43.1	22%	0.215	22%	0.215	C	C	.	.	H	α-helix	trans	-57.8	-46.1	-178.5	-130.1	80.5	0	0	0	113.2	T665 V666 Q667 Y693 V697	L663-T665 VanDerWaalsContact C-N 3.31Å; L663-T665 PolarHBondContact O-N 2.87Å; L663-V666 PolarHBondContact O-N 2.91Å; L663-V666 VanDerWaalsContact O-N 3.1Å; L663-Q667 WeakPolarHBondContact O-CG 3.37Å; L663-Q667 PolarHBondContact O-N 3.48Å; L663-Y693 HydrophobicContact CD1-CE2 4.48Å; L663-Y693 HydrophobicContact CD2-CD2 4.26Å; L663-Y693 HydrophobicContact CD2-CE2 3.21Å; L663-Y693 WeakPolarHBondContact CD2-OH 3.32Å; L663-Y693 HydrophobicContact CG-CD2 4.3Å; L663-Y693 HydrophobicContact CG-CE2 3.59Å; L663-V697 HydrophobicContact CD1-CG2 3.87Å; L663-V697 HydrophobicContact CD2-CG2 4.05Å
664	H	68.9	Low	82.7	Confident	96 Å²	96	38.8 Å²	38.8	44%	0.444	19%	0.193	S	C	.	.	H	α-helix	trans	-59.2	-41.3	-178.7	-176.6	-110.1	0	0	0	112.3	E642 R662 V666 Q667 N668	E642-H664 IonicContact OE2-CE1 2.91Å; E642-H664 IonicContact OE2-ND1 2.81Å; E642-H664 PolarHBondContact OE2-ND1 3.03Å; R662-H664 PolarHBondContact O-N 3.18Å; H664-V666 VanDerWaalsContact C-N 3.29Å; H664-V666 PolarHBondContact O-N 2.85Å; H664-Q667 PolarHBondContact O-N 3.45Å; H664-N668 PolarHBondContact CE1-ND2 2.88Å; H664-N668 PolarHBondContact NE2-ND2 3.44Å; H664-N668 VanDerWaalsContact NE2-ND2 3.19Å; H664-N668 PolarHBondContact O-N 3.38Å; H664-N668 PolarHBondContact O-ND2 3.09Å
665	T	73.1	Confident	82.6	Confident	18 Å²	18	37.9 Å²	37.9	11%	0.11	19%	0.19	C	C	.	.	H	α-helix	trans	-68.6	-30.1	178.6	-42.1	0	0	0	0	112.2	V658 A660 R662 L663	V658-T665 HydrophobicContact CB-CG2 4.41Å; V658-T665 HydrophobicContact CG1-CG2 3.57Å; A660-T665 HydrophobicContact CB-CG2 4Å; R662-T665 PolarHBondContact O-N 3.31Å; L663-T665 VanDerWaalsContact C-N 3.31Å; L663-T665 PolarHBondContact O-N 2.87Å
666	V	77.5	Confident	82.2	Confident	18 Å²	18	42.7 Å²	42.7	11%	0.109	21%	0.21	C	C	.	.	H	α-helix	trans	-77.1	-39.8	175.7	179.2	0	0	0	0	111.3	A500 V502 A660 R662 L663 H664 N668 A669 V672 L696	A500-V666 HydrophobicContact CB-CG2 4.44Å; V502-V666 HydrophobicContact CG2-CG1 4.28Å; V502-V666 HydrophobicContact CG2-CG2 3.56Å; A660-V666 HydrophobicContact CB-CG2 3.82Å; R662-V666 WeakPolarHBondContact O-CG2 3.45Å; R662-V666 PolarHBondContact O-N 3.33Å; L663-V666 PolarHBondContact O-N 2.91Å; L663-V666 VanDerWaalsContact O-N 3.1Å; H664-V666 VanDerWaalsContact C-N 3.29Å; H664-V666 PolarHBondContact O-N 2.85Å; V666-N668 VanDerWaalsContact C-N 3.27Å; V666-N668 PolarHBondContact O-N 2.85Å; V666-A669 PolarHBondContact O-N 3.13Å; V666-V672 HydrophobicContact CG1-CG1 3.92Å; V666-V672 HydrophobicContact CG1-CG2 3.91Å; V666-L696 HydrophobicContact CG1-CD1 4.05Å
