A0A077Z128_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z128, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 884 aa.

						>A0A077Z128_TRITR|A0A077Z128
MDIAQIEPSVLGLILAFTIAALFAVIFYWATKESSDKLDGIKSSSPEVRRSPVQRLRNSHFQRSKKLRKTSKKKPNGDVRKTFNVKGQEPDSSEKSLDAEVEKKAIVNDVNTKEETEDVESLEERETAEAATDSAQNIVAADDANDDIEKKGATVPSEIMHAADSLIEVLPNKVTEELLRDWMTNMTDSSSSWKTIKRRCVLVESLCLRVKQLEKMLETEKRVMADRDRRLTERWDEVRRLFKSKIDMCSAFLANEKELFRLRELVESLSLKVNRANNANQTLRKENSECTARLRQALIKQSQDSQDKINLESRCLQLEKDLQMRYEDKMHWVNELHLCEAKLTMAESRRRELELLVERVRQKLQNDAVEKDGLHQKLCDLHVLLPSSRVDKDGSEWKLIKKGVQKLVDSLSLREAEITSLKQRLKSANEIAYSKLTALSSAVTVQKDANWKEQNELPIAIPPSSLYGLSDEGRNRYNEIDFRVENGTNCARVDDSDNDVHNLNSANTSNSARDAPAPSAVESKEPMSNSNANDVTANIESISTEDVGVQTCTDFAFEAEKYEKLLERIANLHEMYHNLLTFQANTSDKNADELALVHLNDMEICMDIMSNKIAMLTDEVEHLKKRNEDLRSKNYRTMDLLRETESRFVDWANHCEETYENDKQENKRRVTNIIKAVFGNRCNGEEDLTKLLNYVKKEYDNELEKQLLVNSRYLNCLLEREVLLDNLVGSYLYKFSSMSVAAVYSVLFGFLLLPACAYNYAEGYIAERLNRSSERILEQLLLRFTDGPFPWKVGQYNTKQFFPRYNRYYWIGKRYYQFDPDSLLADRLPCEYALPVNVTVSYEDDEPVKEIVFQCRKFQQACCGEMDCCLVDETGRIYSRFTNE
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.4	Low	75.3	Confident	181 Å²	181	108.2 Å²	108.2	89%	0.892	61%	0.605	S	S	*	*				0	122.2	0	-79	174.7	76.4	0	0	106.9	I3 I6	M1-I3 PolarHBondContact O-N 2.82Å; M1-I6 HydrophobicContact CB-CD1 4.45Å; M1-I6 HydrophobicContact CE-CD1 4.08Å; M1-I6 HydrophobicContact CE-CG1 3.47Å; M1-I6 VanDerWaalsContact CE-CG1 3.47Å
2	D	62.5	Low	76.6	Confident	128 Å²	128	102.3 Å²	102.3	68%	0.684	59%	0.587	S	S	*	*			trans	-62.7	130.5	168.1	-91.5	-36.9	0	0	0	108.7	A4 Q5	D2-A4 PolarHBondContact O-N 3.2Å; D2-Q5 PolarHBondContact O-N 3.05Å
3	I	67	Low	77.7	Confident	125 Å²	125	102.7 Å²	102.7	64%	0.641	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-57.6	-26	-173.7	-63.6	171.1	0	0	0	111.2	M1 Q5 I6	M1-I3 PolarHBondContact O-N 2.82Å; I3-Q5 PolarHBondContact O-N 3.21Å; I3-I6 PolarHBondContact O-N 3.29Å
4	A	69.2	Low	78.7	Confident	102 Å²	102	101.4 Å²	101.4	84%	0.843	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-64.3	-19.4	176.8	0	0	0	0	0	114.4	D2	D2-A4 PolarHBondContact O-N 3.2Å
5	Q	74.9	Confident	79.7	Confident	151 Å²	151	101.7 Å²	101.7	71%	0.706	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-93.8	-7.1	-179.2	-68.2	-177.1	-10.6	0	0	113.8	D2 I3 E7	D2-Q5 PolarHBondContact O-N 3.05Å; I3-Q5 PolarHBondContact O-N 3.21Å; Q5-E7 PolarHBondContact O-N 3.45Å
6	I	77	Confident	80.5	Confident	32 Å²	32	99 Å²	99	16%	0.164	57%	0.567	C	S	.	*	S	Bend	trans	-85.7	118.6	179.7	-61.1	175	0	0	0	107.9	M1 I3 V10 L11	M1-I6 HydrophobicContact CB-CD1 4.45Å; M1-I6 HydrophobicContact CE-CD1 4.08Å; M1-I6 HydrophobicContact CE-CG1 3.47Å; M1-I6 VanDerWaalsContact CE-CG1 3.47Å; I3-I6 PolarHBondContact O-N 3.29Å; I6-V10 HydrophobicContact CG2-CB 3.76Å; I6-V10 HydrophobicContact CG2-CG1 3.85Å; I6-L11 HydrophobicContact CG2-CB 3.99Å
7	E	81.2	Confident	81.3	Confident	132 Å²	132	101.5 Å²	101.5	62%	0.617	57%	0.57	S	S	*	*			trans	-51.6	135.9	172.8	-72.7	-171.5	161.2	0	0	110	Q5 S9 V10 L11	Q5-E7 PolarHBondContact O-N 3.45Å; E7-S9 WeakPolarHBondContact CB-OG 3.46Å; E7-S9 PolarHBondContact O-N 3.35Å; E7-V10 HydrophobicContact CB-CG2 4.29Å; E7-V10 PolarHBondContact O-N 3.36Å; E7-L11 PolarHBondContact O-N 2.99Å
8	P	83.7	Confident	82	Confident	113 Å²	113	99.9 Å²	99.9	73%	0.734	56%	0.564	S	S	*	*	H	α-helix	trans	-53.7	-28.9	-177.5	-27.2	33.5	0	0	0	113.8	G12	P8-G12 PolarHBondContact O-N 2.99Å
9	S	84	Confident	82.7	Confident	78 Å²	78	99 Å²	99	55%	0.545	56%	0.556	S	S	.	*	H	α-helix	trans	-61.6	-48.8	173.2	50.6	0	0	0	0	112.2	E7 G12 L13	E7-S9 WeakPolarHBondContact CB-OG 3.46Å; E7-S9 PolarHBondContact O-N 3.35Å; S9-G12 PolarHBondContact O-N 3.47Å; S9-L13 PolarHBondContact O-N 2.94Å
10	V	86.8	Confident	83.2	Confident	68 Å²	68	97 Å²	97	41%	0.412	55%	0.553	S	S	.	*	H	α-helix	trans	-68.3	-39.6	178.8	-179.8	0	0	0	0	110.5	I6 E7 G12 L13 I14	I6-V10 HydrophobicContact CG2-CB 3.76Å; I6-V10 HydrophobicContact CG2-CG1 3.85Å; E7-V10 HydrophobicContact CB-CG2 4.29Å; E7-V10 PolarHBondContact O-N 3.36Å; V10-G12 VanDerWaalsContact C-N 3.32Å; V10-G12 PolarHBondContact O-N 2.88Å; V10-L13 WeakPolarHBondContact O-CB 3.24Å; V10-L13 PolarHBondContact O-N 3.48Å; V10-I14 HydrophobicContact CG1-CD1 4.01Å; V10-I14 HydrophobicContact CG1-CG1 4.49Å; V10-I14 VanDerWaalsContact O-CG1 3.32Å; V10-I14 WeakPolarHBondContact O-CG1 3.49Å; V10-I14 PolarHBondContact O-N 2.97Å
11	L	88.4	Confident	83.7	Confident	80 Å²	80	95 Å²	95	42%	0.419	55%	0.548	S	S	.	.	H	α-helix	trans	-62.8	-41.5	174.6	-168	70.6	0	0	0	111.2	I6 E7 L13 I14 L15	I6-L11 HydrophobicContact CG2-CB 3.99Å; E7-L11 PolarHBondContact O-N 2.99Å; L11-L13 VanDerWaalsContact C-N 3.33Å; L11-L13 PolarHBondContact O-N 2.82Å; L11-I14 PolarHBondContact O-N 3.07Å; L11-L15 WeakPolarHBondContact O-CB 3.5Å; L11-L15 PolarHBondContact O-N 2.8Å
12	G	90.9	Very high	85.7	Confident	38 Å²	38	91.6 Å²	91.6	39%	0.392	53%	0.533	S	S	.	.	H	α-helix	trans	-61.2	-40	173.3	0	0	0	0	0	112.6	P8 S9 V10 L15 A16	P8-G12 PolarHBondContact O-N 2.99Å; S9-G12 PolarHBondContact O-N 3.47Å; V10-G12 VanDerWaalsContact C-N 3.32Å; V10-G12 PolarHBondContact O-N 2.88Å; G12-L15 PolarHBondContact O-N 3.27Å; G12-A16 WeakPolarHBondContact O-CB 3.28Å; G12-A16 PolarHBondContact O-N 2.88Å
13	L	90.3	Very high	87.2	Confident	107 Å²	107	92.2 Å²	92.2	56%	0.56	53%	0.53	S	S	*	.	H	α-helix	trans	-66.4	-45.3	177	-154.2	108.9	0	0	0	111.6	S9 V10 L11 L15 A16 F17	S9-L13 PolarHBondContact O-N 2.94Å; V10-L13 WeakPolarHBondContact O-CB 3.24Å; V10-L13 PolarHBondContact O-N 3.48Å; L11-L13 VanDerWaalsContact C-N 3.33Å; L11-L13 PolarHBondContact O-N 2.82Å; L13-L15 VanDerWaalsContact C-N 3.31Å; L13-L15 PolarHBondContact O-N 3.13Å; L13-A16 PolarHBondContact O-N 3.32Å; L13-F17 HydrophobicContact CD2-CD2 3.95Å; L13-F17 HydrophobicContact CD2-CE2 3.76Å; L13-F17 HydrophobicContact CG-CD2 4.11Å; L13-F17 HydrophobicContact CG-CE2 4.11Å; L13-F17 WeakPolarHBondContact O-CD2 3.28Å; L13-F17 PolarHBondContact O-N 3.4Å
14	I	92.3	Very high	88.4	Confident	85 Å²	85	89.2 Å²	89.2	44%	0.436	52%	0.524	S	S	.	.	H	α-helix	trans	-61.4	-41.8	176.1	-67.2	167	0	0	0	110.5	V10 L11 F17 T18	V10-I14 HydrophobicContact CG1-CD1 4.01Å; V10-I14 HydrophobicContact CG1-CG1 4.49Å; V10-I14 VanDerWaalsContact O-CG1 3.32Å; V10-I14 WeakPolarHBondContact O-CG1 3.49Å; V10-I14 PolarHBondContact O-N 2.97Å; L11-I14 PolarHBondContact O-N 3.07Å; I14-F17 PolarHBondContact O-N 3.3Å; I14-T18 PolarHBondContact O-N 2.98Å; I14-T18 PolarHBondContact O-OG1 3.35Å
15	L	93.2	Very high	89.5	Confident	106 Å²	106	88.2 Å²	88.2	56%	0.555	51%	0.507	S	S	*	.	H	α-helix	trans	-63.7	-43.5	176.1	-163.3	85.3	0	0	0	111.4	L11 G12 L13 T18 I19	L11-L15 WeakPolarHBondContact O-CB 3.5Å; L11-L15 PolarHBondContact O-N 2.8Å; G12-L15 PolarHBondContact O-N 3.27Å; L13-L15 VanDerWaalsContact C-N 3.31Å; L13-L15 PolarHBondContact O-N 3.13Å; L15-T18 VanDerWaalsContact CA-OG1 3.29Å; L15-T18 WeakPolarHBondContact CA-OG1 3.47Å; L15-T18 PolarHBondContact O-N 3.03Å; L15-T18 PolarHBondContact O-OG1 2.78Å; L15-I19 HydrophobicContact CD2-CD1 4.18Å; L15-I19 HydrophobicContact CG-CD1 4.02Å; L15-I19 WeakPolarHBondContact O-CB 3.4Å; L15-I19 VanDerWaalsContact O-CG1 3.23Å; L15-I19 WeakPolarHBondContact O-CG1 3.27Å; L15-I19 PolarHBondContact O-N 2.95Å
16	A	92.7	Very high	90.4	Very high	58 Å²	58	86.2 Å²	86.2	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-62.9	-43.8	177.1	0	0	0	0	0	111.7	G12 L13 I19 A20	G12-A16 WeakPolarHBondContact O-CB 3.28Å; G12-A16 PolarHBondContact O-N 2.88Å; L13-A16 PolarHBondContact O-N 3.32Å; A16-I19 PolarHBondContact O-N 3.29Å; A16-A20 WeakPolarHBondContact O-CB 3.32Å; A16-A20 PolarHBondContact O-N 3.05Å
17	F	93.8	Very high	90.9	Very high	141 Å²	141	91.8 Å²	91.8	62%	0.618	52%	0.523	S	S	*	.	H	α-helix	trans	-64.6	-40.4	176.3	-92.8	-74.9	0	0	0	112.6	L13 I14 A20 A21	L13-F17 HydrophobicContact CD2-CD2 3.95Å; L13-F17 HydrophobicContact CD2-CE2 3.76Å; L13-F17 HydrophobicContact CG-CD2 4.11Å; L13-F17 HydrophobicContact CG-CE2 4.11Å; L13-F17 WeakPolarHBondContact O-CD2 3.28Å; L13-F17 PolarHBondContact O-N 3.4Å; I14-F17 PolarHBondContact O-N 3.3Å; F17-A20 PolarHBondContact O-N 3.22Å; F17-A21 WeakPolarHBondContact O-CB 3.25Å; F17-A21 PolarHBondContact O-N 3.35Å
18	T	94.1	Very high	91.4	Very high	74 Å²	74	92.1 Å²	92.1	45%	0.454	52%	0.52	S	S	.	.	H	α-helix	trans	-67.9	-39.1	176.5	33.4	0	0	0	0	112.1	I14 L15 A21 L22	I14-T18 PolarHBondContact O-N 2.98Å; I14-T18 PolarHBondContact O-OG1 3.35Å; L15-T18 VanDerWaalsContact CA-OG1 3.29Å; L15-T18 WeakPolarHBondContact CA-OG1 3.47Å; L15-T18 PolarHBondContact O-N 3.03Å; L15-T18 PolarHBondContact O-OG1 2.78Å; T18-A21 PolarHBondContact O-N 3.07Å; T18-L22 WeakPolarHBondContact O-CB 3.38Å; T18-L22 WeakPolarHBondContact O-CG 3.44Å; T18-L22 PolarHBondContact O-N 3.38Å
19	I	95.3	Very high	91.5	Very high	82 Å²	82	94.5 Å²	94.5	42%	0.421	51%	0.514	S	S	.	.	H	α-helix	trans	-63.6	-46.4	173.5	-69.4	166.8	0	0	0	110.4	L15 A16 A21 L22 F23	L15-I19 HydrophobicContact CD2-CD1 4.18Å; L15-I19 HydrophobicContact CG-CD1 4.02Å; L15-I19 WeakPolarHBondContact O-CB 3.4Å; L15-I19 VanDerWaalsContact O-CG1 3.23Å; L15-I19 WeakPolarHBondContact O-CG1 3.27Å; L15-I19 PolarHBondContact O-N 2.95Å; A16-I19 PolarHBondContact O-N 3.29Å; I19-A21 PolarHBondContact O-N 3.2Å; I19-L22 PolarHBondContact O-N 2.94Å; I19-F23 HydrophobicContact CG2-CD2 3.7Å; I19-F23 HydrophobicContact CG2-CE2 3.73Å; I19-F23 WeakPolarHBondContact O-CD2 3.48Å; I19-F23 PolarHBondContact O-N 3.39Å
20	A	92.8	Very high	91.5	Very high	58 Å²	58	93.6 Å²	93.6	48%	0.479	51%	0.511	S	S	.	.	H	α-helix	trans	-61	-42.8	178.2	0	0	0	0	0	112.2	A16 F17 F23 A24	A16-A20 WeakPolarHBondContact O-CB 3.32Å; A16-A20 PolarHBondContact O-N 3.05Å; F17-A20 PolarHBondContact O-N 3.22Å; A20-F23 PolarHBondContact O-N 2.72Å; A20-A24 PolarHBondContact O-N 3.36Å
21	A	94.6	Very high	91.3	Very high	56 Å²	56	93 Å²	93	46%	0.463	51%	0.508	S	S	.	.	H	α-helix	trans	-63.2	-41.7	175.9	0	0	0	0	0	112.1	F17 T18 I19 A24 V25	F17-A21 WeakPolarHBondContact O-CB 3.25Å; F17-A21 PolarHBondContact O-N 3.35Å; T18-A21 PolarHBondContact O-N 3.07Å; I19-A21 PolarHBondContact O-N 3.2Å; A21-A24 PolarHBondContact O-N 3.35Å; A21-V25 WeakPolarHBondContact O-CG2 3.28Å; A21-V25 PolarHBondContact O-N 3.12Å
22	L	95.1	Very high	90.6	Very high	110 Å²	110	93.8 Å²	93.8	58%	0.576	51%	0.508	S	S	*	.	H	α-helix	trans	-63.4	-42.1	175.2	-76.2	170	0	0	0	111.9	T18 I19 V25 I26	T18-L22 WeakPolarHBondContact O-CB 3.38Å; T18-L22 WeakPolarHBondContact O-CG 3.44Å; T18-L22 PolarHBondContact O-N 3.38Å; I19-L22 PolarHBondContact O-N 2.94Å; L22-V25 PolarHBondContact O-N 3.06Å; L22-I26 VanDerWaalsContact O-CG1 3.25Å; L22-I26 WeakPolarHBondContact O-CG1 3.37Å; L22-I26 PolarHBondContact O-N 3.41Å
23	F	94.6	Very high	89.6	Confident	141 Å²	141	98.1 Å²	98.1	62%	0.618	52%	0.518	S	S	*	.	H	α-helix	trans	-62.1	-42.6	174.4	-91.2	-74.4	0	0	0	112.1	I19 A20 V25 I26 F27	I19-F23 HydrophobicContact CG2-CD2 3.7Å; I19-F23 HydrophobicContact CG2-CE2 3.73Å; I19-F23 WeakPolarHBondContact O-CD2 3.48Å; I19-F23 PolarHBondContact O-N 3.39Å; A20-F23 PolarHBondContact O-N 2.72Å; F23-V25 VanDerWaalsContact C-N 3.35Å; F23-V25 PolarHBondContact O-N 3.2Å; F23-I26 PolarHBondContact O-N 3.03Å; F23-F27 VanDerWaalsContact O-CB 3.26Å; F23-F27 WeakPolarHBondContact O-CB 3.42Å; F23-F27 PolarHBondContact O-N 2.84Å
24	A	91.5	Very high	88.4	Confident	61 Å²	61	96.5 Å²	96.5	50%	0.504	52%	0.516	S	S	.	.	H	α-helix	trans	-62.1	-41.7	177	0	0	0	0	0	112	A20 A21 F27 Y28	A20-A24 PolarHBondContact O-N 3.36Å; A21-A24 PolarHBondContact O-N 3.35Å; A24-F27 PolarHBondContact O-N 3.05Å; A24-Y28 WeakPolarHBondContact O-CB 3.41Å; A24-Y28 PolarHBondContact O-N 2.92Å
25	V	93.3	Very high	87.2	Confident	81 Å²	81	95.8 Å²	95.8	49%	0.491	52%	0.518	S	S	.	.	H	α-helix	trans	-65.5	-46.3	176	173	0	0	0	0	111.1	A21 L22 F23 F27 Y28 W29	A21-V25 WeakPolarHBondContact O-CG2 3.28Å; A21-V25 PolarHBondContact O-N 3.12Å; L22-V25 PolarHBondContact O-N 3.06Å; F23-V25 VanDerWaalsContact C-N 3.35Å; F23-V25 PolarHBondContact O-N 3.2Å; V25-F27 VanDerWaalsContact C-N 3.31Å; V25-F27 PolarHBondContact O-N 3.25Å; V25-Y28 PolarHBondContact O-N 3.38Å; V25-W29 VanDerWaalsContact O-CD1 3.24Å; V25-W29 PolarHBondContact O-N 3.37Å
26	I	93.6	Very high	85.7	Confident	110 Å²	110	96.5 Å²	96.5	56%	0.564	52%	0.523	S	S	*	.	H	α-helix	trans	-60.8	-42.7	177.6	-68.7	165.7	0	0	0	110.6	L22 F23 W29 A30	L22-I26 VanDerWaalsContact O-CG1 3.25Å; L22-I26 WeakPolarHBondContact O-CG1 3.37Å; L22-I26 PolarHBondContact O-N 3.41Å; F23-I26 PolarHBondContact O-N 3.03Å; I26-W29 PolarHBondContact O-N 3.34Å; I26-A30 WeakPolarHBondContact O-CB 3.29Å; I26-A30 PolarHBondContact O-N 3.09Å
27	F	86.4	Confident	83.9	Confident	149 Å²	149	100.9 Å²	100.9	65%	0.654	53%	0.531	S	S	*	.	H	α-helix	trans	-66	-42	178.7	-166	-93.1	0	0	0	112	F23 A24 V25 W29 A30 T31	F23-F27 VanDerWaalsContact O-CB 3.26Å; F23-F27 WeakPolarHBondContact O-CB 3.42Å; F23-F27 PolarHBondContact O-N 2.84Å; A24-F27 PolarHBondContact O-N 3.05Å; V25-F27 VanDerWaalsContact C-N 3.31Å; V25-F27 PolarHBondContact O-N 3.25Å; F27-W29 VanDerWaalsContact C-N 3.32Å; F27-W29 PolarHBondContact O-N 3.24Å; F27-A30 PolarHBondContact O-N 3.46Å; F27-T31 HydrophobicContact CD1-CG2 3.84Å; F27-T31 HydrophobicContact CE1-CG2 3.52Å; F27-T31 HydrophobicContact CZ-CG2 3.95Å; F27-T31 WeakPolarHBondContact O-CB 3.32Å; F27-T31 WeakPolarHBondContact O-CG2 3.44Å; F27-T31 PolarHBondContact O-N 2.97Å; F27-T31 PolarHBondContact O-OG1 3.14Å
28	Y	91.2	Very high	81.7	Confident	138 Å²	138	100.8 Å²	100.8	54%	0.541	54%	0.536	S	S	.	.	H	α-helix	trans	-58.9	-42.8	174	179.1	-97.1	0	0	0	111.9	A24 V25 T31 K32	A24-Y28 WeakPolarHBondContact O-CB 3.41Å; A24-Y28 PolarHBondContact O-N 2.92Å; V25-Y28 PolarHBondContact O-N 3.38Å; Y28-T31 PolarHBondContact O-OG1 2.95Å; Y28-T31 VanDerWaalsContact O-OG1 3.04Å; Y28-K32 HydrophobicContact CE1-CD 4.22Å; Y28-K32 VanDerWaalsContact O-CB 3.3Å; Y28-K32 WeakPolarHBondContact O-CB 3.44Å; Y28-K32 PolarHBondContact O-N 3.43Å
29	W	86.3	Confident	79.5	Confident	164 Å²	164	104.5 Å²	104.5	62%	0.621	55%	0.553	S	S	*	*	H	α-helix	trans	-68.6	-40.8	176.4	-81.6	101.7	0	0	0	113.1	V25 I26 F27 T31 K32 E33	V25-W29 VanDerWaalsContact O-CD1 3.24Å; V25-W29 PolarHBondContact O-N 3.37Å; I26-W29 PolarHBondContact O-N 3.34Å; F27-W29 VanDerWaalsContact C-N 3.32Å; F27-W29 PolarHBondContact O-N 3.24Å; W29-T31 PolarHBondContact O-N 3.49Å; W29-K32 PolarHBondContact O-N 3.09Å; W29-E33 PolarHBondContact O-N 3.04Å; W29-E33 VanDerWaalsContact O-N 3.16Å
30	A	83.6	Confident	77.2	Confident	58 Å²	58	103.4 Å²	103.4	48%	0.479	56%	0.562	S	S	.	*	H	α-helix	trans	-64.6	-40.8	178.5	0	0	0	0	0	112.4	I26 F27 S34	I26-A30 WeakPolarHBondContact O-CB 3.29Å; I26-A30 PolarHBondContact O-N 3.09Å; F27-A30 PolarHBondContact O-N 3.46Å; A30-S34 PolarHBondContact O-N 3.04Å
31	T	82.7	Confident	74.8	Confident	57 Å²	57	107 Å²	107	35%	0.35	57%	0.572	S	S	.	*	H	α-helix	trans	-71.4	-40.4	178.2	52.7	0	0	0	0	111.7	F27 Y28 W29 E33 S34 S35	F27-T31 HydrophobicContact CD1-CG2 3.84Å; F27-T31 HydrophobicContact CE1-CG2 3.52Å; F27-T31 HydrophobicContact CZ-CG2 3.95Å; F27-T31 WeakPolarHBondContact O-CB 3.32Å; F27-T31 WeakPolarHBondContact O-CG2 3.44Å; F27-T31 PolarHBondContact O-N 2.97Å; F27-T31 PolarHBondContact O-OG1 3.14Å; Y28-T31 PolarHBondContact O-OG1 2.95Å; Y28-T31 VanDerWaalsContact O-OG1 3.04Å; W29-T31 PolarHBondContact O-N 3.49Å; T31-E33 VanDerWaalsContact C-N 3.34Å; T31-E33 PolarHBondContact O-N 3.08Å; T31-S34 PolarHBondContact O-N 3.26Å; T31-S34 VanDerWaalsContact O-N 3.13Å; T31-S34 PolarHBondContact O-OG 3.47Å; T31-S35 PolarHBondContact O-N 2.93Å; T31-S35 VanDerWaalsContact O-N 3.07Å
32	K	75	Confident	72.1	Confident	96 Å²	96	114.1 Å²	114.1	42%	0.417	59%	0.593	S	S	.	*	H	α-helix	trans	-59.2	-42.5	176.5	-167.8	172.1	-177.6	174.5	0	112.4	Y28 W29 S34 S35 D36	Y28-K32 HydrophobicContact CE1-CD 4.22Å; Y28-K32 VanDerWaalsContact O-CB 3.3Å; Y28-K32 WeakPolarHBondContact O-CB 3.44Å; Y28-K32 PolarHBondContact O-N 3.43Å; W29-K32 PolarHBondContact O-N 3.09Å; K32-S34 VanDerWaalsContact C-N 3.28Å; K32-S34 PolarHBondContact O-N 3.17Å; K32-S35 WeakPolarHBondContact O-CB 3.19Å; K32-S35 PolarHBondContact O-N 3.28Å; K32-D36 PolarHBondContact O-N 3.25Å
33	E	69.1	Low	69.3	Low	129 Å²	129	114.1 Å²	114.1	60%	0.603	60%	0.602	S	S	*	*	H	α-helix	trans	-68.5	-27.5	178.1	-156.9	179.4	178.1	0	0	113	W29 T31	W29-E33 PolarHBondContact O-N 3.04Å; W29-E33 VanDerWaalsContact O-N 3.16Å; T31-E33 VanDerWaalsContact C-N 3.34Å; T31-E33 PolarHBondContact O-N 3.08Å
34	S	65.6	Low	66.6	Low	72 Å²	72	112.3 Å²	112.3	50%	0.503	61%	0.607	S	S	.	*	H	α-helix	trans	-74.7	-32.5	174.6	76.8	0	0	0	0	113	A30 T31 K32 K37	A30-S34 PolarHBondContact O-N 3.04Å; T31-S34 PolarHBondContact O-N 3.26Å; T31-S34 VanDerWaalsContact O-N 3.13Å; T31-S34 PolarHBondContact O-OG 3.47Å; K32-S34 VanDerWaalsContact C-N 3.28Å; K32-S34 PolarHBondContact O-N 3.17Å; S34-K37 PolarHBondContact O-N 2.86Å
35	S	66.8	Low	63.7	Low	71 Å²	71	115 Å²	115	50%	0.497	62%	0.622	S	S	.	*	H	α-helix	trans	-64.6	-47.3	177.2	178.4	0	0	0	0	111.1	T31 K32 K37 L38	T31-S35 PolarHBondContact O-N 2.93Å; T31-S35 VanDerWaalsContact O-N 3.07Å; K32-S35 WeakPolarHBondContact O-CB 3.19Å; K32-S35 PolarHBondContact O-N 3.28Å; S35-K37 PolarHBondContact O-N 3.22Å; S35-L38 PolarHBondContact O-N 2.87Å; S35-L38 VanDerWaalsContact O-N 3.11Å
36	D	61.8	Low	61.3	Low	121 Å²	121	116.7 Å²	116.7	65%	0.647	64%	0.635	S	S	*	*	H	α-helix	trans	-66.5	-22.3	-176.5	-70	-13	0	0	0	112.9	K32	K32-D36 PolarHBondContact O-N 3.25Å
37	K	54.9	Low	58.4	Low	149 Å²	149	120.3 Å²	120.3	65%	0.648	65%	0.649	S	S	*	*	H	α-helix	trans	-84	-17.6	176	-79.7	178.6	-179.2	162.5	0	114.2	S34 S35	S34-K37 PolarHBondContact O-N 2.86Å; S35-K37 PolarHBondContact O-N 3.22Å
38	L	46.5	Very low	56	Low	140 Å²	140	119.3 Å²	119.3	73%	0.733	66%	0.655	S	S	*	*	H	α-helix	trans	-81.5	-21	-173.8	-148.9	74.1	0	0	0	113.3	S35 G40	S35-L38 PolarHBondContact O-N 2.87Å; S35-L38 VanDerWaalsContact O-N 3.11Å; L38-G40 VanDerWaalsContact C-N 3.29Å; L38-G40 PolarHBondContact O-N 3.42Å
39	D	49.2	Very low	53.3	Low	152 Å²	152	124.1 Å²	124.1	81%	0.813	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-10.6	176.5	-77.3	-26.1	0	0	0	113.9
40	G	47.1	Very low	50.6	Low	59 Å²	59	127.9 Å²	127.9	61%	0.608	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-10.6	-179.7	0	0	0	0	0	116.1	L38	L38-G40 VanDerWaalsContact C-N 3.29Å; L38-G40 PolarHBondContact O-N 3.42Å
41	I	42.5	Very low	48.2	Very low	134 Å²	134	130 Å²	130	69%	0.687	70%	0.697	S	S	*	*			trans	-115.9	60.4	-170.1	-46.5	179.2	0	0	0	110.7
42	K	37.7	Very low	46.1	Very low	205 Å²	205	133.4 Å²	133.4	89%	0.891	72%	0.72	S	S	*	*			trans	-126	50.9	163.9	-86.1	-176.7	179.1	168.4	0	111
43	S	35.7	Very low	44.2	Very low	110 Å²	110	135.5 Å²	135.5	77%	0.769	74%	0.741	S	S	*	*			trans	-162.4	60.3	169	55.8	0	0	0	0	113.1
44	S	38.2	Very low	42.5	Very low	103 Å²	103	138 Å²	138	72%	0.72	75%	0.753	S	S	*	*			trans	-153.6	111.5	152.6	42.2	0	0	0	0	111
45	S	31.4	Very low	40.9	Very low	118 Å²	118	146.1 Å²	146.1	83%	0.825	77%	0.772	S	S	*	*			trans	-69.7	125.2	173.2	-173.1	0	0	0	0	109.4	E47	S45-E47 PolarHBondContact O-N 2.97Å
46	P	42.2	Very low	39.3	Very low	116 Å²	116	150.4 Å²	150.4	75%	0.753	79%	0.789	S	S	*	*			trans	-84	105	-177.1	30.6	-29.6	0	0	0	110.4	V48	P46-V48 PolarHBondContact O-N 3.32Å
47	E	33	Very low	37.8	Very low	185 Å²	185	155.9 Å²	155.9	86%	0.864	80%	0.8	S	S	*	*			trans	-69.7	118.3	173.8	-159.1	168.3	-169.3	0	0	110.6	S45 R49	S45-E47 PolarHBondContact O-N 2.97Å; E47-R49 PolarHBondContact O-N 3.15Å
48	V	35.8	Very low	36.8	Very low	128 Å²	128	156.6 Å²	156.6	78%	0.776	81%	0.811	S	S	*	*			trans	-68	94.9	-174.7	176.9	0	0	0	0	110.7	P46	P46-V48 PolarHBondContact O-N 3.32Å
49	R	34.3	Very low	36.1	Very low	240 Å²	240	154.6 Å²	154.6	91%	0.906	81%	0.809	S	S	*	*			trans	-90.3	105	165.6	-84.8	-174.6	173.7	160.4	0.7	110.9	E47 S51	E47-R49 PolarHBondContact O-N 3.15Å; R49-S51 PolarHBondContact O-N 2.82Å
50	R	30.6	Very low	35.3	Very low	243 Å²	243	155.3 Å²	155.3	92%	0.917	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-67.5	116.4	165	-70.2	177.2	174.9	162.2	-0.8	109.4
51	S	32.7	Very low	34.7	Very low	102 Å²	102	161.5 Å²	161.5	71%	0.713	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-99.7	146.6	165.9	68.9	0	0	0	0	110.5	R49	R49-S51 PolarHBondContact O-N 2.82Å
52	P	38.4	Very low	34.3	Very low	128 Å²	128	164.6 Å²	164.6	83%	0.831	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-89	122.8	-170.1	13.7	3.9	0	0	0	111.3	Q54	P52-Q54 PolarHBondContact O-N 3.33Å
53	V	36	Very low	34.1	Very low	141 Å²	141	166 Å²	166	86%	0.855	83%	0.829	S	S	*	*			trans	-67.9	113.2	176.4	175.2	0	0	0	0	110.4	R55	V53-R55 PolarHBondContact O-N 3.01Å
54	Q	32	Very low	34.2	Very low	182 Å²	182	166 Å²	166	85%	0.85	83%	0.828	S	S	*	*			trans	-75.7	115.5	178.2	-152.1	169.1	7.1	0	0	109.8	P52 L56	P52-Q54 PolarHBondContact O-N 3.33Å; Q54-L56 PolarHBondContact O-N 3.06Å
55	R	32.4	Very low	34.2	Very low	241 Å²	241	170.7 Å²	170.7	91%	0.909	84%	0.836	S	S	*	*			trans	-68.5	107.9	177.1	-76.7	178.9	-177.9	161	0.9	110.8	V53	V53-R55 PolarHBondContact O-N 3.01Å
56	L	34	Very low	34.4	Very low	162 Å²	162	174.7 Å²	174.7	85%	0.848	84%	0.838	S	S	*	*			trans	-76.1	119.2	166.3	-96.8	144.4	0	0	0	110.3	Q54 N58	Q54-L56 PolarHBondContact O-N 3.06Å; L56-N58 PolarHBondContact O-N 3.37Å
57	R	30	Very low	34.1	Very low	235 Å²	235	177 Å²	177	89%	0.887	84%	0.844	S	S	*	*			trans	-69	113.1	172.4	-78.9	178.4	168.6	-174.3	-2.6	109.7
58	N	34.3	Very low	34.1	Very low	165 Å²	165	179.8 Å²	179.8	88%	0.882	85%	0.846	S	S	*	*			trans	-97	106.3	162.8	-79.7	-11.8	0	0	0	109.4	L56	L56-N58 PolarHBondContact O-N 3.37Å
59	S	31.6	Very low	34.1	Very low	97 Å²	97	183.6 Å²	183.6	68%	0.678	85%	0.852	S	S	*	*			trans	-100	146.2	174.4	56.7	0	0	0	0	111.3
60	H	30.6	Very low	34.2	Very low	168 Å²	168	178.2 Å²	178.2	78%	0.778	85%	0.847	S	S	*	*			trans	69.5	105.8	158.5	-81.7	-76.6	0	0	0	118.8
61	F	36	Very low	34.4	Very low	189 Å²	189	172.5 Å²	172.5	83%	0.829	84%	0.844	S	S	*	*				171.9	95.2	110	-105.1	-85.5	0	0	0	108.8
62	Q	34	Very low	34.6	Very low	198 Å²	198	177.4 Å²	177.4	93%	0.925	85%	0.852	S	S	*	*			trans	-125.9	107	159.8	-87.4	-167.3	-4.2	0	0	109.7
63	R	33.1	Very low	34.5	Very low	235 Å²	235	181.2 Å²	181.2	89%	0.887	86%	0.856	S	S	*	*			trans	-79.4	111.1	-175.2	-160.2	175.7	-172.8	-179.8	2.2	108.4	K65	R63-K65 PolarHBondContact O-N 3.15Å
64	S	37.2	Very low	34.4	Very low	109 Å²	109	183.8 Å²	183.8	76%	0.762	86%	0.855	S	S	*	*			trans	-71.5	109.9	-179.9	42.4	0	0	0	0	111.6	K66	S64-K66 PolarHBondContact O-N 3.21Å
65	K	38	Very low	34.9	Very low	202 Å²	202	181.1 Å²	181.1	88%	0.878	85%	0.854	S	S	*	*			trans	-81.4	106.1	167.6	-83.9	-179.4	175.5	177.2	0	109.4	R63 L67	R63-K65 PolarHBondContact O-N 3.15Å; K65-L67 PolarHBondContact O-N 3.1Å
66	K	35.6	Very low	34.9	Very low	202 Å²	202	177.6 Å²	177.6	88%	0.878	85%	0.853	S	S	*	*			trans	-65.2	104.8	171.8	-73	176.5	175.8	176.4	0	110.4	S64	S64-K66 PolarHBondContact O-N 3.21Å
67	L	35.6	Very low	34.9	Very low	164 Å²	164	173.4 Å²	173.4	86%	0.859	85%	0.849	S	S	*	*			trans	-87.5	108.7	164.6	-94.8	152	0	0	0	109.2	K65 K69	K65-L67 PolarHBondContact O-N 3.1Å; L67-K69 PolarHBondContact O-N 3.2Å
68	R	33.2	Very low	35.1	Very low	244 Å²	244	170.1 Å²	170.1	92%	0.921	85%	0.849	S	S	*	*			trans	-59.8	110.5	171.4	-90.4	177	163.8	173.9	-5.1	109.5
69	K	35.8	Very low	35.2	Very low	208 Å²	208	167.9 Å²	167.9	90%	0.904	84%	0.841	S	S	*	*			trans	-84.3	113.2	165.5	-78.9	-179.8	174.7	177.9	0	109	L67	L67-K69 PolarHBondContact O-N 3.2Å
70	T	36.5	Very low	35.2	Very low	128 Å²	128	175.1 Å²	175.1	79%	0.785	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-73.9	133.2	171.2	45	0	0	0	0	110.7	K72	T70-K72 PolarHBondContact O-N 3.47Å
71	S	34.9	Very low	35.4	Very low	123 Å²	123	175.7 Å²	175.7	86%	0.86	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-64.8	118.6	179.8	44.1	0	0	0	0	112.3
72	K	38.3	Very low	35.5	Very low	205 Å²	205	173.2 Å²	173.2	89%	0.891	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-97.3	116.8	163.6	-79.8	-174.2	175.4	-178.6	0	108.9	T70	T70-K72 PolarHBondContact O-N 3.47Å
73	K	36.1	Very low	35.4	Very low	207 Å²	207	173.4 Å²	173.4	90%	0.9	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-57.8	135.6	176.4	-91	175.7	168.8	177.2	0	111.4
74	K	33.3	Very low	35.3	Very low	195 Å²	195	169.6 Å²	169.6	85%	0.848	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-68	134.1	165	-72.2	178.4	172.8	-178.1	0	110.3
75	P	42.6	Very low	35.2	Very low	127 Å²	127	170.7 Å²	170.7	83%	0.825	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-89	122.4	157.5	21.3	-6.6	0	0	0	109.5
76	N	33	Very low	34.9	Very low	167 Å²	167	170.5 Å²	170.5	89%	0.893	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-67.2	136.7	163.5	-79.4	-15.6	0	0	0	109
77	G	33.7	Very low	34.6	Very low	74 Å²	74	164.6 Å²	164.6	76%	0.763	85%	0.847	S	S	*	*			trans	-168	67.6	177.3	0	0	0	0	0	110.9	V79	G77-V79 PolarHBondContact O-N 3.44Å
78	D	33.8	Very low	34.4	Very low	166 Å²	166	166 Å²	166	89%	0.888	85%	0.849	S	S	*	*			trans	-67.3	111.5	163.2	-86.9	-42.6	0	0	0	109.5
79	V	37.3	Very low	34.3	Very low	118 Å²	118	163.1 Å²	163.1	72%	0.715	85%	0.846	S	S	*	*			trans	-145	97	148.9	-177.2	0	0	0	0	108.4	G77 K81	G77-V79 PolarHBondContact O-N 3.44Å; V79-K81 HydrophobicContact CG1-CG 4.17Å; V79-K81 PolarHBondContact O-N 3.28Å
80	R	30.3	Very low	34.6	Very low	249 Å²	249	158.9 Å²	158.9	94%	0.94	84%	0.84	S	S	*	*			trans	-57.1	117.7	157.7	-90.7	176.6	167.9	176.5	-3.8	108.6
81	K	35.1	Very low	34.5	Very low	179 Å²	179	160.4 Å²	160.4	78%	0.778	84%	0.843	S	S	*	*			trans	-127.8	117.2	155.1	-85.1	-176	179	179.8	0	109.3	V79 F83	V79-K81 HydrophobicContact CG1-CG 4.17Å; V79-K81 PolarHBondContact O-N 3.28Å; K81-F83 PolarHBondContact O-N 3.4Å
82	T	37.3	Very low	34.6	Very low	138 Å²	138	160 Å²	160	85%	0.847	84%	0.84	S	S	*	*			trans	-58.6	115.3	175.5	42.8	0	0	0	0	110.8	N84	T82-N84 PolarHBondContact O-N 2.82Å
83	F	32	Very low	34.4	Very low	202 Å²	202	155.3 Å²	155.3	89%	0.886	83%	0.834	S	S	*	*			trans	-80.2	107.3	167.3	-95	-93.5	0	0	0	108.7	K81	K81-F83 PolarHBondContact O-N 3.4Å
84	N	32.6	Very low	34.3	Very low	154 Å²	154	154.7 Å²	154.7	82%	0.824	83%	0.834	S	S	*	*			trans	-91	111.3	170.1	-146	-4.6	0	0	0	107.1	T82 K86	T82-N84 PolarHBondContact O-N 2.82Å; N84-K86 PolarHBondContact O-N 3.16Å
85	V	33.2	Very low	34.4	Very low	133 Å²	133	154.6 Å²	154.6	81%	0.806	83%	0.834	S	S	*	*			trans	-76.8	107.1	179.9	177.2	0	0	0	0	107.8
86	K	32.6	Very low	34.1	Very low	198 Å²	198	153.7 Å²	153.7	86%	0.861	83%	0.83	S	S	*	*			trans	-115.9	117.3	159.9	-92.3	-172	174	-175.5	0	108	N84	N84-K86 PolarHBondContact O-N 3.16Å
87	G	28.3	Very low	34.1	Very low	77 Å²	77	154.1 Å²	154.1	79%	0.794	83%	0.832	S	S	*	*			trans	-61.5	144	175.4	0	0	0	0	0	111.6
88	Q	31.7	Very low	33.9	Very low	194 Å²	194	157.7 Å²	157.7	91%	0.907	83%	0.833	S	S	*	*			trans	-135	112.9	159.5	-158.2	164.3	1.6	0	0	105.7
89	E	31.6	Very low	33.9	Very low	183 Å²	183	154.3 Å²	154.3	86%	0.855	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-63.6	161.6	178.5	-88	177.8	154.6	0	0	112.1
90	P	43.4	Very low	33.6	Very low	119 Å²	119	157.4 Å²	157.4	77%	0.773	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-93.4	124.6	-154.3	34.3	-28.8	0	0	0	112.1
91	D	34.3	Very low	33.9	Very low	161 Å²	161	150.1 Å²	150.1	86%	0.861	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-85.3	124.9	166.2	-81.3	-31	0	0	0	110.6
92	S	35.3	Very low	33.8	Very low	114 Å²	114	150.2 Å²	150.2	80%	0.797	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-51.4	131.6	167.1	42.3	0	0	0	0	112.3
93	S	34.8	Very low	33.7	Very low	107 Å²	107	152.7 Å²	152.7	75%	0.748	82%	0.82	S	S	*	*			trans	-148.5	105.3	148.2	50.2	0	0	0	0	109.8	K95	S93-K95 PolarHBondContact O-N 3.4Å
94	E	33.2	Very low	33.9	Very low	194 Å²	194	151.3 Å²	151.3	91%	0.907	81%	0.813	S	S	*	*			trans	-48.4	124.7	156.7	-68.6	167.2	132.7	0	0	109.4
95	K	36.2	Very low	33.8	Very low	193 Å²	193	148.4 Å²	148.4	84%	0.839	81%	0.811	S	S	*	*			trans	-130.9	98.6	155.6	-86.2	-174.8	176.9	175.3	0	108.3	S93	S93-K95 PolarHBondContact O-N 3.4Å
96	S	35.4	Very low	33.8	Very low	108 Å²	108	148.7 Å²	148.7	76%	0.755	81%	0.807	S	S	*	*			trans	-43.5	126.2	159.9	42.3	0	0	0	0	111.3
97	L	33.6	Very low	33.8	Very low	176 Å²	176	145.9 Å²	145.9	92%	0.921	81%	0.806	S	S	*	*			trans	-124	70.4	162.9	-100.7	159.1	0	0	0	105.8
98	D	30.4	Very low	34	Very low	149 Å²	149	148.3 Å²	148.3	80%	0.797	80%	0.8	S	S	*	*			trans	-104.9	147.9	164.4	-83.3	-39.7	0	0	0	108.5
99	A	33.7	Very low	34	Very low	94 Å²	94	147 Å²	147	78%	0.777	80%	0.8	S	S	*	*			trans	78.9	109.4	177.8	0	0	0	0	0	115.6
100	E	31.5	Very low	34.2	Very low	184 Å²	184	144.4 Å²	144.4	86%	0.86	80%	0.796	S	S	*	*				-167	125.8	105.2	-105	-165.7	137.2	0	0	113.5
101	V	34.8	Very low	33.7	Very low	96 Å²	96	145.6 Å²	145.6	58%	0.582	80%	0.796	S	S	*	*			trans	84.5	72.3	140	-169.7	0	0	0	0	116.9	K103	V101-K103 HydrophobicContact CG1-CB 4.31Å; V101-K103 HydrophobicContact CG1-CD 4.17Å; V101-K103 HydrophobicContact CG1-CG 3.73Å; V101-K103 PolarHBondContact O-N 3.02Å; V101-K103 VanDerWaalsContact O-N 3.16Å
102	E	33.8	Very low	33.7	Very low	181 Å²	181	144.3 Å²	144.3	85%	0.846	79%	0.794	S	S	*	*			trans	-64.8	94.5	146.3	-144.9	179.1	-151.7	0	0	108.7	K104	E102-K104 PolarHBondContact O-N 3.12Å; E102-K104 VanDerWaalsContact O-N 3.16Å
103	K	35.2	Very low	33.6	Very low	190 Å²	190	147.2 Å²	147.2	83%	0.826	79%	0.792	S	S	*	*			trans	-80.1	93.7	173.6	-107.5	175.1	-177.3	178.2	0	109.5	V101 A105	V101-K103 HydrophobicContact CG1-CB 4.31Å; V101-K103 HydrophobicContact CG1-CD 4.17Å; V101-K103 HydrophobicContact CG1-CG 3.73Å; V101-K103 PolarHBondContact O-N 3.02Å; V101-K103 VanDerWaalsContact O-N 3.16Å; K103-A105 PolarHBondContact O-N 3.45Å
104	K	35.6	Very low	33.5	Very low	172 Å²	172	150.6 Å²	150.6	75%	0.748	80%	0.796	S	S	*	*			trans	-57	108.8	163.6	-71	177.1	176.4	177.6	0	109.8	E102 I106	E102-K104 PolarHBondContact O-N 3.12Å; E102-K104 VanDerWaalsContact O-N 3.16Å; K104-I106 PolarHBondContact O-N 2.93Å
105	A	31.7	Very low	33.4	Very low	94 Å²	94	150.2 Å²	150.2	78%	0.777	79%	0.794	S	S	*	*			trans	-87	95.5	161.2	0	0	0	0	0	107.8	K103 V107	K103-A105 PolarHBondContact O-N 3.45Å; A105-V107 PolarHBondContact O-N 3.1Å
106	I	32	Very low	33.2	Very low	139 Å²	139	146.7 Å²	146.7	71%	0.713	79%	0.79	S	S	*	*			trans	-71.2	110.1	164.7	-63.2	166.8	0	0	0	105.9	K104	K104-I106 PolarHBondContact O-N 2.93Å
107	V	32.4	Very low	33	Very low	139 Å²	139	150 Å²	150	84%	0.842	79%	0.793	S	S	*	*			trans	-115	107.9	163.2	178.7	0	0	0	0	106.9	A105	A105-V107 PolarHBondContact O-N 3.1Å
108	N	33.8	Very low	33	Very low	127 Å²	127	148.2 Å²	148.2	68%	0.679	79%	0.785	S	S	*	*			trans	-36.6	133.1	-174.7	-63	-32.5	0	0	0	116.9	V110	N108-V110 PolarHBondContact O-N 3.34Å
109	D	32	Very low	33.1	Very low	168 Å²	168	147.4 Å²	147.4	90%	0.898	78%	0.784	S	S	*	*			trans	-48.3	112.9	152.3	-79.7	-43.8	0	0	0	110.5	N111	D109-N111 PolarHBondContact O-N 2.98Å
110	V	35.4	Very low	33.1	Very low	128 Å²	128	152.2 Å²	152.2	78%	0.776	79%	0.791	S	S	*	*			trans	-88.6	89.2	164.2	177.4	0	0	0	0	107.5	N108 T112	N108-V110 PolarHBondContact O-N 3.34Å; V110-T112 PolarHBondContact O-N 3.28Å
111	N	32.5	Very low	33	Very low	144 Å²	144	148 Å²	148	77%	0.77	78%	0.782	S	S	*	*			trans	-3.7	85.2	145.3	-136.9	5	0	0	0	115.3	D109 K113	D109-N111 PolarHBondContact O-N 2.98Å; N111-K113 PolarHBondContact O-N 3.46Å
112	T	34.9	Very low	32.7	Very low	133 Å²	133	150.2 Å²	150.2	82%	0.816	79%	0.79	S	S	*	*			trans	-79.5	98.8	161.1	42.2	0	0	0	0	107.9	V110 E114	V110-T112 PolarHBondContact O-N 3.28Å; T112-E114 PolarHBondContact O-N 3.44Å
113	K	32	Very low	32.7	Very low	176 Å²	176	149.7 Å²	149.7	77%	0.765	79%	0.787	S	S	*	*			trans	-57	120.7	165.5	-80.7	177.7	170.6	-177.5	0	109.1	N111 E115	N111-K113 PolarHBondContact O-N 3.46Å; K113-E115 PolarHBondContact O-N 3.26Å
114	E	32.7	Very low	32.5	Very low	178 Å²	178	150.4 Å²	150.4	83%	0.832	79%	0.793	S	S	*	*			trans	-61.9	104.6	158.2	-72	171.7	140.9	0	0	108.2	T112	T112-E114 PolarHBondContact O-N 3.44Å
115	E	32.7	Very low	32.1	Very low	185 Å²	185	152.9 Å²	152.9	86%	0.864	80%	0.798	S	S	*	*			trans	-87.3	104.7	158.1	-79.1	179.1	176.3	0	0	106.9	K113	K113-E115 PolarHBondContact O-N 3.26Å
116	T	31.6	Very low	32.1	Very low	120 Å²	120	156.5 Å²	156.5	74%	0.736	80%	0.799	S	S	*	*			trans	-104.9	107.1	170.6	29.6	0	0	0	0	105.9
117	E	31.3	Very low	32.2	Very low	177 Å²	177	157.1 Å²	157.1	83%	0.827	81%	0.809	S	S	*	*			trans	-176.8	128	172.7	-100.3	164.8	-152	0	0	103.6
118	D	32.7	Very low	32	Very low	139 Å²	139	155 Å²	155	74%	0.743	81%	0.806	S	S	*	*			cis	-150.5	139.8	7.6	-88	-48	0	0	0	109.2	E120	D118-E120 PolarHBondContact O-N 3.41Å
119	V	32.4	Very low	31.9	Very low	131 Å²	131	158.1 Å²	158.1	79%	0.794	82%	0.817	S	S	*	*			trans	-79.5	93.9	170	174.6	0	0	0	0	107.2	S121	V119-S121 VanDerWaalsContact C-N 3.27Å; V119-S121 PolarHBondContact O-N 3.48Å; V119-S121 VanDerWaalsContact O-N 3.08Å