667	Q	76.2	Confident	81.9	Confident	102 Å²	102	49.7 Å²	49.7	48%	0.477	24%	0.243	S	C	.	.	H	α-helix	trans	-62.1	-34.3	178.8	-76.8	177	-28.2	0	0	113.1	L663 H664 A669 Y693	L663-Q667 WeakPolarHBondContact O-CG 3.37Å; L663-Q667 PolarHBondContact O-N 3.48Å; H664-Q667 PolarHBondContact O-N 3.45Å; Q667-A669 VanDerWaalsContact C-N 3.34Å; Q667-Y693 HydrophobicContact CG-CD2 4.25Å; Q667-Y693 HydrophobicContact CG-CE2 3.96Å; Q667-Y693 PolarHBondContact NE2-OH 2.86Å
668	N	75.9	Confident	81.6	Confident	79 Å²	79	49.7 Å²	49.7	42%	0.422	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	7.3	-177.2	-63.9	-25.1	0	0	0	113.3	H664 V666	H664-N668 PolarHBondContact CE1-ND2 2.88Å; H664-N668 PolarHBondContact NE2-ND2 3.44Å; H664-N668 VanDerWaalsContact NE2-ND2 3.19Å; H664-N668 PolarHBondContact O-N 3.38Å; H664-N668 PolarHBondContact O-ND2 3.09Å; V666-N668 VanDerWaalsContact C-N 3.27Å; V666-N668 PolarHBondContact O-N 2.85Å
669	A	83.8	Confident	81.5	Confident	16 Å²	16	56.6 Å²	56.6	13%	0.132	27%	0.269	C	S	.	.			trans	-87.4	139.4	179.4	0	0	0	0	0	111.3	V498 A500 V666 Q667 Q671 V672	V498-A669 HydrophobicContact CG1-CB 4.21Å; A500-A669 HydrophobicContact CB-CB 3.57Å; V666-A669 PolarHBondContact O-N 3.13Å; Q667-A669 VanDerWaalsContact C-N 3.34Å; A669-Q671 VanDerWaalsContact C-N 3.26Å; A669-Q671 PolarHBondContact O-N 3.49Å; A669-V672 HydrophobicContact CB-CG2 4.34Å
670	D	87.4	Confident	81.4	Confident	108 Å²	108	58.8 Å²	58.8	58%	0.578	28%	0.28	S	S	*	.	S	Bend	trans	-69.1	-28.9	176.3	-57.1	-59.5	0	0	0	111.6	T497 V498 R649	T497-D670 WeakPolarHBondContact CA-OD2 3.47Å; V498-D670 PolarHBondContact N-OD2 3.07Å; V498-D670 PolarHBondContact O-N 3.39Å; R649-D670 IonicContact NH2-OD2 3.5Å; R649-D670 PolarHBondContact NH2-OD2 3.42Å
671	Q	88.4	Confident	81.6	Confident	54 Å²	54	60.8 Å²	60.8	25%	0.252	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	138	178.4	-175.4	179.3	10.2	0	0	110.2	T492 V498 T499 A500 A669 L673	T492-Q671 PolarHBondContact O-OE1 3.49Å; V498-Q671 PolarHBondContact O-N 3.36Å; V498-Q671 VanDerWaalsContact O-N 3.12Å; T499-Q671 CarbonylContact C-O 3.54Å; T499-Q671 VanDerWaalsContact CA-O 3.3Å; T499-Q671 WeakPolarHBondContact CA-O 3.28Å; T499-Q671 HydrophobicContact CG2-CB 4.16Å; T499-Q671 HydrophobicContact CG2-CG 4.14Å; T499-Q671 PolarHBondContact OG1-OE1 3.43Å; A500-Q671 PolarHBondContact N-O 3.41Å; A669-Q671 VanDerWaalsContact C-N 3.26Å; A669-Q671 PolarHBondContact O-N 3.49Å; Q671-L673 HydrophobicContact CG-CD2 4.44Å