120	E	33.5	Very low	31.7	Very low	196 Å²	196	154.8 Å²	154.8	92%	0.916	81%	0.813	S	S	*	*			trans	-79.3	83.4	162.5	-85.4	-172.5	157.4	0	0	109.2	D118	D118-E120 PolarHBondContact O-N 3.41Å
121	S	29.5	Very low	31.6	Very low	95 Å²	95	153.8 Å²	153.8	66%	0.664	82%	0.818	S	S	*	*			trans	-79.6	110.5	156.5	53.8	0	0	0	0	108.6	V119	V119-S121 VanDerWaalsContact C-N 3.27Å; V119-S121 PolarHBondContact O-N 3.48Å; V119-S121 VanDerWaalsContact O-N 3.08Å
122	L	30	Very low	31.5	Very low	143 Å²	143	153 Å²	153	75%	0.749	82%	0.818	S	S	*	*			trans	-145	110.9	162.9	-132.5	111.5	0	0	0	111.4
123	E	33.4	Very low	31.3	Very low	169 Å²	169	154 Å²	154	79%	0.79	82%	0.819	S	S	*	*			trans	69.4	75.8	141.7	-65.8	174.6	-174.3	0	0	119
124	E	30.4	Very low	31.2	Very low	206 Å²	206	151.7 Å²	151.7	96%	0.963	83%	0.825	S	S	*	*			trans	-100.8	87.4	143.2	-77.6	-174.2	163.8	0	0	109
125	R	28	Very low	31.1	Very low	224 Å²	224	147 Å²	147	85%	0.845	82%	0.816	S	S	*	*			trans	-152.1	135.1	163.4	-142.9	-178.2	177.7	146.3	-0.5	110.5
126	E	31.2	Very low	31.1	Very low	170 Å²	170	146.6 Å²	146.6	79%	0.794	81%	0.814	S	S	*	*			trans	80.2	96.6	167.3	-58	-176.3	170.1	0	0	117.5
127	T	34.9	Very low	31	Very low	151 Å²	151	149.2 Å²	149.2	93%	0.926	82%	0.824	S	S	*	*				-158.1	84.3	114.6	50.5	0	0	0	0	108.8
128	A	27.6	Very low	31	Very low	94 Å²	94	148.2 Å²	148.2	78%	0.777	82%	0.822	S	S	*	*			trans	-107.9	115.2	151.8	0	0	0	0	0	105.4
129	E	30.7	Very low	30.9	Very low	194 Å²	194	148.2 Å²	148.2	91%	0.907	83%	0.827	S	S	*	*			trans	157	141.6	138.7	-87.2	178.1	178.2	0	0	112.6
130	A	28.9	Very low	31	Very low	98 Å²	98	146.1 Å²	146.1	81%	0.81	82%	0.824	S	S	*	*			trans	76.4	96.3	155.5	0	0	0	0	0	119.1
131	A	33.1	Very low	31.1	Very low	107 Å²	107	141.5 Å²	141.5	88%	0.884	82%	0.819	S	S	*	*				-165.8	72.5	126.7	0	0	0	0	0	110.4
132	T	29.6	Very low	31.2	Very low	126 Å²	126	143.9 Å²	143.9	77%	0.773	82%	0.824	S	S	*	*			trans	-76.8	149.6	148.9	36.3	0	0	0	0	109.2
133	D	30.7	Very low	31.4	Very low	156 Å²	156	144.3 Å²	144.3	83%	0.834	83%	0.827	S	S	*	*			trans	81.6	95.6	162.9	-55.1	-23	0	0	0	119.1
134	S	31.2	Very low	31.5	Very low	127 Å²	127	141.4 Å²	141.4	89%	0.888	83%	0.832	S	S	*	*			trans	-150.3	98.5	132.2	-168.5	0	0	0	0	109.8
135	A	30.7	Very low	31.6	Very low	79 Å²	79	138.7 Å²	138.7	65%	0.653	83%	0.825	S	S	*	*			trans	-74.4	146.1	168.9	0	0	0	0	0	110.8
136	Q	31.3	Very low	31.9	Very low	177 Å²	177	134.9 Å²	134.9	83%	0.827	82%	0.821	S	S	*	*			trans	41.4	108.5	141.8	-72.7	168.1	-27.2	0	0	118.1
137	N	31.1	Very low	32.2	Very low	175 Å²	175	134 Å²	134	94%	0.936	82%	0.822	S	S	*	*			trans	-138.7	123.7	139.3	-99.5	-30.2	0	0	0	110.9
138	I	29.7	Very low	32.3	Very low	155 Å²	155	134 Å²	134	80%	0.795	81%	0.814	S	S	*	*			trans	-76.4	131.3	172.6	-66	159.7	0	0	0	108
139	V	31.8	Very low	32.8	Very low	139 Å²	139	138.2 Å²	138.2	84%	0.842	82%	0.818	S	S	*	*			trans	-149.6	115.9	140.7	177.9	0	0	0	0	108.6
140	A	33.2	Very low	33.3	Very low	88 Å²	88	138.6 Å²	138.6	73%	0.727	82%	0.817	S	S	*	*			trans	-73.8	137.8	160.1	0	0	0	0	0	109.6
141	A	35.5	Very low	33.6	Very low	99 Å²	99	142.8 Å²	142.8	82%	0.818	82%	0.817	S	S	*	*			trans	-149.4	109.6	157.6	0	0	0	0	0	108.3
142	D	31.7	Very low	33.8	Very low	145 Å²	145	141 Å²	141	78%	0.775	81%	0.809	S	S	*	*			trans	-65.1	161.3	170.2	-78	-43.8	0	0	0	112.6
143	D	34.2	Very low	34.5	Very low	151 Å²	151	139.9 Å²	139.9	81%	0.807	81%	0.812	S	S	*	*			trans	61.9	93.6	147.6	-64.2	-20.7	0	0	0	119.7
144	A	35.8	Very low	35.2	Very low	108 Å²	108	138.5 Å²	138.5	89%	0.893	81%	0.809	S	S	*	*			trans	-140.1	80.6	141.3	0	0	0	0	0	108.6
145	N	33.1	Very low	36.3	Very low	150 Å²	150	136.2 Å²	136.2	80%	0.802	79%	0.79	S	S	*	*			trans	-77.4	111.5	160.1	-158.6	30.3	0	0	0	105.6
146	D	34.8	Very low	37.3	Very low	144 Å²	144	135.4 Å²	135.4	77%	0.77	78%	0.778	S	S	*	*			trans	-175.5	118.2	153.5	-89.9	-20.1	0	0	0	110.3
147	D	36.8	Very low	38.6	Very low	151 Å²	151	131.4 Å²	131.4	81%	0.807	77%	0.77	S	S	*	*			trans	48	82.4	150.3	-64	-19.5	0	0	0	119.7
148	I	36.9	Very low	39.9	Very low	150 Å²	150	130.4 Å²	130.4	77%	0.769	76%	0.759	S	S	*	*			trans	-124.9	63	150.5	-50	178.7	0	0	0	108.9
149	E	37.9	Very low	41	Very low	184 Å²	184	126 Å²	126	86%	0.86	74%	0.737	S	S	*	*			trans	-85	128.3	152.3	-80.8	-167.7	157.7	0	0	108.4
150	K	41.1	Very low	42.2	Very low	202 Å²	202	124 Å²	124	88%	0.878	72%	0.719	S	S	*	*			trans	88	47.4	175.4	-55.3	-179.5	177	173.3	0	118.9
151	K	36.7	Very low	43.5	Very low	186 Å²	186	126.2 Å²	126.2	81%	0.809	71%	0.714	S	S	*	*			trans	-118.4	110.4	142.5	-77	-174.6	178.7	176.4	0	108.9	A153	K151-A153 PolarHBondContact O-N 3.49Å
152	G	37.3	Very low	44.5	Very low	70 Å²	70	124.1 Å²	124.1	72%	0.722	70%	0.697	S	S	*	*			trans	-50.2	124.4	176.7	0	0	0	0	0	109.4	T154	G152-T154 PolarHBondContact O-N 2.91Å
153	A	43.7	Very low	45.7	Very low	101 Å²	101	117.9 Å²	117.9	84%	0.835	67%	0.665	S	S	*	*			trans	-68.6	82.4	176.8	0	0	0	0	0	108.8	K151 V155	K151-A153 PolarHBondContact O-N 3.49Å; A153-V155 PolarHBondContact O-N 3.04Å
154	T	44.4	Very low	47.2	Very low	128 Å²	128	114.3 Å²	114.3	79%	0.785	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-65.7	117.4	162.7	27.3	0	0	0	0	107.6	G152	G152-T154 PolarHBondContact O-N 2.91Å
155	V	54.5	Low	48.6	Very low	78 Å²	78	112 Å²	112	47%	0.473	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-47.4	122.9	171.7	179	0	0	0	0	108.2	A153 S157	A153-V155 PolarHBondContact O-N 3.04Å; V155-S157 PolarHBondContact O-N 3.07Å
156	P	51.9	Low	49.7	Very low	62 Å²	62	108 Å²	108	40%	0.403	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-57.2	125.4	179.1	-24.3	33.3	0	0	0	109.8	E158 I159	P156-E158 PolarHBondContact O-N 3.43Å; P156-I159 HydrophobicContact CG-CD1 4.42Å; P156-I159 PolarHBondContact O-N 3.47Å
157	S	59	Low	51	Low	94 Å²	94	101.8 Å²	101.8	66%	0.657	57%	0.569	S	S	*	*	H	α-helix	trans	-52.5	-25.8	-178.7	46	0	0	0	0	113.4	V155 I159 M160 H161	V155-S157 PolarHBondContact O-N 3.07Å; S157-I159 VanDerWaalsContact C-N 3.27Å; S157-I159 PolarHBondContact O-N 3.29Å; S157-M160 PolarHBondContact O-N 3.02Å; S157-H161 PolarHBondContact O-N 3.15Å
158	E	58.4	Low	52.2	Low	154 Å²	154	102.6 Å²	102.6	72%	0.72	57%	0.568	S	S	*	*	H	α-helix	trans	-60.1	-32	175.8	-66.5	163.4	177.8	0	0	113.1	P156 A162	P156-E158 PolarHBondContact O-N 3.43Å; E158-A162 WeakPolarHBondContact O-CB 3.41Å; E158-A162 PolarHBondContact O-N 2.87Å
159	I	53.5	Low	53.1	Low	63 Å²	63	99.9 Å²	99.9	32%	0.323	56%	0.558	S	S	.	*	H	α-helix	trans	-76.6	-41	179.6	-58.7	175.3	0	0	0	111	P156 S157 H161 A162 A163 W193	P156-I159 HydrophobicContact CG-CD1 4.42Å; P156-I159 PolarHBondContact O-N 3.47Å; S157-I159 VanDerWaalsContact C-N 3.27Å; S157-I159 PolarHBondContact O-N 3.29Å; I159-H161 PolarHBondContact O-N 3.27Å; I159-A162 PolarHBondContact O-N 3.13Å; I159-A163 VanDerWaalsContact O-CB 3.28Å; I159-A163 WeakPolarHBondContact O-CB 3.47Å; I159-A163 PolarHBondContact O-N 3.3Å; I159-W193 HydrophobicContact CD1-CH2 3.62Å; I159-W193 HydrophobicContact CD1-CZ3 3.64Å
160	M	56.4	Low	53.8	Low	96 Å²	96	93.2 Å²	93.2	47%	0.473	53%	0.528	S	S	.	.	H	α-helix	trans	-61	-41.1	173.2	-73.9	-109.6	74.1	0	0	109.9	S157 A162 A163 D164	S157-M160 PolarHBondContact O-N 3.02Å; M160-A162 PolarHBondContact O-N 3.08Å; M160-A163 WeakPolarHBondContact O-CB 3.41Å; M160-A163 PolarHBondContact O-N 3.4Å; M160-D164 WeakPolarHBondContact O-CB 3.42Å; M160-D164 PolarHBondContact O-N 3.01Å
161	H	60	Low	54.6	Low	135 Å²	135	88.8 Å²	88.8	63%	0.625	52%	0.52	S	S	*	.	H	α-helix	trans	-65.2	-40.3	177.8	-144.3	-44	0	0	0	112.9	S157 I159 S165	S157-H161 PolarHBondContact O-N 3.15Å; I159-H161 PolarHBondContact O-N 3.27Å; H161-S165 PolarHBondContact O-N 3.36Å; H161-S165 PolarHBondContact O-OG 3.12Å; H161-S165 VanDerWaalsContact O-OG 3.13Å
162	A	57.1	Low	55.9	Low	55 Å²	55	84 Å²	84	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-67.7	-36.6	175	0	0	0	0	0	112.5	E158 I159 M160 L166	E158-A162 WeakPolarHBondContact O-CB 3.41Å; E158-A162 PolarHBondContact O-N 2.87Å; I159-A162 PolarHBondContact O-N 3.13Å; M160-A162 PolarHBondContact O-N 3.08Å; A162-L166 PolarHBondContact O-N 3.21Å
163	A	56.6	Low	57.5	Low	13 Å²	13	88.1 Å²	88.1	11%	0.107	50%	0.501	C	S	.	.	H	α-helix	trans	-66	-44.2	175.6	0	0	0	0	0	111.9	I159 M160 L166 I167 M183	I159-A163 VanDerWaalsContact O-CB 3.28Å; I159-A163 WeakPolarHBondContact O-CB 3.47Å; I159-A163 PolarHBondContact O-N 3.3Å; M160-A163 WeakPolarHBondContact O-CB 3.41Å; M160-A163 PolarHBondContact O-N 3.4Å; A163-L166 WeakPolarHBondContact O-CB 3.37Å; A163-L166 PolarHBondContact O-N 3.25Å; A163-L166 VanDerWaalsContact O-N 3.14Å; A163-I167 WeakPolarHBondContact O-CG1 3.48Å; A163-I167 PolarHBondContact O-N 2.93Å; A163-M183 HydrophobicContact CB-CE 3.94Å; A163-M183 HydrophobicContact CB-SD 3.61Å
164	D	66.1	Low	58.2	Low	77 Å²	77	87.6 Å²	87.6	41%	0.412	49%	0.487	S	S	.	.	H	α-helix	trans	-64.4	-41.1	176.3	-71.9	-26	0	0	0	111	M160 L166 I167 E168	M160-D164 WeakPolarHBondContact O-CB 3.42Å; M160-D164 PolarHBondContact O-N 3.01Å; D164-L166 VanDerWaalsContact C-N 3.28Å; D164-L166 PolarHBondContact O-N 3.3Å; D164-I167 PolarHBondContact O-N 2.94Å; D164-E168 PolarHBondContact O-N 3.38Å
165	S	64.3	Low	58.9	Low	58 Å²	58	84.4 Å²	84.4	41%	0.406	47%	0.467	S	S	.	.	H	α-helix	trans	-63	-31	172.6	-65.7	0	0	0	0	113.4	H161 V169	H161-S165 PolarHBondContact O-N 3.36Å; H161-S165 PolarHBondContact O-OG 3.12Å; H161-S165 VanDerWaalsContact O-OG 3.13Å; S165-V169 VanDerWaalsContact O-CG2 3.32Å; S165-V169 WeakPolarHBondContact O-CG2 3.45Å
166	L	56.1	Low	59.4	Low	68 Å²	68	83.1 Å²	83.1	36%	0.356	46%	0.456	S	S	.	.	H	α-helix	trans	-71.8	-39.8	173.9	-96.1	158.9	0	0	0	112	A162 A163 D164 V169	A162-L166 PolarHBondContact O-N 3.21Å; A163-L166 WeakPolarHBondContact O-CB 3.37Å; A163-L166 PolarHBondContact O-N 3.25Å; A163-L166 VanDerWaalsContact O-N 3.14Å; D164-L166 VanDerWaalsContact C-N 3.28Å; D164-L166 PolarHBondContact O-N 3.3Å; L166-V169 PolarHBondContact O-N 3.27Å
167	I	62.2	Low	60.3	Low	13 Å²	13	86.2 Å²	86.2	7%	0.067	47%	0.465	C	S	.	.	H	α-helix	trans	-62.3	-44.4	176.3	-77.4	177.4	0	0	0	110.8	A163 D164 V169 L170 E176 M183	A163-I167 WeakPolarHBondContact O-CG1 3.48Å; A163-I167 PolarHBondContact O-N 2.93Å; D164-I167 PolarHBondContact O-N 2.94Å; I167-V169 PolarHBondContact O-N 3.42Å; I167-V169 VanDerWaalsContact O-N 3.09Å; I167-L170 PolarHBondContact O-N 3.37Å; I167-E176 HydrophobicContact CG2-CG 3.65Å; I167-M183 HydrophobicContact CD1-CE 3.41Å; I167-M183 VanDerWaalsContact CD1-CE 3.41Å; I167-M183 HydrophobicContact CG1-CE 4.14Å
168	E	61.7	Low	60.6	Low	168 Å²	168	87.3 Å²	87.3	79%	0.785	46%	0.463	S	S	*	.	H	α-helix	trans	-62.9	-20.6	-175.7	-144.4	174.3	-162.2	0	0	113.2	D164	D164-E168 PolarHBondContact O-N 3.38Å
169	V	57.4	Low	61	Low	93 Å²	93	81.5 Å²	81.5	56%	0.564	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-8	-179.7	-178.1	0	0	0	0	112.4	S165 L166 I167	S165-V169 VanDerWaalsContact O-CG2 3.32Å; S165-V169 WeakPolarHBondContact O-CG2 3.45Å; L166-V169 PolarHBondContact O-N 3.27Å; I167-V169 PolarHBondContact O-N 3.42Å; I167-V169 VanDerWaalsContact O-N 3.09Å
170	L	51.1	Low	61.9	Low	43 Å²	43	83.9 Å²	83.9	23%	0.225	44%	0.442	C	S	.	.			trans	-90	122.1	-175.7	-69.9	169.4	0	0	0	111.7	I167 N172 L179	I167-L170 PolarHBondContact O-N 3.37Å; L170-N172 VanDerWaalsContact C-N 3.33Å; L170-N172 PolarHBondContact O-N 3.29Å; L170-L179 HydrophobicContact CD1-CD1 4.01Å; L170-L179 HydrophobicContact CD1-CD2 4.39Å
171	P	58.5	Low	62.6	Low	110 Å²	110	84.3 Å²	84.3	71%	0.714	45%	0.446	S	S	*	.			trans	-80.5	-2.9	-168.6	29.7	-35.2	0	0	0	115.5
172	N	64.7	Low	63	Low	86 Å²	86	82.4 Å²	82.4	46%	0.46	43%	0.434	S	S	.	.			trans	-131.7	123.4	-171.4	-175.1	-1.6	0	0	0	111.8	L170 V174 T175 E176	L170-N172 VanDerWaalsContact C-N 3.33Å; L170-N172 PolarHBondContact O-N 3.29Å; N172-V174 PolarHBondContact O-N 3.04Å; N172-V174 PolarHBondContact OD1-N 3.31Å; N172-T175 WeakPolarHBondContact CB-OG1 3.48Å; N172-T175 PolarHBondContact O-N 2.86Å; N172-T175 VanDerWaalsContact O-N 3.15Å; N172-T175 PolarHBondContact O-OG1 3Å; N172-E176 PolarHBondContact O-N 2.76Å
173	K	70.2	Confident	63.5	Low	156 Å²	156	81.6 Å²	81.6	68%	0.678	42%	0.421	S	S	*	.	H	α-helix	trans	-54.4	-35.7	-179.5	-83.3	-171.4	172.7	-172.4	0	113.7	E176 E177	K173-E176 VanDerWaalsContact O-CB 3.29Å; K173-E176 WeakPolarHBondContact O-CB 3.35Å; K173-E176 PolarHBondContact O-N 3.22Å; K173-E177 PolarHBondContact O-N 2.95Å
174	V	57.3	Low	64.2	Low	89 Å²	89	84.8 Å²	84.8	54%	0.539	44%	0.439	S	S	.	.	H	α-helix	trans	-67.8	-41.5	-178.4	179.8	0	0	0	0	110.8	N172 E176 L178	N172-V174 PolarHBondContact O-N 3.04Å; N172-V174 PolarHBondContact OD1-N 3.31Å; V174-E176 VanDerWaalsContact C-N 3.3Å; V174-L178 HydrophobicContact CG1-CD1 4.27Å; V174-L178 PolarHBondContact O-N 3.33Å; V174-L178 VanDerWaalsContact O-N 3.15Å
175	T	60.5	Low	64.3	Low	61 Å²	61	86.2 Å²	86.2	37%	0.374	45%	0.447	S	S	.	.	H	α-helix	trans	-68.1	-36	175.6	-17.9	0	0	0	0	110.8	N172 L179	N172-T175 WeakPolarHBondContact CB-OG1 3.48Å; N172-T175 PolarHBondContact O-N 2.86Å; N172-T175 VanDerWaalsContact O-N 3.15Å; N172-T175 PolarHBondContact O-OG1 3Å; T175-L179 WeakPolarHBondContact O-CB 3.44Å; T175-L179 PolarHBondContact O-N 3.08Å
176	E	63.8	Low	64.1	Low	52 Å²	52	84.4 Å²	84.4	24%	0.243	43%	0.432	C	S	.	.	H	α-helix	trans	-60.6	-50.8	175.8	-155	-161.5	140.8	0	0	112	I167 N172 K173 V174 L179 R180	I167-E176 HydrophobicContact CG2-CG 3.65Å; N172-E176 PolarHBondContact O-N 2.76Å; K173-E176 VanDerWaalsContact O-CB 3.29Å; K173-E176 WeakPolarHBondContact O-CB 3.35Å; K173-E176 PolarHBondContact O-N 3.22Å; V174-E176 VanDerWaalsContact C-N 3.3Å; E176-L179 PolarHBondContact O-N 3.18Å; E176-R180 VanDerWaalsContact O-CB 3.28Å; E176-R180 WeakPolarHBondContact O-CB 3.42Å; E176-R180 PolarHBondContact O-N 3.31Å; E176-R180 IonicContact OE1-CZ 3.74Å; E176-R180 IonicContact OE1-NE 3.98Å; E176-R180 IonicContact OE1-NH2 2.72Å; E176-R180 PolarHBondContact OE1-NH2 2.97Å
177	E	70.9	Confident	64.4	Low	126 Å²	126	85 Å²	85	59%	0.589	44%	0.439	S	S	*	.	H	α-helix	trans	-62.7	-45.5	178.8	-77.2	177.8	177.4	0	0	111.7	K173 L179 R180 D181	K173-E177 PolarHBondContact O-N 2.95Å; E177-L179 VanDerWaalsContact C-N 3.34Å; E177-L179 PolarHBondContact O-N 3.31Å; E177-R180 PolarHBondContact O-N 3.41Å; E177-D181 WeakPolarHBondContact O-CB 3.49Å; E177-D181 PolarHBondContact O-N 3.38Å
178	L	66.2	Low	64.6	Low	118 Å²	118	89.2 Å²	89.2	62%	0.618	46%	0.461	S	S	*	.	H	α-helix	trans	-60.7	-41.6	176.2	-84.8	162.6	0	0	0	112.4	V174 W182	V174-L178 HydrophobicContact CG1-CD1 4.27Å; V174-L178 PolarHBondContact O-N 3.33Å; V174-L178 VanDerWaalsContact O-N 3.15Å; L178-W182 WeakPolarHBondContact O-CB 3.48Å; L178-W182 PolarHBondContact O-N 2.93Å
179	L	67	Low	64.9	Low	31 Å²	31	87.5 Å²	87.5	16%	0.162	47%	0.468	C	S	.	.	H	α-helix	trans	-68.1	-40.9	176.9	-125.6	111.5	0	0	0	111	L170 T175 E176 E177 W182 M183	L170-L179 HydrophobicContact CD1-CD1 4.01Å; L170-L179 HydrophobicContact CD1-CD2 4.39Å; T175-L179 WeakPolarHBondContact O-CB 3.44Å; T175-L179 PolarHBondContact O-N 3.08Å; E176-L179 PolarHBondContact O-N 3.18Å; E177-L179 VanDerWaalsContact C-N 3.34Å; E177-L179 PolarHBondContact O-N 3.31Å; L179-W182 PolarHBondContact O-N 2.83Å; L179-M183 HydrophobicContact CD2-SD 4.44Å; L179-M183 WeakPolarHBondContact O-CB 3.42Å; L179-M183 VanDerWaalsContact O-CG 3.25Å; L179-M183 WeakPolarHBondContact O-CG 3.43Å; L179-M183 PolarHBondContact O-N 2.89Å
180	R	71.1	Confident	65.7	Low	113 Å²	113	88.2 Å²	88.2	43%	0.426	48%	0.477	S	S	.	.	H	α-helix	trans	-62.4	-49.7	179.4	-162	-177.9	-70.6	-98.7	5.6	110.7	E176 E177 W182 M183 T184	E176-R180 VanDerWaalsContact O-CB 3.28Å; E176-R180 WeakPolarHBondContact O-CB 3.42Å; E176-R180 PolarHBondContact O-N 3.31Å; E176-R180 IonicContact OE1-CZ 3.74Å; E176-R180 IonicContact OE1-NE 3.98Å; E176-R180 IonicContact OE1-NH2 2.72Å; E176-R180 PolarHBondContact OE1-NH2 2.97Å; E177-R180 PolarHBondContact O-N 3.41Å; R180-W182 VanDerWaalsContact C-N 3.31Å; R180-W182 PolarHBondContact O-N 2.97Å; R180-M183 PolarHBondContact O-N 3.41Å; R180-T184 PolarHBondContact O-N 3.22Å; R180-T184 PolarHBondContact O-OG1 2.9Å
181	D	71.1	Confident	66.8	Low	105 Å²	105	87.9 Å²	87.9	56%	0.561	48%	0.478	S	S	*	.	H	α-helix	trans	-58.7	-43.2	175.1	-89.4	6.3	0	0	0	111.8	E177 T184 N185	E177-D181 WeakPolarHBondContact O-CB 3.49Å; E177-D181 PolarHBondContact O-N 3.38Å; D181-T184 VanDerWaalsContact C-OG1 3.26Å; D181-T184 VanDerWaalsContact CA-OG1 3.24Å; D181-T184 WeakPolarHBondContact CA-OG1 3.48Å; D181-T184 PolarHBondContact O-N 3.47Å; D181-T184 PolarHBondContact O-OG1 3.42Å; D181-N185 VanDerWaalsContact O-CG 3.31Å; D181-N185 PolarHBondContact O-N 3.36Å; D181-N185 VanDerWaalsContact O-N 3.07Å; D181-N185 PolarHBondContact O-ND2 3.39Å; D181-N185 VanDerWaalsContact O-ND2 3.17Å