672	V	88.4	Confident	81.4	Confident	39 Å²	39	64.2 Å²	64.2	24%	0.236	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	126.1	176.3	-176.5	0	0	0	0	109.8	A500 V502 V666 A669 V674 V692	A500-V672 HydrophobicContact CB-CG2 4.44Å; A500-V672 CarbonylContact O-C 3.54Å; A500-V672 WeakPolarHBondContact O-CA 3.18Å; V502-V672 HydrophobicContact CG2-CG1 4.28Å; V666-V672 HydrophobicContact CG1-CG1 3.92Å; V666-V672 HydrophobicContact CG1-CG2 3.91Å; A669-V672 HydrophobicContact CB-CG2 4.34Å; V672-V674 HydrophobicContact CG1-CG2 4.42Å; V672-V692 HydrophobicContact CG1-CG1 4.43Å
673	L	89.1	Confident	80.8	Confident	18 Å²	18	65.4 Å²	65.4	9%	0.094	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	121.5	177.1	-62.4	178.5	0	0	0	109.3	F491 T499 A500 L501 V502 Q671 L680	F491-L673 HydrophobicContact CB-CD1 4.18Å; F491-L673 HydrophobicContact CB-CD2 4.42Å; F491-L673 HydrophobicContact CD1-CD1 4.46Å; F491-L673 HydrophobicContact CD2-CD1 3.38Å; F491-L673 HydrophobicContact CE2-CD1 3.77Å; F491-L673 HydrophobicContact CG-CD1 3.77Å; F491-L673 HydrophobicContact CZ-CD1 4.43Å; T499-L673 HydrophobicContact CG2-CD1 3.6Å; T499-L673 HydrophobicContact CG2-CG 3.8Å; A500-L673 PolarHBondContact O-N 3.11Å; L501-L673 WeakPolarHBondContact CA-O 3.45Å; L501-L673 HydrophobicContact CD1-CB 3.81Å; V502-L673 PolarHBondContact N-O 2.91Å; Q671-L673 HydrophobicContact CG-CD2 4.44Å; L673-L680 HydrophobicContact CB-CD2 3.98Å; L673-L680 HydrophobicContact CD2-CD2 4.42Å
674	V	88.2	Confident	79.7	Confident	24 Å²	24	70.7 Å²	70.7	15%	0.145	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	116	178.7	-175.9	0	0	0	0	109.9	V502 V672 V681 V692	V502-V674 CarbonylContact O-C 3.59Å; V502-V674 WeakPolarHBondContact O-CA 3.43Å; V672-V674 HydrophobicContact CG1-CG2 4.42Å; V674-V681 HydrophobicContact CB-CB 4.43Å; V674-V681 HydrophobicContact CG1-CG2 4.32Å; V674-V681 PolarHBondContact O-N 3.48Å; V674-V692 HydrophobicContact CG2-CG1 4.04Å
675	L	88.4	Confident	78.5	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	119.2	-178.6	-167.3	72.2	0	0	0	110.9	L486 L489 L501 V502 G503 S507 K509 V512 L680	L486-L675 HydrophobicContact CD2-CD2 4.37Å; L489-L675 HydrophobicContact CD2-CD1 3.61Å; L489-L675 HydrophobicContact CG-CD1 4.31Å; L501-L675 HydrophobicContact CD1-CB 4.06Å; V502-L675 PolarHBondContact O-N 2.98Å; G503-L675 WeakPolarHBondContact CA-O 3.24Å; S507-L675 WeakPolarHBondContact CB-O 3.46Å; S507-L675 WeakPolarHBondContact O-CD2 3.17Å; S507-L675 WeakPolarHBondContact O-CG 3.38Å; S507-L675 PolarHBondContact OG-O 2.96Å; K509-L675 HydrophobicContact CG-CD2 4.19Å; V512-L675 HydrophobicContact CG2-CD2 4.48Å; L675-L680 HydrophobicContact CD1-CD2 4.31Å; L675-L680 HydrophobicContact CD1-CG 4.5Å