182	W	68.5	Low	68	Low	96 Å²	96	85.8 Å²	85.8	36%	0.364	47%	0.466	S	S	.	.	H	α-helix	trans	-67.5	-37.1	178.4	-171.9	81.8	0	0	0	112.6	L178 L179 R180 N185 M186 R199 V203	L178-W182 WeakPolarHBondContact O-CB 3.48Å; L178-W182 PolarHBondContact O-N 2.93Å; L179-W182 PolarHBondContact O-N 2.83Å; R180-W182 VanDerWaalsContact C-N 3.31Å; R180-W182 PolarHBondContact O-N 2.97Å; W182-N185 PolarHBondContact O-N 2.87Å; W182-M186 HydrophobicContact CD2-CG 4.37Å; W182-M186 HydrophobicContact CE3-CE 4.03Å; W182-M186 HydrophobicContact CE3-CG 4.23Å; W182-M186 HydrophobicContact CE3-SD 4.41Å; W182-M186 HydrophobicContact CH2-CE 3.55Å; W182-M186 HydrophobicContact CH2-CG 4.42Å; W182-M186 HydrophobicContact CH2-SD 3.64Å; W182-M186 HydrophobicContact CZ2-CE 4.45Å; W182-M186 HydrophobicContact CZ2-SD 3.99Å; W182-M186 HydrophobicContact CZ3-CE 3.26Å; W182-M186 HydrophobicContact CZ3-CG 4.24Å; W182-M186 HydrophobicContact CZ3-SD 3.85Å; W182-M186 WeakPolarHBondContact O-CG 3.45Å; W182-M186 PolarHBondContact O-N 2.96Å; W182-M186 VanDerWaalsContact O-N 3.12Å; W182-R199 HydrophobicContact CH2-CB 3.89Å; W182-R199 HydrophobicContact CH2-CG 4.5Å; W182-R199 HydrophobicContact CZ2-CB 4.31Å; W182-R199 HydrophobicContact CZ2-CG 4.43Å; W182-V203 HydrophobicContact CE3-CG2 4.34Å; W182-V203 HydrophobicContact CH2-CG2 3.5Å; W182-V203 HydrophobicContact CZ3-CG2 3.36Å
183	M	68.1	Low	68.5	Low	37 Å²	37	89.4 Å²	89.4	18%	0.182	47%	0.474	C	S	.	.	H	α-helix	trans	-69.9	-39.5	175.3	-74.1	-165.7	-43.4	0	0	112.5	A163 I167 L179 R180 N185 M186 T187	A163-M183 HydrophobicContact CB-CE 3.94Å; A163-M183 HydrophobicContact CB-SD 3.61Å; I167-M183 HydrophobicContact CD1-CE 3.41Å; I167-M183 VanDerWaalsContact CD1-CE 3.41Å; I167-M183 HydrophobicContact CG1-CE 4.14Å; L179-M183 HydrophobicContact CD2-SD 4.44Å; L179-M183 WeakPolarHBondContact O-CB 3.42Å; L179-M183 VanDerWaalsContact O-CG 3.25Å; L179-M183 WeakPolarHBondContact O-CG 3.43Å; L179-M183 PolarHBondContact O-N 2.89Å; R180-M183 PolarHBondContact O-N 3.41Å; M183-N185 PolarHBondContact O-N 2.76Å; M183-M186 WeakPolarHBondContact O-CA 3.43Å; M183-M186 WeakPolarHBondContact O-CB 3.39Å; M183-M186 PolarHBondContact O-N 2.94Å; M183-T187 PolarHBondContact O-N 2.97Å
184	T	72.1	Confident	68.9	Low	81 Å²	81	89.1 Å²	89.1	50%	0.497	47%	0.472	S	S	.	.	H	α-helix	trans	-60	-38	171.8	33.5	0	0	0	0	111.6	R180 D181 M186 T187	R180-T184 PolarHBondContact O-N 3.22Å; R180-T184 PolarHBondContact O-OG1 2.9Å; D181-T184 VanDerWaalsContact C-OG1 3.26Å; D181-T184 VanDerWaalsContact CA-OG1 3.24Å; D181-T184 WeakPolarHBondContact CA-OG1 3.48Å; D181-T184 PolarHBondContact O-N 3.47Å; D181-T184 PolarHBondContact O-OG1 3.42Å; T184-M186 PolarHBondContact O-N 3.29Å; T184-T187 PolarHBondContact O-N 2.67Å; T184-T187 PolarHBondContact O-OG1 3.21Å
185	N	68.3	Low	69.8	Low	107 Å²	107	87.4 Å²	87.4	57%	0.572	46%	0.462	S	S	*	.	H	α-helix	trans	-69.5	-18.6	173.3	-71.3	-30.5	0	0	0	113.3	D181 W182 M183	D181-N185 VanDerWaalsContact O-CG 3.31Å; D181-N185 PolarHBondContact O-N 3.36Å; D181-N185 VanDerWaalsContact O-N 3.07Å; D181-N185 PolarHBondContact O-ND2 3.39Å; D181-N185 VanDerWaalsContact O-ND2 3.17Å; W182-N185 PolarHBondContact O-N 2.87Å; M183-N185 PolarHBondContact O-N 2.76Å
186	M	60.1	Low	70.5	Confident	20 Å²	20	86.4 Å²	86.4	10%	0.099	45%	0.454	C	S	.	.	H	α-helix	trans	-83.2	-26.5	175.7	-71.6	-127.9	-74.6	0	0	113.3	W182 M183 T184 D188 R199	W182-M186 HydrophobicContact CD2-CG 4.37Å; W182-M186 HydrophobicContact CE3-CE 4.03Å; W182-M186 HydrophobicContact CE3-CG 4.23Å; W182-M186 HydrophobicContact CE3-SD 4.41Å; W182-M186 HydrophobicContact CH2-CE 3.55Å; W182-M186 HydrophobicContact CH2-CG 4.42Å; W182-M186 HydrophobicContact CH2-SD 3.64Å; W182-M186 HydrophobicContact CZ2-CE 4.45Å; W182-M186 HydrophobicContact CZ2-SD 3.99Å; W182-M186 HydrophobicContact CZ3-CE 3.26Å; W182-M186 HydrophobicContact CZ3-CG 4.24Å; W182-M186 HydrophobicContact CZ3-SD 3.85Å; W182-M186 WeakPolarHBondContact O-CG 3.45Å; W182-M186 PolarHBondContact O-N 2.96Å; W182-M186 VanDerWaalsContact O-N 3.12Å; M183-M186 WeakPolarHBondContact O-CA 3.43Å; M183-M186 WeakPolarHBondContact O-CB 3.39Å; M183-M186 PolarHBondContact O-N 2.94Å; T184-M186 PolarHBondContact O-N 3.29Å; M186-D188 PolarHBondContact O-N 3.13Å; M186-R199 HydrophobicContact CE-CB 4.07Å; M186-R199 HydrophobicContact SD-CB 3.6Å; M186-R199 WeakPolarHBondContact SD-CD 3.1Å; M186-R199 HydrophobicContact SD-CG 4.09Å
187	T	61	Low	71.2	Confident	81 Å²	81	90.6 Å²	90.6	50%	0.497	47%	0.472	S	S	.	.			trans	-76.3	2.4	177.2	43.5	0	0	0	0	114.2	M183 T184 S189	M183-T187 PolarHBondContact O-N 2.97Å; T184-T187 PolarHBondContact O-N 2.67Å; T184-T187 PolarHBondContact O-OG1 3.21Å; T187-S189 PolarHBondContact O-N 3.2Å; T187-S189 VanDerWaalsContact O-N 3.07Å
188	D	67.7	Low	71.6	Confident	100 Å²	100	93 Å²	93	54%	0.535	48%	0.475	S	S	.	.			trans	-54.4	117.8	168.5	-93.5	-13.7	0	0	0	109.8	M186 S190 S191	M186-D188 PolarHBondContact O-N 3.13Å; D188-S190 PolarHBondContact O-N 3.03Å; D188-S191 PolarHBondContact O-N 3.22Å
189	S	67.3	Low	72.1	Confident	132 Å²	132	91.9 Å²	91.9	92%	0.923	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-5.4	-169.3	54.4	0	0	0	0	115.1	T187	T187-S189 PolarHBondContact O-N 3.2Å; T187-S189 VanDerWaalsContact O-N 3.07Å
190	S	73.8	Confident	72.7	Confident	108 Å²	108	93 Å²	93	76%	0.755	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-9.7	178.3	54.2	0	0	0	0	114.7	D188 S192	D188-S190 PolarHBondContact O-N 3.03Å; S190-S192 PolarHBondContact O-N 3.42Å
191	S	74.3	Confident	73.1	Confident	36 Å²	36	91.7 Å²	91.7	25%	0.252	48%	0.477	S	S	.	.	S	Bend	trans	-77.7	118.4	-176.1	-63.8	0	0	0	0	111.6	D188 W193	D188-S191 PolarHBondContact O-N 3.22Å; S191-W193 PolarHBondContact O-N 3.04Å
192	S	84	Confident	73.3	Confident	67 Å²	67	92.4 Å²	92.4	47%	0.469	48%	0.48	S	S	.	.			trans	-58.6	140.7	175.9	86.3	0	0	0	0	111	S190 K194 T195 I196	S190-S192 PolarHBondContact O-N 3.42Å; S192-K194 PolarHBondContact O-N 3.39Å; S192-T195 WeakPolarHBondContact O-CA 3.35Å; S192-T195 VanDerWaalsContact O-CB 3.28Å; S192-T195 WeakPolarHBondContact O-CB 3.4Å; S192-T195 PolarHBondContact O-N 3.36Å; S192-T195 PolarHBondContact OG-OG1 2.88Å; S192-I196 PolarHBondContact O-N 2.75Å
193	W	75.9	Confident	73.8	Confident	161 Å²	161	89 Å²	89	61%	0.61	47%	0.47	S	S	*	.	H	α-helix	trans	-50.3	-34.9	179	178.8	-114.4	0	0	0	113.6	I159 S191 T195 I196 K197	I159-W193 HydrophobicContact CD1-CH2 3.62Å; I159-W193 HydrophobicContact CD1-CZ3 3.64Å; S191-W193 PolarHBondContact O-N 3.04Å; W193-T195 VanDerWaalsContact C-N 3.3Å; W193-T195 PolarHBondContact O-N 3.38Å; W193-I196 PolarHBondContact O-N 2.94Å; W193-K197 PolarHBondContact O-N 3.44Å
194	K	78.4	Confident	74.4	Confident	150 Å²	150	92.8 Å²	92.8	65%	0.652	49%	0.488	S	S	*	.	H	α-helix	trans	-64.4	-34	177.5	-157.5	173.8	-172.3	173.2	0	112.4	S192 R198	S192-K194 PolarHBondContact O-N 3.39Å; K194-R198 WeakPolarHBondContact O-CG 3.33Å; K194-R198 PolarHBondContact O-N 2.97Å
195	T	76.1	Confident	75	Confident	53 Å²	53	92.5 Å²	92.5	33%	0.325	49%	0.489	S	S	.	.	H	α-helix	trans	-71.1	-44.8	175.3	-50.6	0	0	0	0	110.9	S192 W193 K197 R198 R199	S192-T195 WeakPolarHBondContact O-CA 3.35Å; S192-T195 VanDerWaalsContact O-CB 3.28Å; S192-T195 WeakPolarHBondContact O-CB 3.4Å; S192-T195 PolarHBondContact O-N 3.36Å; S192-T195 PolarHBondContact OG-OG1 2.88Å; W193-T195 VanDerWaalsContact C-N 3.3Å; W193-T195 PolarHBondContact O-N 3.38Å; T195-K197 PolarHBondContact O-N 2.97Å; T195-R198 PolarHBondContact O-N 3.41Å; T195-R199 WeakPolarHBondContact O-CG 3.27Å; T195-R199 PolarHBondContact O-N 3.42Å
196	I	75.1	Confident	75.5	Confident	41 Å²	41	93 Å²	93	21%	0.21	49%	0.491	C	S	.	.	H	α-helix	trans	-59.5	-49	177.9	-61.8	173	0	0	0	109.8	S192 W193 R198 R199 C200	S192-I196 PolarHBondContact O-N 2.75Å; W193-I196 PolarHBondContact O-N 2.94Å; I196-R198 PolarHBondContact O-N 2.88Å; I196-R199 PolarHBondContact O-N 3.18Å; I196-R199 VanDerWaalsContact O-N 3.09Å; I196-C200 PolarHBondContact O-N 3.46Å; I196-C200 PolarHBondContact O-SG 2.97Å; I196-C200 VanDerWaalsContact O-SG 3.38Å
197	K	78	Confident	76.5	Confident	140 Å²	140	93.3 Å²	93.3	61%	0.609	49%	0.494	S	S	*	.	H	α-helix	trans	-59.6	-43.1	178.7	-169.6	172	-177.1	173.2	0	113.1	W193 T195 R199 C200 V201	W193-K197 PolarHBondContact O-N 3.44Å; T195-K197 PolarHBondContact O-N 2.97Å; K197-R199 VanDerWaalsContact C-N 3.29Å; K197-R199 PolarHBondContact O-N 3.49Å; K197-C200 PolarHBondContact O-N 2.84Å; K197-V201 WeakPolarHBondContact O-CG2 3.4Å; K197-V201 PolarHBondContact O-N 3.49Å
198	R	79.1	Confident	77.6	Confident	176 Å²	176	94.9 Å²	94.9	66%	0.664	50%	0.499	S	S	*	.	H	α-helix	trans	-62.4	-37.6	175.9	-78.7	179.9	176	-175.7	-2.1	112.2	K194 T195 I196 L202	K194-R198 WeakPolarHBondContact O-CG 3.33Å; K194-R198 PolarHBondContact O-N 2.97Å; T195-R198 PolarHBondContact O-N 3.41Å; I196-R198 PolarHBondContact O-N 2.88Å; R198-L202 PolarHBondContact O-N 3.28Å
199	R	78.3	Confident	78.3	Confident	94 Å²	94	96.9 Å²	96.9	36%	0.355	50%	0.499	S	S	.	.	H	α-helix	trans	-71.5	-39.2	179.1	-74.6	-176.8	-179.6	-178.6	-0.4	112.2	W182 M186 T195 I196 K197 V201 L202 V203	W182-R199 HydrophobicContact CH2-CB 3.89Å; W182-R199 HydrophobicContact CH2-CG 4.5Å; W182-R199 HydrophobicContact CZ2-CB 4.31Å; W182-R199 HydrophobicContact CZ2-CG 4.43Å; M186-R199 HydrophobicContact CE-CB 4.07Å; M186-R199 HydrophobicContact SD-CB 3.6Å; M186-R199 WeakPolarHBondContact SD-CD 3.1Å; M186-R199 HydrophobicContact SD-CG 4.09Å; T195-R199 WeakPolarHBondContact O-CG 3.27Å; T195-R199 PolarHBondContact O-N 3.42Å; I196-R199 PolarHBondContact O-N 3.18Å; I196-R199 VanDerWaalsContact O-N 3.09Å; K197-R199 VanDerWaalsContact C-N 3.29Å; K197-R199 PolarHBondContact O-N 3.49Å; R199-V201 PolarHBondContact O-N 2.93Å; R199-L202 WeakPolarHBondContact O-CB 3.47Å; R199-L202 PolarHBondContact O-N 3.43Å; R199-V203 PolarHBondContact O-N 3.4Å; R199-V203 VanDerWaalsContact O-N 3.1Å
200	C	79.6	Confident	78.9	Confident	55 Å²	55	93.7 Å²	93.7	37%	0.372	47%	0.474	S	S	.	.	H	α-helix	trans	-59.8	-44.2	173.8	-65.8	0	0	0	0	112.4	I196 K197 L202 V203 E204	I196-C200 PolarHBondContact O-N 3.46Å; I196-C200 PolarHBondContact O-SG 2.97Å; I196-C200 VanDerWaalsContact O-SG 3.38Å; K197-C200 PolarHBondContact O-N 2.84Å; C200-L202 VanDerWaalsContact C-N 3.28Å; C200-L202 PolarHBondContact O-N 3.15Å; C200-V203 PolarHBondContact O-N 3.49Å; C200-V203 VanDerWaalsContact O-N 3.12Å; C200-E204 PolarHBondContact O-N 2.88Å
201	V	78.8	Confident	79.3	Confident	86 Å²	86	94.4 Å²	94.4	52%	0.521	46%	0.463	S	S	.	.	H	α-helix	trans	-61.8	-35.8	176.7	174.1	0	0	0	0	111.9	K197 R199 S205	K197-V201 WeakPolarHBondContact O-CG2 3.4Å; K197-V201 PolarHBondContact O-N 3.49Å; R199-V201 PolarHBondContact O-N 2.93Å; V201-S205 WeakPolarHBondContact O-CB 3.42Å; V201-S205 PolarHBondContact O-N 3.41Å; V201-S205 VanDerWaalsContact O-N 3.1Å
202	L	76.1	Confident	79.7	Confident	119 Å²	119	97.6 Å²	97.6	62%	0.623	48%	0.475	S	S	*	.	H	α-helix	trans	-66.3	-39.5	174.8	-76.7	168.6	0	0	0	112	R198 R199 C200 S205 L206	R198-L202 PolarHBondContact O-N 3.28Å; R199-L202 WeakPolarHBondContact O-CB 3.47Å; R199-L202 PolarHBondContact O-N 3.43Å; C200-L202 VanDerWaalsContact C-N 3.28Å; C200-L202 PolarHBondContact O-N 3.15Å; L202-S205 PolarHBondContact O-N 2.95Å; L202-L206 WeakPolarHBondContact O-CB 3.48Å; L202-L206 PolarHBondContact O-N 3.44Å
203	V	78.9	Confident	79.5	Confident	26 Å²	26	98.5 Å²	98.5	16%	0.158	47%	0.473	C	S	.	.	H	α-helix	trans	-66.2	-44.9	177.1	174.7	0	0	0	0	111.4	W182 R199 C200 S205 L206 C207	W182-V203 HydrophobicContact CE3-CG2 4.34Å; W182-V203 HydrophobicContact CH2-CG2 3.5Å; W182-V203 HydrophobicContact CZ3-CG2 3.36Å; R199-V203 PolarHBondContact O-N 3.4Å; R199-V203 VanDerWaalsContact O-N 3.1Å; C200-V203 PolarHBondContact O-N 3.49Å; C200-V203 VanDerWaalsContact O-N 3.12Å; V203-S205 VanDerWaalsContact C-N 3.31Å; V203-S205 PolarHBondContact O-N 2.89Å; V203-L206 PolarHBondContact O-N 2.91Å; V203-L206 VanDerWaalsContact O-N 3.16Å; V203-C207 WeakPolarHBondContact O-CB 3.43Å; V203-C207 PolarHBondContact O-N 3.27Å; V203-C207 PolarHBondContact O-SG 2.96Å; V203-C207 VanDerWaalsContact O-SG 3.4Å
204	E	79.8	Confident	79.8	Confident	116 Å²	116	95.5 Å²	95.5	54%	0.542	47%	0.466	S	S	.	.	H	α-helix	trans	-58.9	-44.2	176.1	-75.4	-179.2	164.2	0	0	111.8	C200 L206 C207 L208	C200-E204 PolarHBondContact O-N 2.88Å; E204-L206 VanDerWaalsContact C-N 3.35Å; E204-L206 PolarHBondContact O-N 3.03Å; E204-C207 PolarHBondContact O-N 3.39Å; E204-L208 WeakPolarHBondContact O-CG 3.39Å; E204-L208 PolarHBondContact O-N 3.49Å
205	S	84.5	Confident	80.1	Confident	74 Å²	74	96 Å²	96	52%	0.517	47%	0.469	S	S	.	.	H	α-helix	trans	-60.7	-42.9	175.2	-178.7	0	0	0	0	112.1	V201 L202 V203 L208 R209	V201-S205 WeakPolarHBondContact O-CB 3.42Å; V201-S205 PolarHBondContact O-N 3.41Å; V201-S205 VanDerWaalsContact O-N 3.1Å; L202-S205 PolarHBondContact O-N 2.95Å; V203-S205 VanDerWaalsContact C-N 3.31Å; V203-S205 PolarHBondContact O-N 2.89Å; S205-L208 PolarHBondContact O-N 3.26Å; S205-R209 PolarHBondContact O-N 3.4Å
206	L	79.6	Confident	80.3	Confident	118 Å²	118	98.7 Å²	98.7	62%	0.618	48%	0.479	S	S	*	.	H	α-helix	trans	-67.9	-42.7	179.2	-154.2	118.9	0	0	0	111.5	L202 V203 E204 L208 R209 V210	L202-L206 WeakPolarHBondContact O-CB 3.48Å; L202-L206 PolarHBondContact O-N 3.44Å; V203-L206 PolarHBondContact O-N 2.91Å; V203-L206 VanDerWaalsContact O-N 3.16Å; E204-L206 VanDerWaalsContact C-N 3.35Å; E204-L206 PolarHBondContact O-N 3.03Å; L206-L208 PolarHBondContact O-N 3Å; L206-R209 PolarHBondContact O-N 3.17Å; L206-R209 VanDerWaalsContact O-N 3.13Å; L206-V210 HydrophobicContact CD2-CG2 4.46Å; L206-V210 WeakPolarHBondContact O-CG2 3.42Å; L206-V210 PolarHBondContact O-N 2.93Å
207	C	80.6	Confident	80.7	Confident	26 Å²	26	101.1 Å²	101.1	18%	0.176	49%	0.492	C	S	.	.	H	α-helix	trans	-60.1	-42.9	174.9	-76.4	0	0	0	0	111.9	V203 E204 R209 V210 K211	V203-C207 WeakPolarHBondContact O-CB 3.43Å; V203-C207 PolarHBondContact O-N 3.27Å; V203-C207 PolarHBondContact O-SG 2.96Å; V203-C207 VanDerWaalsContact O-SG 3.4Å; E204-C207 PolarHBondContact O-N 3.39Å; C207-R209 VanDerWaalsContact C-N 3.32Å; C207-R209 PolarHBondContact O-N 3.02Å; C207-V210 PolarHBondContact O-N 2.89Å; C207-K211 PolarHBondContact O-N 2.67Å
208	L	83.7	Confident	81	Confident	115 Å²	115	98.5 Å²	98.5	60%	0.602	48%	0.482	S	S	*	.	H	α-helix	trans	-62.3	-40.1	174	-78.2	167.6	0	0	0	111.8	E204 S205 L206 K211 Q212	E204-L208 WeakPolarHBondContact O-CG 3.39Å; E204-L208 PolarHBondContact O-N 3.49Å; S205-L208 PolarHBondContact O-N 3.26Å; L206-L208 PolarHBondContact O-N 3Å; L208-K211 PolarHBondContact O-N 3.43Å; L208-Q212 WeakPolarHBondContact O-CG 3.36Å; L208-Q212 PolarHBondContact O-N 3.19Å; L208-Q212 VanDerWaalsContact O-N 3.08Å
209	R	82.9	Confident	81.3	Confident	142 Å²	142	93.7 Å²	93.7	54%	0.536	47%	0.472	S	S	.	.	H	α-helix	trans	-68.9	-39.4	178.6	-169.6	58.4	173.2	176.5	-0	112.6	S205 L206 C207 Q212 L213	S205-R209 PolarHBondContact O-N 3.4Å; L206-R209 PolarHBondContact O-N 3.17Å; L206-R209 VanDerWaalsContact O-N 3.13Å; C207-R209 VanDerWaalsContact C-N 3.32Å; C207-R209 PolarHBondContact O-N 3.02Å; R209-Q212 WeakPolarHBondContact O-CB 3.45Å; R209-Q212 PolarHBondContact O-N 3.42Å; R209-L213 HydrophobicContact CG-CD1 4.5Å; R209-L213 WeakPolarHBondContact O-CG 3.34Å; R209-L213 PolarHBondContact O-N 3.44Å
210	V	79.4	Confident	81.4	Confident	64 Å²	64	95.1 Å²	95.1	39%	0.388	48%	0.483	S	S	.	.	H	α-helix	trans	-62	-47.3	174.8	171.7	0	0	0	0	110.3	L206 C207 Q212 L213 E214	L206-V210 HydrophobicContact CD2-CG2 4.46Å; L206-V210 WeakPolarHBondContact O-CG2 3.42Å; L206-V210 PolarHBondContact O-N 2.93Å; C207-V210 PolarHBondContact O-N 2.89Å; V210-Q212 VanDerWaalsContact C-N 3.28Å; V210-Q212 PolarHBondContact O-N 3.15Å; V210-L213 PolarHBondContact O-N 2.97Å; V210-L213 VanDerWaalsContact O-N 3.07Å; V210-E214 HydrophobicContact CG1-CG 4.47Å; V210-E214 WeakPolarHBondContact O-CG 3.21Å; V210-E214 PolarHBondContact O-N 3.06Å
211	K	82.7	Confident	81.4	Confident	123 Å²	123	98 Å²	98	54%	0.535	49%	0.489	S	S	.	.	H	α-helix	trans	-58.8	-37.2	175.5	-76	-175.8	176.8	-178.1	0	113	C207 L208 K215	C207-K211 PolarHBondContact O-N 2.67Å; L208-K211 PolarHBondContact O-N 3.43Å; K211-K215 PolarHBondContact O-N 3.39Å; K211-K215 VanDerWaalsContact O-N 3.15Å