676	K	86.9	Confident	77.4	Confident	101 Å²	101	72.9 Å²	72.9	44%	0.439	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	124.4	178.6	-171.1	177.8	-179.5	-178.6	0	110	G678 R679 V681	K676-G678 PolarHBondContact O-N 3Å; K676-G678 VanDerWaalsContact O-N 3.13Å; K676-R679 PolarHBondContact N-O 3.1Å; K676-R679 PolarHBondContact O-N 3.26Å; K676-V681 HydrophobicContact CB-CG2 3.74Å; K676-V681 HydrophobicContact CD-CG2 4.48Å
677	Q	85.7	Confident	75.7	Confident	160 Å²	160	81.6 Å²	81.6	75%	0.748	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	38.6	179.4	-63.1	179.6	-18.9	0	0	113.7	R679	Q677-R679 VanDerWaalsContact C-N 3.35Å; Q677-R679 PolarHBondContact O-N 3.33Å
678	G	86.5	Confident	74	Confident	0 Å²	0	85.3 Å²	85.3	0%	0	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	80	7.6	178.6	0	0	0	0	0	116.1	V485 Q487 L489 S507 K676	V485-G678 WeakPolarHBondContact O-CA 3.32Å; Q487-G678 PolarHBondContact N-O 3.19Å; L489-G678 WeakPolarHBondContact CD1-O 3.18Å; S507-G678 WeakPolarHBondContact O-CA 3.47Å; S507-G678 PolarHBondContact O-N 3.29Å; S507-G678 VanDerWaalsContact O-N 3.15Å; K676-G678 PolarHBondContact O-N 3Å; K676-G678 VanDerWaalsContact O-N 3.13Å
679	R	90.1	Very high	72.6	Confident	150 Å²	150	85.5 Å²	85.5	57%	0.566	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.4	149.3	175.8	-61.4	-176.7	-171.6	-171.1	-0.5	110.9	Q487 K676 Q677	Q487-R679 HydrophobicContact CB-CG 3.88Å; Q487-R679 VanDerWaalsContact OE1-CZ 3.28Å; K676-R679 PolarHBondContact N-O 3.1Å; K676-R679 PolarHBondContact O-N 3.26Å; Q677-R679 VanDerWaalsContact C-N 3.35Å; Q677-R679 PolarHBondContact O-N 3.33Å
680	L	88.4	Confident	71	Confident	46 Å²	46	88.5 Å²	88.5	24%	0.241	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	134.6	169.2	-73.9	169.8	0	0	0	109.4	L489 T490 F491 L673 L675	L489-L680 HydrophobicContact CD2-CG 4.3Å; T490-L680 WeakPolarHBondContact O-CD1 3.42Å; F491-L680 HydrophobicContact CB-CD1 3.91Å; F491-L680 HydrophobicContact CD1-CD1 3.65Å; F491-L680 HydrophobicContact CG-CD1 4.14Å; L673-L680 HydrophobicContact CB-CD2 3.98Å; L673-L680 HydrophobicContact CD2-CD2 4.42Å; L675-L680 HydrophobicContact CD1-CD2 4.31Å; L675-L680 HydrophobicContact CD1-CG 4.5Å
681	V	83.4	Confident	69.5	Low	42 Å²	42	88.4 Å²	88.4	26%	0.255	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-85.3	124.9	173.5	-176.5	0	0	0	0	107.9	V674 K676 Q685	V674-V681 HydrophobicContact CB-CB 4.43Å; V674-V681 HydrophobicContact CG1-CG2 4.32Å; V674-V681 PolarHBondContact O-N 3.48Å; K676-V681 HydrophobicContact CB-CG2 3.74Å; K676-V681 HydrophobicContact CD-CG2 4.48Å; V681-Q685 HydrophobicContact CG1-CB 4.14Å
682	E	67	Low	67.9	Low	130 Å²	130	87.1 Å²	87.1	61%	0.607	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-69.3	146.6	176.7	-69.4	176.8	166.6	0	0	111.3	D684 Q685	E682-D684 PolarHBondContact O-N 3.37Å; E682-Q685 PolarHBondContact O-N 3.03Å
683	H	55	Low	66.3	Low	131 Å²	131	89.6 Å²	89.6	61%	0.606	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-55.7	-33.1	179.6	-100.4	-69.9	0	0	0	113	Q685 L686	H683-Q685 VanDerWaalsContact C-N 3.31Å; H683-Q685 PolarHBondContact O-N 3.3Å; H683-L686 WeakPolarHBondContact O-CB 3.43Å; H683-L686 PolarHBondContact O-N 3.48Å
684	D	44.6	Very low	64.7	Low	152 Å²	152	90.5 Å²	90.5	81%	0.813	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-74.7	-17	-179.6	-65	-17.8	0	0	0	113.8	E682 L686	E682-D684 PolarHBondContact O-N 3.37Å; D684-L686 VanDerWaalsContact C-N 3.31Å
685	Q	44.2	Very low	63.3	Low	135 Å²	135	92.6 Å²	92.6	63%	0.631	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-84.1	-8.4	174.7	-67.3	-173.8	7.5	0	0	112.9	V681 E682 H683 R687	V681-Q685 HydrophobicContact CG1-CB 4.14Å; E682-Q685 PolarHBondContact O-N 3.03Å; H683-Q685 VanDerWaalsContact C-N 3.31Å; H683-Q685 PolarHBondContact O-N 3.3Å; Q685-R687 VanDerWaalsContact C-N 3.31Å; Q685-R687 PolarHBondContact O-N 3.32Å; Q685-R687 VanDerWaalsContact O-N 3.11Å
686	L	50.5	Low	61.9	Low	26 Å²	26	93.7 Å²	93.7	14%	0.136	47%	0.467	C	S	.	.	S	Bend	trans	-77.6	88.9	162.6	-68.8	138.3	0	0	0	106.6	H683 D684 D688 V692 H695	H683-L686 WeakPolarHBondContact O-CB 3.43Å; H683-L686 PolarHBondContact O-N 3.48Å; D684-L686 VanDerWaalsContact C-N 3.31Å; L686-D688 PolarHBondContact O-N 3.44Å; L686-V692 HydrophobicContact CD1-CG2 3.62Å; L686-V692 HydrophobicContact CD2-CB 4.47Å; L686-V692 HydrophobicContact CD2-CG2 4.24Å; L686-V692 HydrophobicContact CG-CG2 4.46Å; L686-H695 HydrophobicContact CD2-CB 3.92Å
687	R	41.8	Very low	60.3	Low	201 Å²	201	91.2 Å²	91.2	76%	0.758	46%	0.46	S	S	*	.			trans	-25.8	126	-176.2	-69.7	179.5	173.2	-178.8	-2.1	113	Q685 G689 Q690	Q685-R687 VanDerWaalsContact C-N 3.31Å; Q685-R687 PolarHBondContact O-N 3.32Å; Q685-R687 VanDerWaalsContact O-N 3.11Å; R687-G689 PolarHBondContact O-N 2.87Å; R687-Q690 PolarHBondContact O-N 3.05Å