212	Q	82.7	Confident	81.7	Confident	104 Å²	104	101.9 Å²	101.9	49%	0.486	49%	0.494	S	S	.	.	H	α-helix	trans	-65.3	-43.2	174	-76.5	179.1	-9.3	0	0	112.4	L208 R209 V210 K215 M216	L208-Q212 WeakPolarHBondContact O-CG 3.36Å; L208-Q212 PolarHBondContact O-N 3.19Å; L208-Q212 VanDerWaalsContact O-N 3.08Å; R209-Q212 WeakPolarHBondContact O-CB 3.45Å; R209-Q212 PolarHBondContact O-N 3.42Å; V210-Q212 VanDerWaalsContact C-N 3.28Å; V210-Q212 PolarHBondContact O-N 3.15Å; Q212-K215 PolarHBondContact O-N 3.4Å; Q212-M216 PolarHBondContact O-N 2.89Å
213	L	79.3	Confident	82.1	Confident	85 Å²	85	101.1 Å²	101.1	45%	0.445	49%	0.494	S	S	.	.	H	α-helix	trans	-66.5	-38.6	178.7	-72.6	170.9	0	0	0	111.9	R209 V210 M216 L217	R209-L213 HydrophobicContact CG-CD1 4.5Å; R209-L213 WeakPolarHBondContact O-CG 3.34Å; R209-L213 PolarHBondContact O-N 3.44Å; V210-L213 PolarHBondContact O-N 2.97Å; V210-L213 VanDerWaalsContact O-N 3.07Å; L213-M216 HydrophobicContact CD2-CE 4.15Å; L213-M216 PolarHBondContact O-N 3.2Å; L213-L217 WeakPolarHBondContact O-CB 3.46Å; L213-L217 PolarHBondContact O-N 2.68Å
214	E	81.7	Confident	81.4	Confident	98 Å²	98	105.3 Å²	105.3	46%	0.458	51%	0.513	S	S	.	.	H	α-helix	trans	-62	-44.3	174.1	-73.4	177.4	157.6	0	0	111.6	V210 M216 L217 E218	V210-E214 HydrophobicContact CG1-CG 4.47Å; V210-E214 WeakPolarHBondContact O-CG 3.21Å; V210-E214 PolarHBondContact O-N 3.06Å; E214-M216 VanDerWaalsContact C-N 3.31Å; E214-M216 PolarHBondContact O-N 3.19Å; E214-L217 PolarHBondContact O-N 2.88Å; E214-E218 WeakPolarHBondContact O-CB 3.32Å; E214-E218 PolarHBondContact O-N 3.35Å
215	K	85.8	Confident	81.4	Confident	162 Å²	162	102.7 Å²	102.7	70%	0.704	51%	0.511	S	S	*	.	H	α-helix	trans	-61.3	-40.6	175.8	-168.8	175.5	-178.5	177	0	111.7	K211 Q212 T219	K211-K215 PolarHBondContact O-N 3.39Å; K211-K215 VanDerWaalsContact O-N 3.15Å; Q212-K215 PolarHBondContact O-N 3.4Å; K215-T219 WeakPolarHBondContact O-CG2 3.3Å; K215-T219 PolarHBondContact O-N 3.01Å; K215-T219 VanDerWaalsContact O-N 3.12Å; K215-T219 PolarHBondContact O-OG1 3.41Å
216	M	79.1	Confident	81.5	Confident	109 Å²	109	102.4 Å²	102.4	54%	0.537	50%	0.504	S	S	.	.	H	α-helix	trans	-64.5	-45.8	174.7	-78.8	176.2	29.8	0	0	112.3	Q212 L213 E214 E218 T219 E220	Q212-M216 PolarHBondContact O-N 2.89Å; L213-M216 HydrophobicContact CD2-CE 4.15Å; L213-M216 PolarHBondContact O-N 3.2Å; E214-M216 VanDerWaalsContact C-N 3.31Å; E214-M216 PolarHBondContact O-N 3.19Å; M216-E218 VanDerWaalsContact C-N 3.29Å; M216-E218 PolarHBondContact O-N 2.92Å; M216-T219 WeakPolarHBondContact CA-OG1 3.35Å; M216-T219 PolarHBondContact O-N 3.44Å; M216-T219 PolarHBondContact O-OG1 3.35Å; M216-E220 PolarHBondContact O-N 2.88Å
217	L	83.8	Confident	81.3	Confident	92 Å²	92	105.1 Å²	105.1	48%	0.482	51%	0.506	S	S	.	.	H	α-helix	trans	-60.9	-40.7	178.9	-177.2	65.3	0	0	0	111.4	L213 E214 E220 K221	L213-L217 WeakPolarHBondContact O-CB 3.46Å; L213-L217 PolarHBondContact O-N 2.68Å; E214-L217 PolarHBondContact O-N 2.88Å; L217-E220 PolarHBondContact O-N 3.43Å; L217-K221 WeakPolarHBondContact O-CG 3.4Å; L217-K221 PolarHBondContact O-N 2.88Å
218	E	85.7	Confident	80.8	Confident	85 Å²	85	108.5 Å²	108.5	40%	0.397	52%	0.522	S	S	.	.	H	α-helix	trans	-67.4	-37.7	177.8	-168.1	55.9	-149.9	0	0	112.1	E214 M216 E220 R222	E214-E218 WeakPolarHBondContact O-CB 3.32Å; E214-E218 PolarHBondContact O-N 3.35Å; M216-E218 VanDerWaalsContact C-N 3.29Å; M216-E218 PolarHBondContact O-N 2.92Å; E218-E220 VanDerWaalsContact C-N 3.35Å; E218-R222 WeakPolarHBondContact O-CG 3.32Å; E218-R222 PolarHBondContact O-N 2.9Å; E218-R222 IonicContact OE1-NE 3.81Å
219	T	85.1	Confident	80.7	Confident	75 Å²	75	110.9 Å²	110.9	46%	0.46	52%	0.523	S	S	.	.	H	α-helix	trans	-64.6	-39	172.4	54.2	0	0	0	0	112.4	K215 M216 R222 V223	K215-T219 WeakPolarHBondContact O-CG2 3.3Å; K215-T219 PolarHBondContact O-N 3.01Å; K215-T219 VanDerWaalsContact O-N 3.12Å; K215-T219 PolarHBondContact O-OG1 3.41Å; M216-T219 WeakPolarHBondContact CA-OG1 3.35Å; M216-T219 PolarHBondContact O-N 3.44Å; M216-T219 PolarHBondContact O-OG1 3.35Å; T219-R222 PolarHBondContact O-N 3.38Å; T219-V223 WeakPolarHBondContact O-CG2 3.41Å; T219-V223 PolarHBondContact O-N 2.83Å; T219-V223 VanDerWaalsContact O-N 3.13Å
220	E	79.2	Confident	80.4	Confident	124 Å²	124	111.1 Å²	111.1	58%	0.579	52%	0.524	S	S	*	.	H	α-helix	trans	-68.8	-39.9	179	-169	169.6	-165.5	0	0	111.9	M216 L217 E218 R222 V223 M224	M216-E220 PolarHBondContact O-N 2.88Å; L217-E220 PolarHBondContact O-N 3.43Å; E218-E220 VanDerWaalsContact C-N 3.35Å; E220-R222 VanDerWaalsContact C-N 3.32Å; E220-R222 PolarHBondContact O-N 3.2Å; E220-V223 PolarHBondContact O-N 3.26Å; E220-M224 VanDerWaalsContact O-CG 3.27Å; E220-M224 WeakPolarHBondContact O-CG 3.5Å; E220-M224 PolarHBondContact O-N 3.47Å
221	K	80.6	Confident	79.8	Confident	116 Å²	116	112.3 Å²	112.3	50%	0.504	53%	0.528	S	S	.	.	H	α-helix	trans	-57	-43.1	172.4	-77	178.1	-179.3	175.7	0	112.4	L217 M224 A225	L217-K221 WeakPolarHBondContact O-CG 3.4Å; L217-K221 PolarHBondContact O-N 2.88Å; K221-M224 PolarHBondContact O-N 3.25Å; K221-A225 WeakPolarHBondContact O-CB 3.48Å; K221-A225 PolarHBondContact O-N 3.36Å
222	R	85.5	Confident	78.8	Confident	167 Å²	167	110.3 Å²	110.3	63%	0.63	53%	0.526	S	S	*	.	H	α-helix	trans	-65.8	-40.3	177.3	-67.4	-179.8	-156.2	-179.3	4.9	112.2	E218 T219 E220 A225 D226	E218-R222 WeakPolarHBondContact O-CG 3.32Å; E218-R222 PolarHBondContact O-N 2.9Å; E218-R222 IonicContact OE1-NE 3.81Å; T219-R222 PolarHBondContact O-N 3.38Å; E220-R222 VanDerWaalsContact C-N 3.32Å; E220-R222 PolarHBondContact O-N 3.2Å; R222-A225 PolarHBondContact O-N 2.98Å; R222-D226 PolarHBondContact O-N 3.3Å
223	V	83.1	Confident	78.5	Confident	102 Å²	102	110.4 Å²	110.4	62%	0.618	53%	0.527	S	S	*	.	H	α-helix	trans	-65.2	-40.1	176.4	172.6	0	0	0	0	111.2	T219 E220 R227	T219-V223 WeakPolarHBondContact O-CG2 3.41Å; T219-V223 PolarHBondContact O-N 2.83Å; T219-V223 VanDerWaalsContact O-N 3.13Å; E220-V223 PolarHBondContact O-N 3.26Å; V223-R227 WeakPolarHBondContact O-CB 3.42Å; V223-R227 PolarHBondContact O-N 3.24Å
224	M	65.1	Low	77.8	Confident	115 Å²	115	115.1 Å²	115.1	57%	0.567	54%	0.538	S	S	*	.	H	α-helix	trans	-63.5	-46.6	175.1	-70	-107.5	-75.7	0	0	111.6	E220 K221 D226 R227 D228	E220-M224 VanDerWaalsContact O-CG 3.27Å; E220-M224 WeakPolarHBondContact O-CG 3.5Å; E220-M224 PolarHBondContact O-N 3.47Å; K221-M224 PolarHBondContact O-N 3.25Å; M224-D226 PolarHBondContact O-N 2.97Å; M224-R227 WeakPolarHBondContact O-CB 3.46Å; M224-R227 PolarHBondContact O-N 2.99Å; M224-D228 PolarHBondContact O-N 3.47Å
225	A	79.1	Confident	76.3	Confident	60 Å²	60	116.2 Å²	116.2	50%	0.496	54%	0.538	S	S	.	.	H	α-helix	trans	-61.4	-40.8	178	0	0	0	0	0	112.9	K221 R222 D228 R229	K221-A225 WeakPolarHBondContact O-CB 3.48Å; K221-A225 PolarHBondContact O-N 3.36Å; R222-A225 PolarHBondContact O-N 2.98Å; A225-D228 PolarHBondContact O-N 2.97Å; A225-R229 PolarHBondContact O-N 3.32Å
226	D	86.6	Confident	75.4	Confident	69 Å²	69	111.8 Å²	111.8	37%	0.369	52%	0.522	S	S	.	.	H	α-helix	trans	-66.9	-37.9	175.4	-174.3	53.6	0	0	0	111.9	R222 M224 R229 R230	R222-D226 PolarHBondContact O-N 3.3Å; M224-D226 PolarHBondContact O-N 2.97Å; D226-R229 PolarHBondContact O-N 2.99Å; D226-R230 WeakPolarHBondContact O-CG 3.27Å; D226-R230 PolarHBondContact O-N 3.3Å; D226-R230 IonicContact OD1-NE 2.76Å; D226-R230 IonicContact OD2-CZ 2.65Å; D226-R230 IonicContact OD2-NE 2.76Å; D226-R230 PolarHBondContact OD2-NE 3.17Å; D226-R230 IonicContact OD2-NH2 2.91Å; D226-R230 PolarHBondContact OD2-NH2 3.46Å
227	R	75.8	Confident	74.8	Confident	175 Å²	175	111.9 Å²	111.9	66%	0.66	52%	0.522	S	S	*	.	H	α-helix	trans	-64.2	-42.5	175.4	-169.8	177.6	-178	173.6	0.4	111.8	V223 M224 R230 L231	V223-R227 WeakPolarHBondContact O-CB 3.42Å; V223-R227 PolarHBondContact O-N 3.24Å; M224-R227 WeakPolarHBondContact O-CB 3.46Å; M224-R227 PolarHBondContact O-N 2.99Å; R227-R230 PolarHBondContact O-N 2.73Å; R227-L231 HydrophobicContact CG-CD1 4.22Å; R227-L231 WeakPolarHBondContact O-CB 3.47Å; R227-L231 WeakPolarHBondContact O-CG 3.41Å; R227-L231 PolarHBondContact O-N 2.92Å
228	D	69.4	Low	73.3	Confident	96 Å²	96	111.4 Å²	111.4	51%	0.513	52%	0.522	S	S	.	.	H	α-helix	trans	-66.1	-39.4	177.3	-75.5	-12.3	0	0	0	111.7	M224 A225 L231 T232	M224-D228 PolarHBondContact O-N 3.47Å; A225-D228 PolarHBondContact O-N 2.97Å; D228-L231 PolarHBondContact O-N 3.14Å; D228-T232 WeakPolarHBondContact O-CB 3.35Å; D228-T232 PolarHBondContact O-N 3.16Å; D228-T232 PolarHBondContact O-OG1 2.98Å
229	R	82.3	Confident	71.9	Confident	165 Å²	165	114.5 Å²	114.5	62%	0.623	53%	0.53	S	S	*	.	H	α-helix	trans	-58.8	-50.9	173.1	-177.2	-179.4	174	157.4	1.5	111.9	A225 D226 L231 T232 E233	A225-R229 PolarHBondContact O-N 3.32Å; D226-R229 PolarHBondContact O-N 2.99Å; R229-L231 VanDerWaalsContact C-N 3.29Å; R229-L231 PolarHBondContact O-N 3.43Å; R229-T232 WeakPolarHBondContact O-CB 3.38Å; R229-T232 PolarHBondContact O-N 3.35Å; R229-T232 VanDerWaalsContact O-N 3.14Å; R229-E233 IonicContact CZ-OE1 3.25Å; R229-E233 IonicContact NE-OE1 2.79Å; R229-E233 PolarHBondContact NE-OE1 2.87Å; R229-E233 VanDerWaalsContact NE-OE1 3.15Å; R229-E233 IonicContact NH2-OE1 3.68Å; R229-E233 PolarHBondContact O-N 3.48Å
230	R	77.5	Confident	70.9	Confident	148 Å²	148	118.7 Å²	118.7	56%	0.558	54%	0.538	S	S	*	.	H	α-helix	trans	-63.2	-34.8	178.7	-66.3	179.6	-158	-156.2	6.8	112.6	D226 R227 R234	D226-R230 WeakPolarHBondContact O-CG 3.27Å; D226-R230 PolarHBondContact O-N 3.3Å; D226-R230 IonicContact OD1-NE 2.76Å; D226-R230 IonicContact OD2-CZ 2.65Å; D226-R230 IonicContact OD2-NE 2.76Å; D226-R230 PolarHBondContact OD2-NE 3.17Å; D226-R230 IonicContact OD2-NH2 2.91Å; D226-R230 PolarHBondContact OD2-NH2 3.46Å; R227-R230 PolarHBondContact O-N 2.73Å; R230-R234 WeakPolarHBondContact O-CG 3.38Å; R230-R234 PolarHBondContact O-N 3Å; R230-R234 VanDerWaalsContact O-N 3.17Å
231	L	64.9	Low	69.6	Low	89 Å²	89	117.5 Å²	117.5	47%	0.466	54%	0.535	S	S	.	.	H	α-helix	trans	-65.8	-41.6	174.4	-84	163	0	0	0	111.4	R227 D228 R229 R234 W235	R227-L231 HydrophobicContact CG-CD1 4.22Å; R227-L231 WeakPolarHBondContact O-CB 3.47Å; R227-L231 WeakPolarHBondContact O-CG 3.41Å; R227-L231 PolarHBondContact O-N 2.92Å; D228-L231 PolarHBondContact O-N 3.14Å; R229-L231 VanDerWaalsContact C-N 3.29Å; R229-L231 PolarHBondContact O-N 3.43Å; L231-R234 PolarHBondContact O-N 3.37Å; L231-W235 WeakPolarHBondContact O-CB 3.49Å; L231-W235 PolarHBondContact O-N 3.16Å
232	T	62.8	Low	68.2	Low	80 Å²	80	118.5 Å²	118.5	49%	0.491	54%	0.539	S	S	.	.	H	α-helix	trans	-65.1	-46.1	178.9	-50	0	0	0	0	111.4	D228 R229 R234 W235 D236	D228-T232 WeakPolarHBondContact O-CB 3.35Å; D228-T232 PolarHBondContact O-N 3.16Å; D228-T232 PolarHBondContact O-OG1 2.98Å; R229-T232 WeakPolarHBondContact O-CB 3.38Å; R229-T232 PolarHBondContact O-N 3.35Å; R229-T232 VanDerWaalsContact O-N 3.14Å; T232-R234 PolarHBondContact O-N 3.39Å; T232-W235 WeakPolarHBondContact O-CB 3.39Å; T232-W235 PolarHBondContact O-N 3.19Å; T232-W235 VanDerWaalsContact O-N 3.08Å; T232-D236 PolarHBondContact O-N 3.23Å
233	E	75.9	Confident	67	Low	107 Å²	107	117.2 Å²	117.2	50%	0.5	54%	0.538	S	S	.	.	H	α-helix	trans	-59.5	-44.8	176.5	-71.8	171.9	-174.9	0	0	111.9	R229 W235 D236 E237	R229-E233 IonicContact CZ-OE1 3.25Å; R229-E233 IonicContact NE-OE1 2.79Å; R229-E233 PolarHBondContact NE-OE1 2.87Å; R229-E233 VanDerWaalsContact NE-OE1 3.15Å; R229-E233 IonicContact NH2-OE1 3.68Å; R229-E233 PolarHBondContact O-N 3.48Å; E233-W235 VanDerWaalsContact C-N 3.29Å; E233-W235 PolarHBondContact O-N 2.86Å; E233-D236 PolarHBondContact O-N 2.95Å; E233-E237 PolarHBondContact O-N 3.39Å
234	R	64.8	Low	65.9	Low	183 Å²	183	115.2 Å²	115.2	69%	0.691	53%	0.529	S	S	*	.	H	α-helix	trans	-63.7	-34.8	174.5	-74.8	178.7	176.8	-176	-0.7	112.5	R230 L231 T232 E237 V238	R230-R234 WeakPolarHBondContact O-CG 3.38Å; R230-R234 PolarHBondContact O-N 3Å; R230-R234 VanDerWaalsContact O-N 3.17Å; L231-R234 PolarHBondContact O-N 3.37Å; T232-R234 PolarHBondContact O-N 3.39Å; R234-E237 PolarHBondContact O-N 3.48Å; R234-V238 WeakPolarHBondContact O-CG2 3.4Å; R234-V238 PolarHBondContact O-N 2.93Å; R234-V238 VanDerWaalsContact O-N 3.14Å
235	W	50.2	Low	65.2	Low	121 Å²	121	116.7 Å²	116.7	46%	0.458	53%	0.532	S	S	.	.	H	α-helix	trans	-68.6	-43.5	178.7	-121.4	111.2	0	0	0	112.1	L231 T232 E233 E237 V238 R239 L723	L231-W235 WeakPolarHBondContact O-CB 3.49Å; L231-W235 PolarHBondContact O-N 3.16Å; T232-W235 WeakPolarHBondContact O-CB 3.39Å; T232-W235 PolarHBondContact O-N 3.19Å; T232-W235 VanDerWaalsContact O-N 3.08Å; E233-W235 VanDerWaalsContact C-N 3.29Å; E233-W235 PolarHBondContact O-N 2.86Å; W235-E237 PolarHBondContact O-N 2.88Å; W235-V238 PolarHBondContact O-N 3.29Å; W235-R239 WeakPolarHBondContact O-CB 3.44Å; W235-R239 PolarHBondContact O-N 3.05Å; W235-L723 HydrophobicContact CH2-CD2 4.21Å; W235-L723 HydrophobicContact CZ2-CD2 3.89Å
236	D	67.9	Low	64.1	Low	69 Å²	69	118.1 Å²	118.1	37%	0.369	53%	0.53	S	S	.	.	H	α-helix	trans	-62.5	-32.8	177.2	-78.7	-30.4	0	0	0	112.1	T232 E233 R239 R240	T232-D236 PolarHBondContact O-N 3.23Å; E233-D236 PolarHBondContact O-N 2.95Å; D236-R239 PolarHBondContact O-N 2.81Å; D236-R239 IonicContact OD1-CZ 2.97Å; D236-R239 IonicContact OD1-NH1 3.78Å; D236-R239 PolarHBondContact OD1-NH1 3.21Å; D236-R240 WeakPolarHBondContact O-CB 3.49Å; D236-R240 PolarHBondContact O-N 3.4Å
237	E	65.8	Low	62.9	Low	112 Å²	112	119.1 Å²	119.1	52%	0.523	54%	0.536	S	S	.	.	H	α-helix	trans	-67.1	-45.6	172.8	-171.4	139.7	-132.9	0	0	112.7	E233 R234 W235 R239 R240 L241	E233-E237 PolarHBondContact O-N 3.39Å; R234-E237 PolarHBondContact O-N 3.48Å; W235-E237 PolarHBondContact O-N 2.88Å; E237-R239 VanDerWaalsContact C-N 3.3Å; E237-R239 PolarHBondContact O-N 2.8Å; E237-R240 PolarHBondContact O-N 3.24Å; E237-R240 IonicContact OE1-NH1 3.19Å; E237-L241 WeakPolarHBondContact O-CG 3.5Å; E237-L241 PolarHBondContact O-N 3.26Å
238	V	52.5	Low	61.6	Low	81 Å²	81	116.4 Å²	116.4	49%	0.491	53%	0.532	S	S	.	.	H	α-helix	trans	-59.9	-41.8	173.6	173	0	0	0	0	111.1	R234 W235 R240 L241 F242	R234-V238 WeakPolarHBondContact O-CG2 3.4Å; R234-V238 PolarHBondContact O-N 2.93Å; R234-V238 VanDerWaalsContact O-N 3.14Å; W235-V238 PolarHBondContact O-N 3.29Å; V238-R240 PolarHBondContact O-N 3.03Å; V238-L241 PolarHBondContact O-N 2.91Å; V238-F242 WeakPolarHBondContact O-CB 3.33Å; V238-F242 PolarHBondContact O-N 3.42Å
239	R	55.5	Low	60.7	Low	150 Å²	150	115.5 Å²	115.5	57%	0.566	53%	0.532	S	S	*	.	H	α-helix	trans	-62.9	-42.5	177.8	-169.4	-175.5	-70.8	154.6	-11.3	111.5	W235 D236 E237 F242 K243	W235-R239 WeakPolarHBondContact O-CB 3.44Å; W235-R239 PolarHBondContact O-N 3.05Å; D236-R239 PolarHBondContact O-N 2.81Å; D236-R239 IonicContact OD1-CZ 2.97Å; D236-R239 IonicContact OD1-NH1 3.78Å; D236-R239 PolarHBondContact OD1-NH1 3.21Å; E237-R239 VanDerWaalsContact C-N 3.3Å; E237-R239 PolarHBondContact O-N 2.8Å; R239-F242 PolarHBondContact O-N 3.21Å; R239-K243 PolarHBondContact O-N 2.98Å
240	R	63.5	Low	59.3	Low	164 Å²	164	110.7 Å²	110.7	62%	0.619	52%	0.524	S	S	*	.	H	α-helix	trans	-62.2	-42.3	176.6	-155.2	-173.3	-61.1	127	-0.9	111.4	D236 E237 V238 S244	D236-R240 WeakPolarHBondContact O-CB 3.49Å; D236-R240 PolarHBondContact O-N 3.4Å; E237-R240 PolarHBondContact O-N 3.24Å; E237-R240 IonicContact OE1-NH1 3.19Å; V238-R240 PolarHBondContact O-N 3.03Å; R240-S244 PolarHBondContact O-N 3.42Å
241	L	52.2	Low	58.3	Low	98 Å²	98	106.5 Å²	106.5	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-65.9	-40.8	175.7	-70.2	171.5	0	0	0	112.7	E237 V238 S244 K245	E237-L241 WeakPolarHBondContact O-CG 3.5Å; E237-L241 PolarHBondContact O-N 3.26Å; V238-L241 PolarHBondContact O-N 2.91Å; L241-S244 PolarHBondContact O-N 3.32Å; L241-K245 PolarHBondContact O-N 3.46Å; L241-K245 VanDerWaalsContact O-N 3.11Å
242	F	51.8	Low	57.7	Low	137 Å²	137	107 Å²	107	60%	0.601	52%	0.52	S	S	*	.	H	α-helix	trans	-66	-42.1	179.2	-157.2	-101	0	0	0	111.4	V238 R239 S244 K245 I246	V238-F242 WeakPolarHBondContact O-CB 3.33Å; V238-F242 PolarHBondContact O-N 3.42Å; R239-F242 PolarHBondContact O-N 3.21Å; F242-S244 PolarHBondContact O-N 3.27Å; F242-K245 PolarHBondContact O-N 2.97Å; F242-I246 HydrophobicContact CD1-CD1 3.55Å; F242-I246 HydrophobicContact CD1-CG1 4.12Å; F242-I246 HydrophobicContact CE1-CD1 3.62Å; F242-I246 HydrophobicContact CE1-CG1 4.11Å; F242-I246 WeakPolarHBondContact O-CG1 3.46Å; F242-I246 PolarHBondContact O-N 2.89Å