688	D	39.8	Very low	58.8	Low	180 Å²	180	87.5 Å²	87.5	96%	0.963	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-27	102.9	172.7	-99.8	-24.4	0	0	0	112	L686	L686-D688 PolarHBondContact O-N 3.44Å
689	G	47.1	Very low	57.3	Low	83 Å²	83	90 Å²	90	86%	0.856	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.1	-1.1	173.9	0	0	0	0	0	117.8	R687	R687-G689 PolarHBondContact O-N 2.87Å
690	Q	49.4	Very low	55.5	Low	79 Å²	79	89.4 Å²	89.4	37%	0.369	45%	0.453	S	S	.	.			trans	-97.7	114	168.2	-74.5	-168.7	-29.1	0	0	111.3	R687	R687-Q690 PolarHBondContact O-N 3.05Å
691	D	57.5	Low	53.1	Low	106 Å²	106	93.9 Å²	93.9	57%	0.567	48%	0.476	S	S	*	.			trans	-50.4	139.1	170.8	-166.5	-12.2	0	0	0	110	Y693 A694 H695	D691-Y693 VanDerWaalsContact CG-CB 3.4Å; D691-Y693 CarbonylContact O-C 3.6Å; D691-Y693 PolarHBondContact O-N 3.01Å; D691-Y693 WeakPolarHBondContact OD1-CB 3.43Å; D691-Y693 PolarHBondContact OD1-N 3.02Å; D691-Y693 WeakPolarHBondContact OD2-CB 3.37Å; D691-A694 HydrophobicContact CB-CB 4.44Å; D691-A694 WeakPolarHBondContact O-CA 3.35Å; D691-A694 WeakPolarHBondContact O-CB 3.26Å; D691-A694 PolarHBondContact O-N 2.9Å; D691-H695 PolarHBondContact O-N 3.01Å
692	V	54.9	Low	50.9	Low	26 Å²	26	99.2 Å²	99.2	16%	0.158	50%	0.498	C	S	.	.	H	α-helix	trans	-49.6	-33.3	172.7	-176.1	0	0	0	0	110.5	V672 V674 L686 H695 L696	V672-V692 HydrophobicContact CG1-CG1 4.43Å; V674-V692 HydrophobicContact CG2-CG1 4.04Å; L686-V692 HydrophobicContact CD1-CG2 3.62Å; L686-V692 HydrophobicContact CD2-CB 4.47Å; L686-V692 HydrophobicContact CD2-CG2 4.24Å; L686-V692 HydrophobicContact CG-CG2 4.46Å; V692-H695 PolarHBondContact O-N 2.82Å; V692-L696 HydrophobicContact CG1-CD1 4.33Å; V692-L696 WeakPolarHBondContact O-CG 3.15Å; V692-L696 PolarHBondContact O-N 3.32Å; V692-L696 VanDerWaalsContact O-N 3.13Å
693	Y	53.3	Low	49.4	Very low	92 Å²	92	99.6 Å²	99.6	36%	0.361	52%	0.523	S	S	.	.	H	α-helix	trans	-56.6	-49	169.9	-171.3	-104.3	0	0	0	114.3	L663 Q667 D691 H695 L696 V697	L663-Y693 HydrophobicContact CD1-CE2 4.48Å; L663-Y693 HydrophobicContact CD2-CD2 4.26Å; L663-Y693 HydrophobicContact CD2-CE2 3.21Å; L663-Y693 WeakPolarHBondContact CD2-OH 3.32Å; L663-Y693 HydrophobicContact CG-CD2 4.3Å; L663-Y693 HydrophobicContact CG-CE2 3.59Å; Q667-Y693 HydrophobicContact CG-CD2 4.25Å; Q667-Y693 HydrophobicContact CG-CE2 