243	K	59.6	Low	57.2	Low	140 Å²	140	108.2 Å²	108.2	61%	0.609	52%	0.523	S	S	*	.	H	α-helix	trans	-59.3	-46.6	175.3	-170.1	170.7	-178.7	176.6	0	111.8	R239 K245 I246 D247	R239-K243 PolarHBondContact O-N 2.98Å; K243-K245 VanDerWaalsContact C-N 3.32Å; K243-K245 PolarHBondContact O-N 2.96Å; K243-I246 PolarHBondContact O-N 3.46Å; K243-D247 PolarHBondContact O-N 3.19Å
244	S	59.7	Low	56.4	Low	61 Å²	61	106 Å²	106	43%	0.427	52%	0.522	S	S	.	.	H	α-helix	trans	-58.4	-39.3	175.5	169.7	0	0	0	0	113.2	R240 L241 F242 D247 M248	R240-S244 PolarHBondContact O-N 3.42Å; L241-S244 PolarHBondContact O-N 3.32Å; F242-S244 PolarHBondContact O-N 3.27Å; S244-D247 PolarHBondContact O-N 3.41Å; S244-M248 PolarHBondContact O-N 3.48Å
245	K	52.4	Low	56.2	Low	146 Å²	146	102.3 Å²	102.3	64%	0.635	52%	0.516	S	S	*	.	H	α-helix	trans	-68.9	-40.1	174.9	-94.6	-178.4	175.7	-179.8	0	113.2	L241 F242 K243 D247 M248 C249	L241-K245 PolarHBondContact O-N 3.46Å; L241-K245 VanDerWaalsContact O-N 3.11Å; F242-K245 PolarHBondContact O-N 2.97Å; K243-K245 VanDerWaalsContact C-N 3.32Å; K243-K245 PolarHBondContact O-N 2.96Å; K245-D247 VanDerWaalsContact C-N 3.28Å; K245-D247 PolarHBondContact O-N 3.08Å; K245-M248 WeakPolarHBondContact O-CB 3.45Å; K245-M248 PolarHBondContact O-N 3.43Å; K245-C249 PolarHBondContact O-N 3.44Å; K245-C249 PolarHBondContact O-SG 2.97Å
246	I	54.6	Low	57	Low	89 Å²	89	101 Å²	101	46%	0.456	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-43.9	175.1	-70.4	170.3	0	0	0	110	F242 K243 M248 C249 S250	F242-I246 HydrophobicContact CD1-CD1 3.55Å; F242-I246 HydrophobicContact CD1-CG1 4.12Å; F242-I246 HydrophobicContact CE1-CD1 3.62Å; F242-I246 HydrophobicContact CE1-CG1 4.11Å; F242-I246 WeakPolarHBondContact O-CG1 3.46Å; F242-I246 PolarHBondContact O-N 2.89Å; K243-I246 PolarHBondContact O-N 3.46Å; I246-M248 VanDerWaalsContact C-N 3.31Å; I246-M248 PolarHBondContact O-N 2.88Å; I246-C249 PolarHBondContact O-N 3.48Å; I246-S250 PolarHBondContact O-N 3.22Å
247	D	60.8	Low	56.9	Low	90 Å²	90	104 Å²	104	48%	0.481	53%	0.526	S	S	.	.	H	α-helix	trans	-61.5	-41	178.7	-65	-23.8	0	0	0	111	K243 S244 K245 S250 A251	K243-D247 PolarHBondContact O-N 3.19Å; S244-D247 PolarHBondContact O-N 3.41Å; K245-D247 VanDerWaalsContact C-N 3.28Å; K245-D247 PolarHBondContact O-N 3.08Å; D247-S250 PolarHBondContact O-N 2.97Å; D247-S250 PolarHBondContact O-OG 3.31Å; D247-A251 PolarHBondContact O-N 3.01Å
248	M	50.5	Low	57	Low	118 Å²	118	103 Å²	103	58%	0.581	52%	0.521	S	S	*	.	H	α-helix	trans	-63.4	-44.7	173.1	-171.3	-170	-64	0	0	112.8	S244 K245 I246 S250 A251 F252	S244-M248 PolarHBondContact O-N 3.48Å; K245-M248 WeakPolarHBondContact O-CB 3.45Å; K245-M248 PolarHBondContact O-N 3.43Å; I246-M248 VanDerWaalsContact C-N 3.31Å; I246-M248 PolarHBondContact O-N 2.88Å; M248-S250 VanDerWaalsContact C-N 3.28Å; M248-S250 PolarHBondContact O-N 3.46Å; M248-A251 PolarHBondContact O-N 3.46Å; M248-F252 PolarHBondContact O-N 3.14Å
249	C	48.6	Very low	57.5	Low	77 Å²	77	101.3 Å²	101.3	52%	0.52	51%	0.508	S	S	.	.	H	α-helix	trans	-62.9	-35.9	176.3	-73.1	0	0	0	0	111.7	K245 I246 F252 L253	K245-C249 PolarHBondContact O-N 3.44Å; K245-C249 PolarHBondContact O-SG 2.97Å; I246-C249 PolarHBondContact O-N 3.48Å; C249-F252 WeakPolarHBondContact O-CB 3.49Å; C249-F252 PolarHBondContact O-N 2.83Å; C249-L253 WeakPolarHBondContact O-CG 3.5Å; C249-L253 PolarHBondContact O-N 3.5Å
250	S	53	Low	58.2	Low	65 Å²	65	100.4 Å²	100.4	46%	0.455	51%	0.509	S	S	.	.	H	α-helix	trans	-64.9	-39.1	177	77.6	0	0	0	0	112.2	I246 D247 M248 F252 L253 A254	I246-S250 PolarHBondContact O-N 3.22Å; D247-S250 PolarHBondContact O-N 2.97Å; D247-S250 PolarHBondContact O-OG 3.31Å; M248-S250 VanDerWaalsContact C-N 3.28Å; M248-S250 PolarHBondContact O-N 3.46Å; S250-F252 VanDerWaalsContact C-N 3.34Å; S250-L253 PolarHBondContact O-N 2.93Å; S250-A254 PolarHBondContact O-N 3.34Å
251	A	56.8	Low	58.5	Low	60 Å²	60	98.7 Å²	98.7	50%	0.496	50%	0.503	S	S	.	.	H	α-helix	trans	-65.8	-36.2	172.7	0	0	0	0	0	112.1	D247 M248 N255	D247-A251 PolarHBondContact O-N 3.01Å; M248-A251 PolarHBondContact O-N 3.46Å; A251-N255 PolarHBondContact O-N 3.43Å
252	F	52.4	Low	59.1	Low	100 Å²	100	96 Å²	96	44%	0.439	49%	0.488	S	S	.	.	H	α-helix	trans	-67.3	-44	174.6	-171.9	-93.6	0	0	0	112.3	M248 C249 S250 A254 N255 E256	M248-F252 PolarHBondContact O-N 3.14Å; C249-F252 WeakPolarHBondContact O-CB 3.49Å; C249-F252 PolarHBondContact O-N 2.83Å; S250-F252 VanDerWaalsContact C-N 3.34Å; F252-A254 VanDerWaalsContact C-N 3.28Å; F252-A254 PolarHBondContact O-N 2.94Å; F252-N255 WeakPolarHBondContact O-CB 3.49Å; F252-N255 PolarHBondContact O-N 3.4Å; F252-N255 VanDerWaalsContact O-N 3.08Å; F252-E256 PolarHBondContact O-N 2.66Å
253	L	52.4	Low	60.1	Low	104 Å²	104	95.5 Å²	95.5	55%	0.545	48%	0.482	S	S	.	.	H	α-helix	trans	-63.5	-33	176.9	-72.4	170.1	0	0	0	112.3	C249 S250 N255 E256 K257	C249-L253 WeakPolarHBondContact O-CG 3.5Å; C249-L253 PolarHBondContact O-N 3.5Å; S250-L253 PolarHBondContact O-N 2.93Å; L253-N255 VanDerWaalsContact C-N 3.28Å; L253-N255 PolarHBondContact O-N 3.01Å; L253-E256 PolarHBondContact O-N 3.43Å; L253-K257 PolarHBondContact O-N 2.94Å
254	A	60	Low	61	Low	60 Å²	60	94 Å²	94	50%	0.496	48%	0.478	S	S	.	.	H	α-helix	trans	-60.8	-37.3	172.9	0	0	0	0	0	112.2	S250 F252	S250-A254 PolarHBondContact O-N 3.34Å; F252-A254 VanDerWaalsContact C-N 3.28Å; F252-A254 PolarHBondContact O-N 2.94Å
255	N	60.9	Low	61.7	Low	106 Å²	106	95.2 Å²	95.2	57%	0.567	48%	0.479	S	S	*	.	H	α-helix	trans	-71.8	-29.7	175.3	-75.9	-25.2	0	0	0	113	A251 F252 L253 K257 E258 L259	A251-N255 PolarHBondContact O-N 3.43Å; F252-N255 WeakPolarHBondContact O-CB 3.49Å; F252-N255 PolarHBondContact O-N 3.4Å; F252-N255 VanDerWaalsContact O-N 3.08Å; L253-N255 VanDerWaalsContact C-N 3.28Å; L253-N255 PolarHBondContact O-N 3.01Å; N255-K257 VanDerWaalsContact C-N 3.3Å; N255-K257 PolarHBondContact O-N 2.87Å; N255-E258 PolarHBondContact O-N 3.48Å; N255-L259 PolarHBondContact O-N 2.97Å
256	E	65.3	Low	62.8	Low	94 Å²	94	89.3 Å²	89.3	44%	0.439	46%	0.455	S	S	.	.	H	α-helix	trans	-65.7	-35.4	177	-166.4	170.3	-158.7	0	0	111.8	F252 L253 E258 L259 F260	F252-E256 PolarHBondContact O-N 2.66Å; L253-E256 PolarHBondContact O-N 3.43Å; E256-E258 VanDerWaalsContact C-N 3.31Å; E256-E258 PolarHBondContact O-N 3.16Å; E256-L259 WeakPolarHBondContact O-CB 3.44Å; E256-L259 PolarHBondContact O-N 2.95Å; E256-F260 PolarHBondContact O-N 3.16Å
257	K	67.4	Low	63.9	Low	133 Å²	133	90.9 Å²	90.9	58%	0.578	46%	0.46	S	S	*	.	H	α-helix	trans	-62.9	-37	173.2	-167.7	175.4	-177.3	175.7	0	112.6	L253 N255 F260 R261	L253-K257 PolarHBondContact O-N 2.94Å; N255-K257 VanDerWaalsContact C-N 3.3Å; N255-K257 PolarHBondContact O-N 2.87Å; K257-F260 PolarHBondContact O-N 3.12Å; K257-R261 WeakPolarHBondContact O-CG 3.36Å; K257-R261 PolarHBondContact O-N 3.02Å; K257-R261 VanDerWaalsContact O-N 3.11Å
258	E	66.5	Low	65	Low	90 Å²	90	89.3 Å²	89.3	42%	0.421	46%	0.456	S	S	.	.	H	α-helix	trans	-69.7	-38.4	174.8	-74.7	-62.5	131.7	0	0	112	N255 E256 F260 R261 L262	N255-E258 PolarHBondContact O-N 3.48Å; E256-E258 VanDerWaalsContact C-N 3.31Å; E256-E258 PolarHBondContact O-N 3.16Å; E258-F260 VanDerWaalsContact C-N 3.32Å; E258-F260 PolarHBondContact O-N 3.39Å; E258-R261 PolarHBondContact O-N 2.99Å; E258-R261 IonicContact OE1-CZ 3.97Å; E258-R261 IonicContact OE1-NH1 3.65Å; E258-R261 PolarHBondContact OE1-NH1 3.19Å; E258-L262 PolarHBondContact O-N 3.29Å
259	L	63.9	Low	66.2	Low	45 Å²	45	84 Å²	84	24%	0.236	43%	0.431	C	S	.	.	H	α-helix	trans	-60.8	-40.9	172.3	-82.1	168.9	0	0	0	112.1	N255 E256 L262 R263 L343 A346	N255-L259 PolarHBondContact O-N 2.97Å; E256-L259 WeakPolarHBondContact O-CB 3.44Å; E256-L259 PolarHBondContact O-N 2.95Å; L259-L262 PolarHBondContact O-N 2.86Å; L259-R263 PolarHBondContact O-N 2.82Å; L259-L343 HydrophobicContact CD2-CD1 3.94Å; L259-A346 HydrophobicContact CD2-CB 3.74Å
260	F	69.5	Low	67.7	Low	131 Å²	131	82.7 Å²	82.7	58%	0.575	42%	0.422	S	S	*	.	H	α-helix	trans	-63.8	-44.6	176.9	-157.2	-87.7	0	0	0	111.5	E256 K257 E258 L262 R263 E264	E256-F260 PolarHBondContact O-N 3.16Å; K257-F260 PolarHBondContact O-N 3.12Å; E258-F260 VanDerWaalsContact C-N 3.32Å; E258-F260 PolarHBondContact O-N 3.39Å; F260-L262 VanDerWaalsContact C-N 3.35Å; F260-L262 PolarHBondContact O-N 3.31Å; F260-R263 PolarHBondContact O-N 3.17Å; F260-E264 HydrophobicContact CD1-CG 4.16Å; F260-E264 HydrophobicContact CE1-CG 4.07Å; F260-E264 WeakPolarHBondContact CE1-OE1 3.45Å; F260-E264 PolarHBondContact O-N 3.25Å
261	R	69.7	Low	69.2	Low	129 Å²	129	84.2 Å²	84.2	49%	0.487	42%	0.424	S	S	.	.	H	α-helix	trans	-59.7	-42.5	174.2	-74.2	172.4	171.6	177.5	-6.6	112.6	K257 E258 R263 E264 L265	K257-R261 WeakPolarHBondContact O-CG 3.36Å; K257-R261 PolarHBondContact O-N 3.02Å; K257-R261 VanDerWaalsContact O-N 3.11Å; E258-R261 PolarHBondContact O-N 2.99Å; E258-R261 IonicContact OE1-CZ 3.97Å; E258-R261 IonicContact OE1-NH1 3.65Å; E258-R261 PolarHBondContact OE1-NH1 3.19Å; R261-R263 VanDerWaalsContact C-N 3.32Å; R261-R263 PolarHBondContact O-N 3.07Å; R261-E264 PolarHBondContact O-N 3.4Å; R261-L265 VanDerWaalsContact O-CB 3.29Å; R261-L265 WeakPolarHBondContact O-CB 3.32Å; R261-L265 PolarHBondContact O-N 3.01Å
262	L	65.3	Low	70.4	Confident	40 Å²	40	85.2 Å²	85.2	21%	0.209	42%	0.418	C	S	.	.	H	α-helix	trans	-61.3	-41.2	175.5	-96.5	147.7	0	0	0	111.6	E258 L259 F260 L265 V266 K342 L343	E258-L262 PolarHBondContact O-N 3.29Å; L259-L262 PolarHBondContact O-N 2.86Å; F260-L262 VanDerWaalsContact C-N 3.35Å; F260-L262 PolarHBondContact O-N 3.31Å; L262-L265 PolarHBondContact O-N 3.33Å; L262-V266 WeakPolarHBondContact O-CG2 3.33Å; L262-V266 PolarHBondContact O-N 3.02Å; L262-K342 HydrophobicContact CD2-CB 4.15Å; L262-L343 HydrophobicContact CB-CD1 4.22Å
263	R	73.7	Confident	71.7	Confident	127 Å²	127	81.1 Å²	81.1	48%	0.479	40%	0.401	S	S	.	.	H	α-helix	trans	-65.3	-46.8	177.9	-168.4	176.9	-72.8	-115.1	-4	112.1	L259 F260 R261 L265 V266 E267 E347	L259-R263 PolarHBondContact O-N 2.82Å; F260-R263 PolarHBondContact O-N 3.17Å; R261-R263 VanDerWaalsContact C-N 3.32Å; R261-R263 PolarHBondContact O-N 3.07Å; R263-L265 PolarHBondContact O-N 3.4Å; R263-V266 PolarHBondContact O-N 2.89Å; R263-E267 PolarHBondContact O-N 3.34Å; R263-E347 IonicContact NH2-OE1 2.78Å; R263-E347 PolarHBondContact NH2-OE1 3.5Å
264	E	77.3	Confident	73.3	Confident	110 Å²	110	79.9 Å²	79.9	51%	0.514	40%	0.395	S	S	.	.	H	α-helix	trans	-58.8	-38.2	173.7	-72.3	-176.5	156.6	0	0	112	F260 R261 E267 S268	F260-E264 HydrophobicContact CD1-CG 4.16Å; F260-E264 HydrophobicContact CE1-CG 4.07Å; F260-E264 WeakPolarHBondContact CE1-OE1 3.45Å; F260-E264 PolarHBondContact O-N 3.25Å; R261-E264 PolarHBondContact O-N 3.4Å; E264-E267 PolarHBondContact O-N 3.42Å; E264-S268 VanDerWaalsContact O-CB 3.32Å; E264-S268 WeakPolarHBondContact O-CB 3.33Å; E264-S268 PolarHBondContact O-N 3.45Å
265	L	75.6	Confident	74.4	Confident	85 Å²	85	85.3 Å²	85.3	45%	0.445	40%	0.402	S	S	.	.	H	α-helix	trans	-69	-40.3	179.5	-161.8	149.2	0	0	0	111.5	R261 L262 R263 S268 L269 C339	R261-L265 VanDerWaalsContact O-CB 3.29Å; R261-L265 WeakPolarHBondContact O-CB 3.32Å; R261-L265 PolarHBondContact O-N 3.01Å; L262-L265 PolarHBondContact O-N 3.33Å; R263-L265 PolarHBondContact O-N 3.4Å; L265-S268 PolarHBondContact O-N 2.91Å; L265-L269 HydrophobicContact CD2-CD1 3.47Å; L265-L269 VanDerWaalsContact CD2-CD1 3.47Å; L265-L269 HydrophobicContact CD2-CG 4.05Å; L265-L269 WeakPolarHBondContact O-CB 3.37Å; L265-L269 WeakPolarHBondContact O-CG 3.46Å; L265-L269 PolarHBondContact O-N 3.37Å; L265-C339 HydrophobicContact CD2-CB 4.46Å; L265-C339 WeakPolarHBondContact CD2-SG 3.32Å
266	V	74.3	Confident	75.4	Confident	22 Å²	22	81.2 Å²	81.2	13%	0.133	38%	0.383	C	S	.	.	H	α-helix	trans	-60.9	-46	172.5	168.1	0	0	0	0	111.1	L262 R263 S268 L269 S270 L336 C339 E340	L262-V266 WeakPolarHBondContact O-CG2 3.33Å; L262-V266 PolarHBondContact O-N 3.02Å; R263-V266 PolarHBondContact O-N 2.89Å; V266-S268 PolarHBondContact O-N 3.37Å; V266-L269 PolarHBondContact O-N 3.21Å; V266-S270 WeakPolarHBondContact O-CB 3.43Å; V266-S270 PolarHBondContact O-N 3.21Å; V266-L336 HydrophobicContact CB-CD1 4.48Å; V266-L336 HydrophobicContact CG1-CD1 3.94Å; V266-C339 HydrophobicContact CG2-CB 3.69Å; V266-E340 HydrophobicContact CG1-CG 4.33Å
267	E	78.3	Confident	76.2	Confident	122 Å²	122	78.9 Å²	78.9	57%	0.57	37%	0.374	S	S	*	.	H	α-helix	trans	-62.7	-42.9	177.5	-72.2	178.1	-172.9	0	0	112.1	R263 E264 S270 L271	R263-E267 PolarHBondContact O-N 3.34Å; E264-E267 PolarHBondContact O-N 3.42Å; E267-S270 PolarHBondContact O-N 3.37Å; E267-L271 PolarHBondContact O-N 3.5Å
268	S	83.3	Confident	77.2	Confident	57 Å²	57	77 Å²	77	40%	0.399	37%	0.37	S	S	.	.	H	α-helix	trans	-63	-42.5	176	-175.7	0	0	0	0	112.5	E264 L265 V266 L271 K272	E264-S268 VanDerWaalsContact O-CB 3.32Å; E264-S268 WeakPolarHBondContact O-CB 3.33Å; E264-S268 PolarHBondContact O-N 3.45Å; L265-S268 PolarHBondContact O-N 2.91Å; V266-S268 PolarHBondContact O-N 3.37Å; S268-L271 PolarHBondContact O-N 3.18Å; S268-K272 WeakPolarHBondContact O-CG 3.41Å; S268-K272 PolarHBondContact O-N 3.06Å; S268-K272 VanDerWaalsContact O-N 3.15Å
269	L	75.9	Confident	78.1	Confident	8 Å²	8	74 Å²	74	4%	0.042	36%	0.361	C	S	.	.	H	α-helix	trans	-66	-43.1	175.7	-77.1	175.5	0	0	0	111.7	L265 V266 L271 K272 V273 W332 E335 L336 C339	L265-L269 HydrophobicContact CD2-CD1 3.47Å; L265-L269 VanDerWaalsContact CD2-CD1 3.47Å; L265-L269 HydrophobicContact CD2-CG 4.05Å; L265-L269 WeakPolarHBondContact O-CB 3.37Å; L265-L269 WeakPolarHBondContact O-CG 3.46Å; L265-L269 PolarHBondContact O-N 3.37Å; V266-L269 PolarHBondContact O-N 3.21Å; L269-L271 VanDerWaalsContact C-N 3.32Å; L269-L271 PolarHBondContact O-N 3.41Å; L269-K272 WeakPolarHBondContact O-CB 3.42Å; L269-K272 PolarHBondContact O-N 2.93Å; L269-V273 WeakPolarHBondContact O-CG2 3.34Å; L269-V273 PolarHBondContact O-N 2.94Å; L269-W332 HydrophobicContact CD2-CE3 3.43Å; L269-W332 VanDerWaalsContact CD2-CE3 3.43Å; L269-W332 HydrophobicContact CD2-CZ3 3.71Å; L269-E335 HydrophobicContact CD1-CB 4.2Å; L269-E335 HydrophobicContact CD2-CB 4.31Å; L269-L336 HydrophobicContact CB-CB 4.38Å; L269-L336 HydrophobicContact CB-CD1 3.82Å; L269-C339 HydrophobicContact CD1-CB 4.45Å
270	S	80.4	Confident	78.9	Confident	48 Å²	48	72.5 Å²	72.5	34%	0.336	35%	0.353	S	S	.	.	H	α-helix	trans	-57.1	-44.2	175.5	179.3	0	0	0	0	111.8	V266 E267 K272 V273 N274	V266-S270 WeakPolarHBondContact O-CB 3.43Å; V266-S270 PolarHBondContact O-N 3.21Å; E267-S270 PolarHBondContact O-N 3.37Å; S270-K272 VanDerWaalsContact C-N 3.35Å; S270-K272 PolarHBondContact O-N 2.86Å; S270-V273 PolarHBondContact O-N 3Å; S270-N274 WeakPolarHBondContact O-CB 3.5Å; S270-N274 PolarHBondContact O-N 3.29Å; S270-N274 PolarHBondContact O-ND2 3.49Å
271	L	83.3	Confident	79.7	Confident	97 Å²	97	72.3 Å²	72.3	51%	0.508	35%	0.354	S	S	.	.	H	α-helix	trans	-61.4	-39.4	174	-76.9	170.7	0	0	0	112.9	E267 S268 L269 N274 R275	E267-L271 PolarHBondContact O-N 3.5Å; S268-L271 PolarHBondContact O-N 3.18Å; L269-L271 VanDerWaalsContact C-N 3.32Å; L269-L271 PolarHBondContact O-N 3.41Å; L271-N274 PolarHBondContact O-N 2.95Å; L271-R275 WeakPolarHBondContact O-CG 3.42Å; L271-R275 PolarHBondContact O-N 3.38Å
272	K	82.3	Confident	80.5	Confident	81 Å²	81	69.9 Å²	69.9	35%	0.352	35%	0.353	S	S	.	.	H	α-helix	trans	-66.2	-43.4	176.3	-72.1	175.1	-177.8	175.1	0	111.8	S268 L269 S270 N274 R275 A276 W332	S268-K272 WeakPolarHBondContact O-CG 3.41Å; S268-K272 PolarHBondContact O-N 3.06Å; S268-K272 VanDerWaalsContact O-N 3.15Å; L269-K272 WeakPolarHBondContact O-CB 3.42Å; L269-K272 PolarHBondContact O-N 2.93Å; S270-K272 VanDerWaalsContact C-N 3.35Å; S270-K272 PolarHBondContact O-N 2.86Å; K272-N274 VanDerWaalsContact C-N 3.32Å; K272-N274 PolarHBondContact O-N 2.91Å; K272-R275 PolarHBondContact O-N 3.44Å; K272-A276 WeakPolarHBondContact O-CB 3.42Å; K272-A276 PolarHBondContact O-N 3.12Å; K272-W332 HydrophobicContact CB-CD2 4.49Å; K272-W332 HydrophobicContact CD-CD2 4.29Å; K272-W332 HydrophobicContact CD-CE3 3.98Å; K272-W332 HydrophobicContact CD-CH2 3.93Å; K272-W332 HydrophobicContact CD-CZ2 4.23Å; K272-W332 HydrophobicContact CD-CZ3 3.79Å
273	V	80.4	Confident	81.3	Confident	14 Å²	14	68.9 Å²	68.9	9%	0.085	35%	0.348	C	S	.	.	H	α-helix	trans	-60.4	-43.4	175.5	173	0	0	0	0	110.6	L269 S270 R275 A276 N277 W332 V333 L336	L269-V273 WeakPolarHBondContact O-CG2 3.34Å; L269-V273 PolarHBondContact O-N 2.94Å; S270-V273 PolarHBondContact O-N 3Å; V273-R275 PolarHBondContact O-N 3.42Å; V273-A276 PolarHBondContact O-N 2.92Å; V273-N277 PolarHBondContact O-N 3.33Å; V273-W332 HydrophobicContact CG2-CB 3.79Å; V273-V333 HydrophobicContact CG1-CG2 4.01Å; V273-V333 HydrophobicContact CG2-CG2 4.15Å; V273-L336 HydrophobicContact CG2-CD2 4.47Å