3.96Å; Q667-Y693 PolarHBondContact NE2-OH 2.86Å; D691-Y693 VanDerWaalsContact CG-CB 3.4Å; D691-Y693 CarbonylContact O-C 3.6Å; D691-Y693 PolarHBondContact O-N 3.01Å; D691-Y693 WeakPolarHBondContact OD1-CB 3.43Å; D691-Y693 PolarHBondContact OD1-N 3.02Å; D691-Y693 WeakPolarHBondContact OD2-CB 3.37Å; Y693-H695 VanDerWaalsContact C-N 3.34Å; Y693-H695 PolarHBondContact O-N 2.97Å; Y693-L696 PolarHBondContact O-N 3.47Å; Y693-V697 HydrophobicContact CD1-CG2 4.48Å; Y693-V697 HydrophobicContact CE1-CG2 4.29Å; Y693-V697 WeakPolarHBondContact O-CB 3.15Å; Y693-V697 VanDerWaalsContact O-CG2 3.25Å; Y693-V697 WeakPolarHBondContact O-CG2 2.96Å; Y693-V697 PolarHBondContact O-N 3.18Å
694	A	55.6	Low	49.2	Very low	37 Å²	37	98 Å²	98	31%	0.306	52%	0.519	S	S	.	.	H	α-helix	trans	-64	-39.7	179.8	0	0	0	0	0	111.6	D691 V697 Q698	D691-A694 HydrophobicContact CB-CB 4.44Å; D691-A694 WeakPolarHBondContact O-CA 3.35Å; D691-A694 WeakPolarHBondContact O-CB 3.26Å; D691-A694 PolarHBondContact O-N 2.9Å; A694-V697 PolarHBondContact O-N 2.89Å; A694-Q698 VanDerWaalsContact O-CB 3.23Å; A694-Q698 WeakPolarHBondContact O-CB 3.43Å; A694-Q698 PolarHBondContact O-N 3.41Å
695	H	58.6	Low	49.4	Very low	67 Å²	67	95.2 Å²	95.2	31%	0.31	50%	0.504	S	S	.	.	H	α-helix	trans	-69.9	-35.1	179.6	-161.2	-43.5	0	0	0	112.6	L686 D691 V692 Y693 Q699	L686-H695 HydrophobicContact CD2-CB 3.92Å; D691-H695 PolarHBondContact O-N 3.01Å; V692-H695 PolarHBondContact O-N 2.82Å; Y693-H695 VanDerWaalsContact C-N 3.34Å; Y693-H695 PolarHBondContact O-N 2.97Å; H695-Q699 PolarHBondContact O-N 3.42Å
696	L	59.6	Low	49.7	Very low	23 Å²	23	92.9 Å²	92.9	12%	0.12	50%	0.497	C	S	.	.	H	α-helix	trans	-71.5	-37.8	174.2	-74.6	173.7	0	0	0	112.5	V502 V666 V692 Y693 R700	V502-L696 HydrophobicContact CB-CD1 4.49Å; V502-L696 HydrophobicContact CB-CD2 4.2Å; V502-L696 HydrophobicContact CG1-CD1 4.07Å; V502-L696 HydrophobicContact CG1-CD2 3.37Å; V502-L696 HydrophobicContact CG1-CG 4.38Å; V666-L696 HydrophobicContact CG1-CD1 4.05Å; V692-L696 HydrophobicContact CG1-CD1 4.33Å; V692-L696 WeakPolarHBondContact O-CG 3.15Å; V692-L696 PolarHBondContact O-N 3.32Å; V692-L696 VanDerWaalsContact O-N 3.13Å; Y693-L696 PolarHBondContact O-N 3.47Å; L696-R700 PolarHBondContact O-N 3.2Å