274	N	85.4	Confident	81.8	Confident	78 Å²	78	70.5 Å²	70.5	42%	0.417	35%	0.354	S	S	.	.	H	α-helix	trans	-63.9	-41.1	177	-73.9	-27.9	0	0	0	112.7	S270 L271 K272 N277 N278	S270-N274 WeakPolarHBondContact O-CB 3.5Å; S270-N274 PolarHBondContact O-N 3.29Å; S270-N274 PolarHBondContact O-ND2 3.49Å; L271-N274 PolarHBondContact O-N 2.95Å; K272-N274 VanDerWaalsContact C-N 3.32Å; K272-N274 PolarHBondContact O-N 2.91Å; N274-N277 WeakPolarHBondContact O-CB 3.43Å; N274-N277 PolarHBondContact O-N 3.42Å; N274-N278 PolarHBondContact O-N 3Å
275	R	84.6	Confident	82.4	Confident	175 Å²	175	71.5 Å²	71.5	66%	0.66	36%	0.357	S	S	*	.	H	α-helix	trans	-63.3	-42.1	173.4	-71.6	175.5	-169.1	169.5	5.3	112.1	L271 K272 V273 N277 N278 A279	L271-R275 WeakPolarHBondContact O-CG 3.42Å; L271-R275 PolarHBondContact O-N 3.38Å; K272-R275 PolarHBondContact O-N 3.44Å; V273-R275 PolarHBondContact O-N 3.42Å; R275-N277 VanDerWaalsContact C-N 3.33Å; R275-N278 PolarHBondContact O-N 2.97Å; R275-A279 PolarHBondContact O-N 3.35Å
276	A	80.3	Confident	83	Confident	20 Å²	20	71.4 Å²	71.4	17%	0.165	35%	0.354	C	S	.	.	H	α-helix	trans	-63.6	-38.9	176.2	0	0	0	0	0	111.7	K272 V273 A279 N280 K329	K272-A276 WeakPolarHBondContact O-CB 3.42Å; K272-A276 PolarHBondContact O-N 3.12Å; V273-A276 PolarHBondContact O-N 2.92Å; A276-A279 PolarHBondContact O-N 3.42Å; A276-N280 WeakPolarHBondContact O-CB 3.29Å; A276-N280 PolarHBondContact O-N 2.96Å; A276-N280 PolarHBondContact O-ND2 2.96Å; A276-K329 HydrophobicContact CB-CB 4.23Å; A276-K329 HydrophobicContact CB-CG 4.45Å
277	N	83.7	Confident	83.5	Confident	44 Å²	44	72 Å²	72	24%	0.235	36%	0.357	C	S	.	.	H	α-helix	trans	-60.5	-48.2	173.6	-80.5	-25.6	0	0	0	112.2	V273 N274 R275 A279 N280 Q281 K329	V273-N277 PolarHBondContact O-N 3.33Å; N274-N277 WeakPolarHBondContact O-CB 3.43Å; N274-N277 PolarHBondContact O-N 3.42Å; R275-N277 VanDerWaalsContact C-N 3.33Å; N277-A279 VanDerWaalsContact C-N 3.33Å; N277-A279 PolarHBondContact O-N 3.28Å; N277-N280 PolarHBondContact O-N 3.42Å; N277-Q281 WeakPolarHBondContact O-CG 3.35Å; N277-Q281 PolarHBondContact O-N 3.19Å; N277-K329 WeakPolarHBondContact OD1-CD 3.47Å; N277-K329 WeakPolarHBondContact OD1-CE 3.48Å; N277-K329 PolarHBondContact OD1-NZ 2.94Å
278	N	88	Confident	84	Confident	95 Å²	95	69.5 Å²	69.5	51%	0.508	35%	0.353	S	S	.	.	H	α-helix	trans	-63.5	-40	179.2	-68	-12.6	0	0	0	111.9	N274 R275 Q281 T282	N274-N278 PolarHBondContact O-N 3Å; R275-N278 PolarHBondContact O-N 2.97Å; N278-Q281 PolarHBondContact O-N 2.76Å; N278-T282 PolarHBondContact O-N 2.82Å; N278-T282 PolarHBondContact O-OG1 2.92Å
279	A	84	Confident	84.3	Confident	27 Å²	27	70.7 Å²	70.7	22%	0.223	35%	0.352	C	S	.	.	H	α-helix	trans	-63.4	-43.8	174.7	0	0	0	0	0	111.8	R275 A276 N277 T282 L283	R275-A279 PolarHBondContact O-N 3.35Å; A276-A279 PolarHBondContact O-N 3.42Å; N277-A279 VanDerWaalsContact C-N 3.33Å; N277-A279 PolarHBondContact O-N 3.28Å; A279-T282 WeakPolarHBondContact O-CB 3.43Å; A279-T282 PolarHBondContact O-N 2.9Å; A279-L283 PolarHBondContact O-N 3.23Å
280	N	81.4	Confident	84.7	Confident	12 Å²	12	70.8 Å²	70.8	6%	0.064	35%	0.353	C	S	.	.	H	α-helix	trans	-64.6	-38.8	176.7	-81.8	-22.8	0	0	0	112.6	A276 N277 T282 L283 R284 R325	A276-N280 WeakPolarHBondContact O-CB 3.29Å; A276-N280 PolarHBondContact O-N 2.96Å; A276-N280 PolarHBondContact O-ND2 2.96Å; N277-N280 PolarHBondContact O-N 3.42Å; N280-T282 VanDerWaalsContact C-N 3.32Å; N280-T282 PolarHBondContact O-N 3.34Å; N280-L283 PolarHBondContact O-N 3.39Å; N280-R284 WeakPolarHBondContact O-CB 3.22Å; N280-R284 VanDerWaalsContact O-CG 3.31Å; N280-R284 WeakPolarHBondContact O-CG 3.4Å; N280-R284 PolarHBondContact O-N 3.27Å; N280-R325 WeakPolarHBondContact OD1-CB 3.48Å
281	Q	86.3	Confident	84.9	Confident	128 Å²	128	70.7 Å²	70.7	60%	0.598	35%	0.351	S	S	*	.	H	α-helix	trans	-61.8	-41.6	173.3	-75.5	-179.6	-4.2	0	0	111.7	N277 N278 R284 K285	N277-Q281 WeakPolarHBondContact O-CG 3.35Å; N277-Q281 PolarHBondContact O-N 3.19Å; N278-Q281 PolarHBondContact O-N 2.76Å; Q281-R284 PolarHBondContact O-N 3.19Å; Q281-K285 PolarHBondContact O-N 2.93Å
282	T	87.2	Confident	85	Confident	77 Å²	77	68.4 Å²	68.4	47%	0.472	35%	0.345	S	S	.	.	H	α-helix	trans	-63.1	-47.6	177.9	-53.3	0	0	0	0	111.1	N278 A279 N280 R284 K285 E286	N278-T282 PolarHBondContact O-N 2.82Å; N278-T282 PolarHBondContact O-OG1 2.92Å; A279-T282 WeakPolarHBondContact O-CB 3.43Å; A279-T282 PolarHBondContact O-N 2.9Å; N280-T282 VanDerWaalsContact C-N 3.32Å; N280-T282 PolarHBondContact O-N 3.34Å; T282-R284 PolarHBondContact O-N 3.48Å; T282-K285 WeakPolarHBondContact O-CB 3.4Å; T282-K285 PolarHBondContact O-N 2.99Å; T282-E286 PolarHBondContact O-N 3.33Å
283	L	81.6	Confident	85	Confident	20 Å²	20	71.5 Å²	71.5	11%	0.105	36%	0.355	C	S	.	.	H	α-helix	trans	-64.9	-37.1	177.4	-75.2	175.7	0	0	0	113	A279 N280 K285 E286 N287 L318 L322 R325	A279-L283 PolarHBondContact O-N 3.23Å; N280-L283 PolarHBondContact O-N 3.39Å; L283-K285 VanDerWaalsContact C-N 3.29Å; L283-K285 PolarHBondContact O-N 2.91Å; L283-E286 PolarHBondContact O-N 3.01Å; L283-N287 WeakPolarHBondContact O-CB 3.47Å; L283-N287 PolarHBondContact O-N 2.73Å; L283-L318 HydrophobicContact CD2-CD2 4.08Å; L283-L322 HydrophobicContact CB-CD1 4.47Å; L283-L322 HydrophobicContact CB-CD2 3.4Å; L283-L322 HydrophobicContact CB-CG 3.75Å; L283-L322 HydrophobicContact CD1-CD2 4.18Å; L283-L322 HydrophobicContact CD1-CG 4.3Å; L283-L322 HydrophobicContact CG-CD2 4.46Å; L283-R325 HydrophobicContact CD1-CG 4.24Å
284	R	83.9	Confident	85	Confident	160 Å²	160	72.2 Å²	72.2	60%	0.604	36%	0.358	S	S	*	.	H	α-helix	trans	-61.2	-41.1	173.9	-77.9	177.9	-180	-174.9	-1.9	111.2	N280 Q281 T282 N287 S288 L322	N280-R284 WeakPolarHBondContact O-CB 3.22Å; N280-R284 VanDerWaalsContact O-CG 3.31Å; N280-R284 WeakPolarHBondContact O-CG 3.4Å; N280-R284 PolarHBondContact O-N 3.27Å; Q281-R284 PolarHBondContact O-N 3.19Å; T282-R284 PolarHBondContact O-N 3.48Å; R284-N287 PolarHBondContact O-N 3.04Å; R284-S288 WeakPolarHBondContact O-CB 3.28Å; R284-S288 PolarHBondContact O-N 2.95Å; R284-S288 PolarHBondContact O-OG 3.34Å; R284-L322 HydrophobicContact CG-CD2 3.97Å
285	K	89.9	Confident	84.8	Confident	131 Å²	131	76.6 Å²	76.6	57%	0.57	37%	0.369	S	S	*	.	H	α-helix	trans	-62.4	-49.6	174.8	-170.8	-179.1	176.7	-176.2	0	110.9	Q281 T282 L283 N287 S288 E289	Q281-K285 PolarHBondContact O-N 2.93Å; T282-K285 WeakPolarHBondContact O-CB 3.4Å; T282-K285 PolarHBondContact O-N 2.99Å; L283-K285 VanDerWaalsContact C-N 3.29Å; L283-K285 PolarHBondContact O-N 2.91Å; K285-N287 VanDerWaalsContact C-N 3.33Å; K285-N287 PolarHBondContact O-N 3.27Å; K285-S288 PolarHBondContact O-N 2.79Å; K285-S288 PolarHBondContact O-OG 2.91Å; K285-E289 WeakPolarHBondContact CE-OE1 3.34Å; K285-E289 WeakPolarHBondContact O-CG 3.48Å; K285-E289 PolarHBondContact O-N 3.39Å
286	E	87.7	Confident	84.6	Confident	83 Å²	83	73.9 Å²	73.9	39%	0.388	36%	0.364	S	S	.	.	H	α-helix	trans	-60.7	-40.2	177.4	-70.8	-177.2	-175.9	0	0	112.9	T282 L283 E289 C290 L318	T282-E286 PolarHBondContact O-N 3.33Å; L283-E286 PolarHBondContact O-N 3.01Å; E286-E289 PolarHBondContact O-N 2.93Å; E286-C290 WeakPolarHBondContact O-CB 3.47Å; E286-C290 PolarHBondContact O-N 3.43Å; E286-L318 HydrophobicContact CB-CD1 4.49Å
287	N	86	Confident	84.5	Confident	36 Å²	36	74.8 Å²	74.8	19%	0.193	37%	0.371	C	S	.	.	H	α-helix	trans	-67.2	-39.5	176.8	-166.6	21.8	0	0	0	111.6	L283 R284 K285 E289 C290 T291 L318 L322	L283-N287 WeakPolarHBondContact O-CB 3.47Å; L283-N287 PolarHBondContact O-N 2.73Å; R284-N287 PolarHBondContact O-N 3.04Å; K285-N287 VanDerWaalsContact C-N 3.33Å; K285-N287 PolarHBondContact O-N 3.27Å; N287-E289 VanDerWaalsContact C-N 3.33Å; N287-E289 PolarHBondContact O-N 3.25Å; N287-C290 PolarHBondContact O-N 2.98Å; N287-T291 WeakPolarHBondContact O-CB 3.32Å; N287-T291 PolarHBondContact O-N 2.83Å; N287-T291 PolarHBondContact O-OG1 3.38Å; N287-L318 HydrophobicContact CB-CB 4.5Å; N287-L322 HydrophobicContact CB-CD1 3.81Å
288	S	87.9	Confident	84.2	Confident	69 Å²	69	76.6 Å²	76.6	48%	0.483	38%	0.38	S	S	.	.	H	α-helix	trans	-63.3	-39.3	174	75.2	0	0	0	0	112.1	R284 K285 T291 A292	R284-S288 WeakPolarHBondContact O-CB 3.28Å; R284-S288 PolarHBondContact O-N 2.95Å; R284-S288 PolarHBondContact O-OG 3.34Å; K285-S288 PolarHBondContact O-N 2.79Å; K285-S288 PolarHBondContact O-OG 2.91Å; S288-T291 PolarHBondContact O-N 2.8Å; S288-A292 WeakPolarHBondContact O-CB 3.38Å; S288-A292 PolarHBondContact O-N 3.35Å
289	E	89.9	Confident	83.7	Confident	82 Å²	82	78.8 Å²	78.8	38%	0.383	39%	0.39	S	S	.	.	H	α-helix	trans	-68.3	-41.7	174.8	-71.5	179.2	-163.7	0	0	111.9	K285 E286 N287 A292 R293	K285-E289 WeakPolarHBondContact CE-OE1 3.34Å; K285-E289 WeakPolarHBondContact O-CG 3.48Å; K285-E289 PolarHBondContact O-N 3.39Å; E286-E289 PolarHBondContact O-N 2.93Å; N287-E289 VanDerWaalsContact C-N 3.33Å; N287-E289 PolarHBondContact O-N 3.25Å; E289-A292 PolarHBondContact O-N 3.16Å; E289-R293 WeakPolarHBondContact O-CG 3.46Å; E289-R293 PolarHBondContact O-N 3.12Å
290	C	85.4	Confident	83.5	Confident	9 Å²	9	85.2 Å²	85.2	6%	0.061	41%	0.413	C	S	.	.	H	α-helix	trans	-58.3	-48.9	173.8	-170.8	0	0	0	0	110.7	E286 N287 A292 R293 L294 C315 L318	E286-C290 WeakPolarHBondContact O-CB 3.47Å; E286-C290 PolarHBondContact O-N 3.43Å; N287-C290 PolarHBondContact O-N 2.98Å; C290-A292 PolarHBondContact O-N 3.09Å; C290-R293 PolarHBondContact O-N 2.85Å; C290-L294 WeakPolarHBondContact O-CB 3.3Å; C290-L294 PolarHBondContact O-N 3.47Å; C290-C315 VanDerWaalsContact C-SG 3.53Å; C290-C315 HydrophobicContact CB-CB 4.34Å; C290-C315 WeakPolarHBondContact CB-SG 3.46Å; C290-C315 WeakPolarHBondContact SG-CA 3.46Å; C290-C315 WeakPolarHBondContact SG-CB 3.28Å; C290-C315 PolarHBondContact SG-N 3.08Å; C290-C315 CovalentContact SG-SG 2.07Å; C290-C315 PolarHBondContact SG-SG 3.16Å; C290-L318 HydrophobicContact CB-CD1 3.94Å
291	T	83.2	Confident	82.3	Confident	47 Å²	47	93 Å²	93	29%	0.288	45%	0.45	S	S	.	.	H	α-helix	trans	-63.2	-41	179.3	-56.4	0	0	0	0	111.5	N287 S288 L294 R295	N287-T291 WeakPolarHBondContact O-CB 3.32Å; N287-T291 PolarHBondContact O-N 2.83Å; N287-T291 PolarHBondContact O-OG1 3.38Å; S288-T291 PolarHBondContact O-N 2.8Å; T291-L294 PolarHBondContact O-N 3.07Å; T291-R295 WeakPolarHBondContact O-CG 3.47Å; T291-R295 PolarHBondContact O-N 2.9Å
292	A	86.4	Confident	80.7	Confident	48 Å²	48	91.3 Å²	91.3	40%	0.397	45%	0.452	S	S	.	.	H	α-helix	trans	-62.9	-42.9	175.6	0	0	0	0	0	112	S288 E289 C290 R295 Q296	S288-A292 WeakPolarHBondContact O-CB 3.38Å; S288-A292 PolarHBondContact O-N 3.35Å; E289-A292 PolarHBondContact O-N 3.16Å; C290-A292 PolarHBondContact O-N 3.09Å; A292-R295 PolarHBondContact O-N 3.42Å; A292-Q296 WeakPolarHBondContact O-CG 3.39Å; A292-Q296 PolarHBondContact O-N 3.25Å
293	R	82.4	Confident	79.3	Confident	146 Å²	146	96.2 Å²	96.2	55%	0.551	47%	0.469	S	S	*	.	H	α-helix	trans	-65	-40.5	175.3	-71	178.9	-168.5	178.2	7.7	112.1	E289 C290 Q296 A297 L311	E289-R293 WeakPolarHBondContact O-CG 3.46Å; E289-R293 PolarHBondContact O-N 3.12Å; C290-R293 PolarHBondContact O-N 2.85Å; R293-Q296 PolarHBondContact O-N 2.9Å; R293-A297 WeakPolarHBondContact O-CB 3.5Å; R293-A297 PolarHBondContact O-N 3.32Å; R293-L311 HydrophobicContact CB-CD2 4.3Å
294	L	80.1	Confident	78.5	Confident	29 Å²	29	101.1 Å²	101.1	15%	0.152	50%	0.496	C	S	.	.	H	α-helix	trans	-62.4	-43.1	175.5	-176.6	66.7	0	0	0	111.3	C290 T291 Q296 A297 L298 L311 E312	C290-L294 WeakPolarHBondContact O-CB 3.3Å; C290-L294 PolarHBondContact O-N 3.47Å; T291-L294 PolarHBondContact O-N 3.07Å; L294-Q296 PolarHBondContact O-N 3.42Å; L294-A297 PolarHBondContact O-N 3Å; L294-L298 HydrophobicContact CG-CD1 4.36Å; L294-L298 WeakPolarHBondContact O-CG 3.47Å; L294-L298 PolarHBondContact O-N 3.27Å; L294-L311 HydrophobicContact CD1-CB 3.82Å; L294-E312 HydrophobicContact CD1-CG 3.88Å; L294-E312 HydrophobicContact CD2-CG 4.21Å
295	R	81.1	Confident	78.3	Confident	170 Å²	170	97.7 Å²	97.7	64%	0.642	50%	0.496	S	S	*	.	H	α-helix	trans	-61.2	-43.2	174	-73.5	178.3	-176.2	176.7	1.6	112	T291 A292 A297 L298 I299	T291-R295 WeakPolarHBondContact O-CG 3.47Å; T291-R295 PolarHBondContact O-N 2.9Å; A292-R295 PolarHBondContact O-N 3.42Å; R295-A297 VanDerWaalsContact C-N 3.34Å; R295-A297 PolarHBondContact O-N 3.49Å; R295-L298 PolarHBondContact O-N 3.1Å; R295-I299 VanDerWaalsContact O-CG1 3.3Å; R295-I299 WeakPolarHBondContact O-CG1 3.45Å; R295-I299 PolarHBondContact O-N 3.29Å
296	Q	81.3	Confident	78	Confident	119 Å²	119	96.5 Å²	96.5	56%	0.556	49%	0.493	S	S	*	.	H	α-helix	trans	-62.8	-40.1	174.9	-74.1	-179.4	-3.5	0	0	112.4	A292 R293 L294 I299 K300	A292-Q296 WeakPolarHBondContact O-CG 3.39Å; A292-Q296 PolarHBondContact O-N 3.25Å; R293-Q296 PolarHBondContact O-N 2.9Å; L294-Q296 PolarHBondContact O-N 3.42Å; Q296-I299 PolarHBondContact O-N 2.89Å; Q296-K300 WeakPolarHBondContact O-CG 3.39Å; Q296-K300 PolarHBondContact O-N 2.84Å
297	A	78	Confident	77.7	Confident	39 Å²	39	97.1 Å²	97.1	32%	0.322	50%	0.499	S	S	.	.	H	α-helix	trans	-65.1	-40.4	175.8	0	0	0	0	0	111.8	R293 L294 R295 K300 L311	R293-A297 WeakPolarHBondContact O-CB 3.5Å; R293-A297 PolarHBondContact O-N 3.32Å; L294-A297 PolarHBondContact O-N 3Å; R295-A297 VanDerWaalsContact C-N 3.34Å; R295-A297 PolarHBondContact O-N 3.49Å; A297-K300 PolarHBondContact O-N 2.94Å; A297-L311 HydrophobicContact CB-CD1 4.07Å
298	L	76.6	Confident	77.5	Confident	81 Å²	81	99.6 Å²	99.6	42%	0.424	51%	0.508	S	S	.	.	H	α-helix	trans	-63.7	-42	175	-75.2	168.7	0	0	0	112.2	L294 R295 K300 Q301 K308	L294-L298 HydrophobicContact CG-CD1 4.36Å; L294-L298 WeakPolarHBondContact O-CG 3.47Å; L294-L298 PolarHBondContact O-N 3.27Å; R295-L298 PolarHBondContact O-N 3.1Å; L298-K300 VanDerWaalsContact C-N 3.32Å; L298-K300 PolarHBondContact O-N 2.86Å; L298-Q301 WeakPolarHBondContact O-CB 3.39Å; L298-Q301 PolarHBondContact O-N 3.27Å; L298-K308 HydrophobicContact CD2-CD 4.21Å
299	I	78.5	Confident	77.4	Confident	141 Å²	141	100.5 Å²	100.5	72%	0.723	51%	0.506	S	S	*	.	H	α-helix	trans	-66.1	-34.5	177	-68.1	165.2	0	0	0	111.5	R295 Q296 Q301	R295-I299 VanDerWaalsContact O-CG1 3.3Å; R295-I299 WeakPolarHBondContact O-CG1 3.45Å; R295-I299 PolarHBondContact O-N 3.29Å; Q296-I299 PolarHBondContact O-N 2.89Å; I299-Q301 PolarHBondContact O-N 3.01Å; I299-Q301 VanDerWaalsContact O-N 3.1Å
300	K	78.3	Confident	77.2	Confident	163 Å²	163	100.6 Å²	100.6	71%	0.709	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-2.6	177.8	-76.5	-178.6	178.8	-175.9	0	114.2	Q296 A297 L298 S302	Q296-K300 WeakPolarHBondContact O-CG 3.39Å; Q296-K300 PolarHBondContact O-N 2.84Å; A297-K300 PolarHBondContact O-N 2.94Å; L298-K300 VanDerWaalsContact C-N 3.32Å; L298-K300 PolarHBondContact O-N 2.86Å; K300-S302 VanDerWaalsContact C-N 3.26Å; K300-S302 PolarHBondContact O-N 3.49Å
301	Q	57.3	Low	77.1	Confident	176 Å²	176	102 Å²	102	82%	0.822	52%	0.516	S	S	*	.			trans	9.4	54.8	164.6	-144.5	-179.8	12.2	0	0	118.2	L298 I299	L298-Q301 WeakPolarHBondContact O-CB 3.39Å; L298-Q301 PolarHBondContact O-N 3.27Å; I299-Q301 PolarHBondContact O-N 3.01Å; I299-Q301 VanDerWaalsContact O-N 3.1Å
302	S	52.7	Low	77.3	Confident	92 Å²	92	103.5 Å²	103.5	64%	0.643	52%	0.52	S	S	*	.	S	Bend	trans	-166.2	124	154.9	55.6	0	0	0	0	110.5	K300	K300-S302 VanDerWaalsContact C-N 3.26Å; K300-S302 PolarHBondContact O-N 3.49Å
303	Q	58.1	Low	77.4	Confident	180 Å²	180	104.9 Å²	104.9	84%	0.841	53%	0.526	S	S	*	.	S	Bend	trans	98.5	-32	151.5	-69.5	161.6	-17.7	0	0	122.9	S305	Q303-S305 PolarHBondContact O-N 3.46Å
304	D	64.9	Low	77.8	Confident	123 Å²	123	105.6 Å²	105.6	66%	0.658	53%	0.529	S	S	*	.			trans	-103.3	85.5	179.6	-75.6	-29.6	0	0	0	114.2	Q306	D304-Q306 PolarHBondContact O-N 3.17Å
305	S	77.9	Confident	78.1	Confident	87 Å²	87	104.8 Å²	104.8	61%	0.608	53%	0.526	S	S	*	.	H	α-helix	trans	-58.6	-30.6	174.7	61.3	0	0	0	0	113.5	Q303 I309	Q303-S305 PolarHBondContact O-N 3.46Å; S305-I309 WeakPolarHBondContact O-CD1 3.43Å; S305-I309 VanDerWaalsContact O-CG1 3.31Å; S305-I309 WeakPolarHBondContact O-CG1 3.26Å; S305-I309 PolarHBondContact O-N 3.43Å
306	Q	84.2	Confident	78.4	Confident	107 Å²	107	101.4 Å²	101.4	50%	0.5	52%	0.52	S	S	.	.	H	α-helix	trans	-73.5	-41.2	-175.1	-169.3	61.3	38.4	0	0	113	D304 K308 I309 N310	D304-Q306 PolarHBondContact O-N 3.17Å; Q306-K308 VanDerWaalsContact C-N 3.3Å; Q306-K308 PolarHBondContact O-N 3.34Å; Q306-I309 PolarHBondContact O-N 2.96Å; Q306-N310 PolarHBondContact NE2-OD1 3.05Å; Q306-N310 WeakPolarHBondContact O-CB 3.5Å; Q306-N310 VanDerWaalsContact O-CG 3.23Å; Q306-N310 PolarHBondContact O-N 3.49Å; Q306-N310 PolarHBondContact O-ND2 3.34Å