697	V	54.2	Low	49.7	Very low	49 Å²	49	96.9 Å²	96.9	30%	0.297	52%	0.518	S	S	.	.	H	α-helix	trans	-65.3	-42.4	172.8	171.2	0	0	0	0	110.7	L663 Y693 A694 R700 L701	L663-V697 HydrophobicContact CD1-CG2 3.87Å; L663-V697 HydrophobicContact CD2-CG2 4.05Å; Y693-V697 HydrophobicContact CD1-CG2 4.48Å; Y693-V697 HydrophobicContact CE1-CG2 4.29Å; Y693-V697 WeakPolarHBondContact O-CB 3.15Å; Y693-V697 VanDerWaalsContact O-CG2 3.25Å; Y693-V697 WeakPolarHBondContact O-CG2 2.96Å; Y693-V697 PolarHBondContact O-N 3.18Å; A694-V697 PolarHBondContact O-N 2.89Å; V697-R700 PolarHBondContact O-N 2.96Å; V697-L701 HydrophobicContact CG1-CD1 4.07Å; V697-L701 WeakPolarHBondContact O-CG 3.42Å; V697-L701 PolarHBondContact O-N 3.01Å
698	Q	54.3	Low	50.1	Low	82 Å²	82	90.4 Å²	90.4	38%	0.383	50%	0.503	S	S	.	.	H	α-helix	trans	-66.6	-40.2	179.6	-161.4	167.9	2.2	0	0	112.1	A694 R700 L701 E702	A694-Q698 VanDerWaalsContact O-CB 3.23Å; A694-Q698 WeakPolarHBondContact O-CB 3.43Å; A694-Q698 PolarHBondContact O-N 3.41Å; Q698-R700 VanDerWaalsContact C-N 3.33Å; Q698-R700 PolarHBondContact O-N 3.17Å; Q698-L701 PolarHBondContact O-N 3.49Å; Q698-L701 VanDerWaalsContact O-N 3.14Å; Q698-E702 PolarHBondContact O-N 3.29Å
699	Q	54.1	Low	50.8	Low	53 Å²	53	84.4 Å²	84.4	25%	0.248	47%	0.472	C	S	.	.	H	α-helix	trans	-65.6	-30.6	173.1	-83	-172.4	-13.8	0	0	114.1	H695 L701 A703	H695-Q699 PolarHBondContact O-N 3.42Å; Q699-L701 VanDerWaalsContact C-N 3.29Å; Q699-A703 PolarHBondContact O-N 3.03Å
700	R	51.3	Low	51.1	Low	138 Å²	138	84.5 Å²	84.5	52%	0.521	45%	0.445	S	S	.	.	H	α-helix	trans	-73	-20.1	173.1	-93.5	178.1	163.4	-142.7	-9.9	113.4	H661 L696 V697 Q698	H661-R700 PolarHBondContact O-NE 3.11Å; H661-R700 PolarHBondContact O-NH2 3.05Å; L696-R700 PolarHBondContact O-N 3.2Å; V697-R700 PolarHBondContact O-N 2.96Å; Q698-R700 VanDerWaalsContact C-N 3.33Å; Q698-R700 PolarHBondContact O-N 3.17Å
701	L	40	Very low	51.2	Low	140 Å²	140	84.9 Å²	84.9	73%	0.733	45%	0.451	S	S	*	.	H	α-helix	trans	-88.7	-20.9	176.3	-73.5	162	0	0	0	112.3	V697 Q698 Q699	V697-L701 HydrophobicContact CG1-CD1 4.07Å; V697-L701 WeakPolarHBondContact O-CG 3.42Å; V697-L701 PolarHBondContact O-N 3.01Å; Q698-L701 PolarHBondContact O-N 3.49Å; Q698-L701 VanDerWaalsContact O-N 3.14Å; Q699-L701 VanDerWaalsContact C-N 3.29Å
702	E	36.1	Very low	50.7	Low	153 Å²	153	83.2 Å²	83.2	72%	0.715	44%	0.441	S	S	*	.	H	α-helix	trans	-96.5	-10	179.3	-70.3	179	179.9	0	0	114.3	Q698	Q698-E702 PolarHBondContact O-N 3.29Å
703	A	36.7	Very low	50.3	Low	138 Å²	138	88.4 Å²	88.4	100%	1.141	47%	0.467	S	S	*	.			trans	-102.3	0	173.7	0	0	0	0	0	110.8	Q699	Q699-A703 PolarHBondContact O-N 3.03Å

Retrieved 703 of 703 residues in 671.9 ms (Link to these results)

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