307	D	81.1	Confident	78.8	Confident	96 Å²	96	100.3 Å²	100.3	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-66.5	-36.7	179.6	-83	-5.6	0	0	0	111.6	N310 L311	D307-N310 PolarHBondContact O-N 3.46Å; D307-L311 WeakPolarHBondContact O-CB 3.47Å; D307-L311 WeakPolarHBondContact O-CG 3.3Å; D307-L311 PolarHBondContact O-N 3.2Å
308	K	82.6	Confident	79.1	Confident	88 Å²	88	99.1 Å²	99.1	38%	0.383	50%	0.503	S	S	.	.	H	α-helix	trans	-59.4	-50.6	171.8	-178.4	-179.9	169.3	-179.1	0	111.3	L298 Q306 N310 L311 E312	L298-K308 HydrophobicContact CD2-CD 4.21Å; Q306-K308 VanDerWaalsContact C-N 3.3Å; Q306-K308 PolarHBondContact O-N 3.34Å; K308-N310 VanDerWaalsContact C-N 3.33Å; K308-N310 PolarHBondContact O-N 3.47Å; K308-L311 PolarHBondContact O-N 3.11Å; K308-E312 WeakPolarHBondContact CE-OE1 3.43Å; K308-E312 IonicContact NZ-OE1 3.94Å; K308-E312 WeakPolarHBondContact O-CB 3.39Å; K308-E312 WeakPolarHBondContact O-CG 3.35Å; K308-E312 PolarHBondContact O-N 3.48Å
309	I	85.5	Confident	79.5	Confident	88 Å²	88	101.1 Å²	101.1	45%	0.451	51%	0.51	S	S	.	.	H	α-helix	trans	-60.8	-42.6	179.2	-67.7	165.9	0	0	0	111	S305 Q306 E312 S313	S305-I309 WeakPolarHBondContact O-CD1 3.43Å; S305-I309 VanDerWaalsContact O-CG1 3.31Å; S305-I309 WeakPolarHBondContact O-CG1 3.26Å; S305-I309 PolarHBondContact O-N 3.43Å; Q306-I309 PolarHBondContact O-N 2.96Å; I309-E312 PolarHBondContact O-N 3.18Å; I309-S313 WeakPolarHBondContact O-CB 3.33Å; I309-S313 PolarHBondContact O-N 3.41Å
310	N	86.5	Confident	80	Confident	84 Å²	84	100.5 Å²	100.5	45%	0.449	50%	0.502	S	S	.	.	H	α-helix	trans	-64.3	-41.2	178.7	-70.2	-18.9	0	0	0	112.1	Q306 D307 K308 R314	Q306-N310 PolarHBondContact NE2-OD1 3.05Å; Q306-N310 WeakPolarHBondContact O-CB 3.5Å; Q306-N310 VanDerWaalsContact O-CG 3.23Å; Q306-N310 PolarHBondContact O-N 3.49Å; Q306-N310 PolarHBondContact O-ND2 3.34Å; D307-N310 PolarHBondContact O-N 3.46Å; K308-N310 VanDerWaalsContact C-N 3.33Å; K308-N310 PolarHBondContact O-N 3.47Å; N310-R314 WeakPolarHBondContact O-CB 3.21Å; N310-R314 PolarHBondContact O-N 3.49Å
311	L	83.3	Confident	80.4	Confident	39 Å²	39	95.1 Å²	95.1	20%	0.204	48%	0.481	C	S	.	.	H	α-helix	trans	-68.6	-43.6	176.5	-79.1	165.8	0	0	0	111.9	R293 L294 A297 D307 K308 R314 C315	R293-L311 HydrophobicContact CB-CD2 4.3Å; L294-L311 HydrophobicContact CD1-CB 3.82Å; A297-L311 HydrophobicContact CB-CD1 4.07Å; D307-L311 WeakPolarHBondContact O-CB 3.47Å; D307-L311 WeakPolarHBondContact O-CG 3.3Å; D307-L311 PolarHBondContact O-N 3.2Å; K308-L311 PolarHBondContact O-N 3.11Å; L311-R314 PolarHBondContact O-N 3.41Å; L311-C315 PolarHBondContact O-N 3.13Å; L311-C315 PolarHBondContact O-SG 3.11Å
312	E	86.7	Confident	81.6	Confident	78 Å²	78	88 Å²	88	36%	0.364	45%	0.448	S	S	.	.	H	α-helix	trans	-59.7	-46.6	175.1	-75.3	176.2	176	0	0	111.2	L294 K308 I309 R314 C315 L316	L294-E312 HydrophobicContact CD1-CG 3.88Å; L294-E312 HydrophobicContact CD2-CG 4.21Å; K308-E312 WeakPolarHBondContact CE-OE1 3.43Å; K308-E312 IonicContact NZ-OE1 3.94Å; K308-E312 WeakPolarHBondContact O-CB 3.39Å; K308-E312 WeakPolarHBondContact O-CG 3.35Å; K308-E312 PolarHBondContact O-N 3.48Å; I309-E312 PolarHBondContact O-N 3.18Å; E312-R314 VanDerWaalsContact C-N 3.32Å; E312-R314 PolarHBondContact O-N 3.37Å; E312-C315 PolarHBondContact O-N 3.39Å; E312-L316 WeakPolarHBondContact O-CB 3.34Å; E312-L316 PolarHBondContact O-N 3.34Å
313	S	89.2	Confident	83.2	Confident	77 Å²	77	88.4 Å²	88.4	54%	0.538	44%	0.44	S	S	.	.	H	α-helix	trans	-60.4	-41.3	176.2	180	0	0	0	0	112.1	I309 Q317	I309-S313 WeakPolarHBondContact O-CB 3.33Å; I309-S313 PolarHBondContact O-N 3.41Å; S313-Q317 WeakPolarHBondContact O-CB 3.35Å; S313-Q317 PolarHBondContact O-N 3.03Å
314	R	89.6	Confident	84.4	Confident	160 Å²	160	84.8 Å²	84.8	60%	0.604	43%	0.425	S	S	*	.	H	α-helix	trans	-68.9	-41.6	178	-175.1	166.9	179.5	157.1	-0	112.7	N310 L311 E312 Q317 L318	N310-R314 WeakPolarHBondContact O-CB 3.21Å; N310-R314 PolarHBondContact O-N 3.49Å; L311-R314 PolarHBondContact O-N 3.41Å; E312-R314 VanDerWaalsContact C-N 3.32Å; E312-R314 PolarHBondContact O-N 3.37Å; R314-Q317 PolarHBondContact O-N 3.04Å; R314-L318 HydrophobicContact CG-CD1 4.36Å; R314-L318 WeakPolarHBondContact O-CG 3.43Å; R314-L318 PolarHBondContact O-N 3.44Å
315	C	86	Confident	85.1	Confident	13 Å²	13	84.9 Å²	84.9	9%	0.088	42%	0.416	C	S	.	.	H	α-helix	trans	-67.9	-39	177.9	-58.3	0	0	0	0	110.7	C290 L311 E312 Q317 L318 E319	C290-C315 VanDerWaalsContact C-SG 3.53Å; C290-C315 HydrophobicContact CB-CB 4.34Å; C290-C315 WeakPolarHBondContact CB-SG 3.46Å; C290-C315 WeakPolarHBondContact SG-CA 3.46Å; C290-C315 WeakPolarHBondContact SG-CB 3.28Å; C290-C315 PolarHBondContact SG-N 3.08Å; C290-C315 CovalentContact SG-SG 2.07Å; C290-C315 PolarHBondContact SG-SG 3.16Å; L311-C315 PolarHBondContact O-N 3.13Å; L311-C315 PolarHBondContact O-SG 3.11Å; E312-C315 PolarHBondContact O-N 3.39Å; C315-Q317 VanDerWaalsContact C-N 3.34Å; C315-Q317 PolarHBondContact O-N 3.13Å; C315-L318 PolarHBondContact O-N 3.23Å; C315-E319 WeakPolarHBondContact O-CB 3.48Å; C315-E319 PolarHBondContact O-N 3.43Å
316	L	87.7	Confident	85.2	Confident	99 Å²	99	85.6 Å²	85.6	52%	0.518	41%	0.406	S	S	.	.	H	α-helix	trans	-60.1	-40	171.2	-92.2	158.4	0	0	0	112.8	E312 E319 K320	E312-L316 WeakPolarHBondContact O-CB 3.34Å; E312-L316 PolarHBondContact O-N 3.34Å; L316-E319 PolarHBondContact O-N 2.88Å; L316-K320 WeakPolarHBondContact O-CG 3.38Å; L316-K320 PolarHBondContact O-N 2.88Å
317	Q	89.6	Confident	85.1	Confident	95 Å²	95	85.6 Å²	85.6	44%	0.444	41%	0.406	S	S	.	.	H	α-helix	trans	-67.3	-43.3	176.3	-174.1	60.3	39.8	0	0	111.6	S313 R314 C315 E319 K320 D321	S313-Q317 WeakPolarHBondContact O-CB 3.35Å; S313-Q317 PolarHBondContact O-N 3.03Å; R314-Q317 PolarHBondContact O-N 3.04Å; C315-Q317 VanDerWaalsContact C-N 3.34Å; C315-Q317 PolarHBondContact O-N 3.13Å; Q317-E319 VanDerWaalsContact C-N 3.28Å; Q317-E319 PolarHBondContact O-N 3.36Å; Q317-K320 PolarHBondContact O-N 3.47Å; Q317-D321 PolarHBondContact NE2-OD1 3.18Å; Q317-D321 WeakPolarHBondContact O-CB 3.48Å; Q317-D321 VanDerWaalsContact O-CG 3.25Å; Q317-D321 PolarHBondContact O-N 3.23Å
318	L	85.1	Confident	85.1	Confident	15 Å²	15	85.8 Å²	85.8	8%	0.079	41%	0.407	C	S	.	.	H	α-helix	trans	-62.5	-36.2	176	-75.3	171.6	0	0	0	112	L283 E286 N287 C290 R314 C315 D321 L322	L283-L318 HydrophobicContact CD2-CD2 4.08Å; E286-L318 HydrophobicContact CB-CD1 4.49Å; N287-L318 HydrophobicContact CB-CB 4.5Å; C290-L318 HydrophobicContact CB-CD1 3.94Å; R314-L318 HydrophobicContact CG-CD1 4.36Å; R314-L318 WeakPolarHBondContact O-CG 3.43Å; R314-L318 PolarHBondContact O-N 3.44Å; C315-L318 PolarHBondContact O-N 3.23Å; L318-D321 PolarHBondContact O-N 3.47Å; L318-L322 VanDerWaalsContact O-CB 3.31Å; L318-L322 WeakPolarHBondContact O-CB 3.44Å; L318-L322 WeakPolarHBondContact O-CG 3.46Å; L318-L322 PolarHBondContact O-N 2.9Å
319	E	85.7	Confident	85	Confident	122 Å²	122	84 Å²	84	57%	0.57	40%	0.399	S	S	*	.	H	α-helix	trans	-65.6	-43.7	174.7	-171.1	172.1	-160.5	0	0	111.8	C315 L316 Q317 L322 Q323	C315-E319 WeakPolarHBondContact O-CB 3.48Å; C315-E319 PolarHBondContact O-N 3.43Å; L316-E319 PolarHBondContact O-N 2.88Å; Q317-E319 VanDerWaalsContact C-N 3.28Å; Q317-E319 PolarHBondContact O-N 3.36Å; E319-L322 WeakPolarHBondContact O-CB 3.42Å; E319-L322 PolarHBondContact O-N 3.48Å; E319-Q323 WeakPolarHBondContact O-CB 3.43Å; E319-Q323 PolarHBondContact O-N 3.18Å
320	K	88.8	Confident	84.6	Confident	129 Å²	129	83.4 Å²	83.4	56%	0.561	40%	0.395	S	S	*	.	H	α-helix	trans	-62.2	-42.7	172.8	-74.1	179.9	179.7	179.3	0	112.5	L316 Q317 L322 Q323 M324	L316-K320 WeakPolarHBondContact O-CG 3.38Å; L316-K320 PolarHBondContact O-N 2.88Å; Q317-K320 PolarHBondContact O-N 3.47Å; K320-L322 VanDerWaalsContact C-N 3.34Å; K320-Q323 PolarHBondContact O-N 2.98Å; K320-M324 PolarHBondContact O-N 3.21Å
321	D	86.4	Confident	84.4	Confident	50 Å²	50	84.5 Å²	84.5	27%	0.267	40%	0.397	S	S	.	.	H	α-helix	trans	-67	-37.5	178.9	-68.8	-12	0	0	0	111.4	Q317 L318 M324 R325	Q317-D321 PolarHBondContact NE2-OD1 3.18Å; Q317-D321 WeakPolarHBondContact O-CB 3.48Å; Q317-D321 VanDerWaalsContact O-CG 3.25Å; Q317-D321 PolarHBondContact O-N 3.23Å; L318-D321 PolarHBondContact O-N 3.47Å; D321-M324 WeakPolarHBondContact OD1-CE 3.21Å; D321-R325 WeakPolarHBondContact O-CG 3.5Å; D321-R325 PolarHBondContact O-N 2.9Å; D321-R325 VanDerWaalsContact O-N 3.1Å
322	L	81.6	Confident	84.1	Confident	25 Å²	25	86.5 Å²	86.5	13%	0.131	40%	0.403	C	S	.	.	H	α-helix	trans	-61.7	-44.4	171.4	-87.7	165.6	0	0	0	111.7	L283 R284 N287 L318 E319 K320 R325 Y326	L283-L322 HydrophobicContact CB-CD1 4.47Å; L283-L322 HydrophobicContact CB-CD2 3.4Å; L283-L322 HydrophobicContact CB-CG 3.75Å; L283-L322 HydrophobicContact CD1-CD2 4.18Å; L283-L322 HydrophobicContact CD1-CG 4.3Å; L283-L322 HydrophobicContact CG-CD2 4.46Å; R284-L322 HydrophobicContact CG-CD2 3.97Å; N287-L322 HydrophobicContact CB-CD1 3.81Å; L318-L322 VanDerWaalsContact O-CB 3.31Å; L318-L322 WeakPolarHBondContact O-CB 3.44Å; L318-L322 WeakPolarHBondContact O-CG 3.46Å; L318-L322 PolarHBondContact O-N 2.9Å; E319-L322 WeakPolarHBondContact O-CB 3.42Å; E319-L322 PolarHBondContact O-N 3.48Å; K320-L322 VanDerWaalsContact C-N 3.34Å; L322-R325 PolarHBondContact O-N 3.41Å; L322-Y326 WeakPolarHBondContact O-CB 3.31Å; L322-Y326 PolarHBondContact O-N 3.45Å
323	Q	86.7	Confident	83.6	Confident	102 Å²	102	84.1 Å²	84.1	48%	0.477	39%	0.393	S	S	.	.	H	α-helix	trans	-63.3	-48.3	179.5	-177.3	62.2	21.8	0	0	111.5	E319 K320 R325 Y326 E327	E319-Q323 WeakPolarHBondContact O-CB 3.43Å; E319-Q323 PolarHBondContact O-N 3.18Å; K320-Q323 PolarHBondContact O-N 2.98Å; Q323-R325 VanDerWaalsContact C-N 3.33Å; Q323-R325 PolarHBondContact O-N 2.88Å; Q323-Y326 WeakPolarHBondContact O-CB 3.24Å; Q323-Y326 PolarHBondContact O-N 2.93Å; Q323-Y326 VanDerWaalsContact O-N 3.14Å; Q323-E327 PolarHBondContact NE2-OE1 3.22Å; Q323-E327 PolarHBondContact O-N 3.4Å
324	M	82.6	Confident	82.9	Confident	104 Å²	104	85.2 Å²	85.2	51%	0.512	39%	0.393	S	S	.	.	H	α-helix	trans	-59.8	-42.3	177.1	-72.6	-172.7	-64.5	0	0	112	K320 D321 Y326 E327 D328	K320-M324 PolarHBondContact O-N 3.21Å; D321-M324 WeakPolarHBondContact OD1-CE 3.21Å; M324-Y326 VanDerWaalsContact C-N 3.32Å; M324-Y326 PolarHBondContact O-N 3.26Å; M324-E327 PolarHBondContact O-N 2.91Å; M324-D328 PolarHBondContact O-N 3.3Å
325	R	80.5	Confident	82.3	Confident	125 Å²	125	81.3 Å²	81.3	47%	0.472	38%	0.382	S	S	.	.	H	α-helix	trans	-71.8	-26.4	177.4	-71.7	-156.5	-168.5	-107.5	3	113.6	N280 L283 D321 L322 Q323 K329	N280-R325 WeakPolarHBondContact OD1-CB 3.48Å; L283-R325 HydrophobicContact CD1-CG 4.24Å; D321-R325 WeakPolarHBondContact O-CG 3.5Å; D321-R325 PolarHBondContact O-N 2.9Å; D321-R325 VanDerWaalsContact O-N 3.1Å; L322-R325 PolarHBondContact O-N 3.41Å; Q323-R325 VanDerWaalsContact C-N 3.33Å; Q323-R325 PolarHBondContact O-N 2.88Å; R325-K329 VanDerWaalsContact O-CB 3.28Å; R325-K329 WeakPolarHBondContact O-CB 3.32Å; R325-K329 PolarHBondContact O-N 2.92Å
326	Y	79.1	Confident	81.8	Confident	102 Å²	102	81.6 Å²	81.6	40%	0.4	38%	0.382	S	S	.	.	H	α-helix	trans	-68	-44.3	171.4	-178.3	-96.2	0	0	0	110.6	L322 Q323 M324 K329 M330	L322-Y326 WeakPolarHBondContact O-CB 3.31Å; L322-Y326 PolarHBondContact O-N 3.45Å; Q323-Y326 WeakPolarHBondContact O-CB 3.24Å; Q323-Y326 PolarHBondContact O-N 2.93Å; Q323-Y326 VanDerWaalsContact O-N 3.14Å; M324-Y326 VanDerWaalsContact C-N 3.32Å; M324-Y326 PolarHBondContact O-N 3.26Å; Y326-K329 WeakPolarHBondContact O-CB 3.43Å; Y326-K329 PolarHBondContact O-N 3.28Å; Y326-M330 HydrophobicContact CD1-CG 4.17Å; Y326-M330 HydrophobicContact CE1-CG 3.76Å; Y326-M330 HydrophobicContact CE1-SD 4.45Å; Y326-M330 WeakPolarHBondContact O-CG 3.39Å; Y326-M330 PolarHBondContact O-N 2.99Å
327	E	83.2	Confident	81	Confident	107 Å²	107	82 Å²	82	50%	0.5	38%	0.381	S	S	.	.	H	α-helix	trans	-61.3	-46.8	174.7	-71.8	170.4	-167.4	0	0	111.9	Q323 M324 K329 M330 H331	Q323-E327 PolarHBondContact NE2-OE1 3.22Å; Q323-E327 PolarHBondContact O-N 3.4Å; M324-E327 PolarHBondContact O-N 2.91Å; E327-K329 VanDerWaalsContact C-N 3.31Å; E327-K329 PolarHBondContact O-N 3.13Å; E327-M330 PolarHBondContact O-N 3.3Å; E327-M330 VanDerWaalsContact O-N 3.15Å; E327-H331 PolarHBondContact O-N 3.23Å
328	D	79.9	Confident	80.3	Confident	100 Å²	100	81.5 Å²	81.5	54%	0.535	38%	0.381	S	S	.	.	H	α-helix	trans	-57.7	-44	173.7	-81.2	-11.5	0	0	0	111.6	M324 M330 H331 W332	M324-D328 PolarHBondContact O-N 3.3Å; D328-M330 PolarHBondContact O-N 3.24Å; D328-H331 WeakPolarHBondContact O-CB 3.42Å; D328-H331 PolarHBondContact O-N 3.46Å; D328-W332 PolarHBondContact O-N 2.66Å
329	K	80.3	Confident	79.6	Confident	50 Å²	50	81.2 Å²	81.2	22%	0.217	38%	0.38	C	S	.	.	H	α-helix	trans	-60.2	-46.5	176.2	175.1	-174	163.1	178.4	0	110.8	A276 N277 R325 Y326 E327 H331 W332 V333	A276-K329 HydrophobicContact CB-CB 4.23Å; A276-K329 HydrophobicContact CB-CG 4.45Å; N277-K329 WeakPolarHBondContact OD1-CD 3.47Å; N277-K329 WeakPolarHBondContact OD1-CE 3.48Å; N277-K329 PolarHBondContact OD1-NZ 2.94Å; R325-K329 VanDerWaalsContact O-CB 3.28Å; R325-K329 WeakPolarHBondContact O-CB 3.32Å; R325-K329 PolarHBondContact O-N 2.92Å; Y326-K329 WeakPolarHBondContact O-CB 3.43Å; Y326-K329 PolarHBondContact O-N 3.28Å; E327-K329 VanDerWaalsContact C-N 3.31Å; E327-K329 PolarHBondContact O-N 3.13Å; K329-H331 VanDerWaalsContact C-N 3.28Å; K329-H331 PolarHBondContact O-N 3.3Å; K329-W332 PolarHBondContact O-N 3.16Å; K329-W332 VanDerWaalsContact O-N 3.16Å; K329-V333 HydrophobicContact CG-CG2 4.33Å; K329-V333 WeakPolarHBondContact O-CG2 3.07Å; K329-V333 PolarHBondContact O-N 3.5Å
330	M	79	Confident	78.9	Confident	76 Å²	76	79.2 Å²	79.2	37%	0.374	37%	0.371	S	S	.	.	H	α-helix	trans	-62.7	-36.8	-179.4	-70.5	-61.8	-89.4	0	0	111.5	Y326 E327 D328 V333 N334	Y326-M330 HydrophobicContact CD1-CG 4.17Å; Y326-M330 HydrophobicContact CE1-CG 3.76Å; Y326-M330 HydrophobicContact CE1-SD 4.45Å; Y326-M330 WeakPolarHBondContact O-CG 3.39Å; Y326-M330 PolarHBondContact O-N 2.99Å; E327-M330 PolarHBondContact O-N 3.3Å; E327-M330 VanDerWaalsContact O-N 3.15Å; D328-M330 PolarHBondContact O-N 3.24Å; M330-V333 PolarHBondContact O-N 3.49Å; M330-N334 VanDerWaalsContact O-CG 3.29Å; M330-N334 PolarHBondContact O-N 2.65Å; M330-N334 PolarHBondContact O-ND2 3.02Å
331	H	82	Confident	77.9	Confident	106 Å²	106	74.8 Å²	74.8	49%	0.491	36%	0.359	S	S	.	.	H	α-helix	trans	-57.5	-48.9	171.5	177.9	-74.4	0	0	0	111.9	E327 D328 K329 V333 N334 E335	E327-H331 PolarHBondContact O-N 3.23Å; D328-H331 WeakPolarHBondContact O-CB 3.42Å; D328-H331 PolarHBondContact O-N 3.46Å; K329-H331 VanDerWaalsContact C-N 3.28Å; K329-H331 PolarHBondContact O-N 3.3Å; H331-V333 PolarHBondContact O-N 2.73Å; H331-N334 PolarHBondContact O-N 2.87Å; H331-E335 PolarHBondContact O-N 3.42Å; H331-E335 VanDerWaalsContact O-N 3.12Å
332	W	76.3	Confident	77.1	Confident	82 Å²	82	78 Å²	78	31%	0.311	37%	0.37	S	S	.	.	H	α-helix	trans	-66.5	-36.1	179.5	-66.6	114.4	0	0	0	113.6	L269 K272 V273 D328 K329 E335 L336	L269-W332 HydrophobicContact CD2-CE3 3.43Å; L269-W332 VanDerWaalsContact CD2-CE3 3.43Å; L269-W332 HydrophobicContact CD2-CZ3 3.71Å; K272-W332 HydrophobicContact CB-CD2 4.49Å; K272-W332 HydrophobicContact CD-CD2 4.29Å; K272-W332 HydrophobicContact CD-CE3 3.98Å; K272-W332 HydrophobicContact CD-CH2 3.93Å; K272-W332 HydrophobicContact CD-CZ2 4.23Å; K272-W332 HydrophobicContact CD-CZ3 3.79Å; V273-W332 HydrophobicContact CG2-CB 3.79Å; D328-W332 PolarHBondContact O-N 2.66Å; K329-W332 PolarHBondContact O-N 3.16Å; K329-W332 VanDerWaalsContact O-N 3.16Å; W332-E335 PolarHBondContact O-N 3.3Å; W332-L336 WeakPolarHBondContact O-CB 3.49Å; W332-L336 PolarHBondContact O-N 3.43Å
333	V	76	Confident	76.4	Confident	28 Å²	28	77.9 Å²	77.9	17%	0.17	37%	0.369	C	S	.	.	H	α-helix	trans	-65.4	-41.5	176.1	171	0	0	0	0	111	V273 K329 M330 H331 L336 H337	V273-V333 HydrophobicContact CG1-CG2 4.01Å; V273-V333 HydrophobicContact CG2-CG2 4.15Å; K329-V333 HydrophobicContact CG-CG2 4.33Å; K329-V333 WeakPolarHBondContact O-CG2 3.07Å; K329-V333 PolarHBondContact O-N 3.5Å; M330-V333 PolarHBondContact O-N 3.49Å; H331-V333 PolarHBondContact O-N 2.73Å; V333-L336 PolarHBondContact O-N 2.66Å; V333-H337 PolarHBondContact O-N 3.46Å
334	N	74.9	Confident	75.5	Confident	99 Å²	99	76.8 Å²	76.8	53%	0.529	37%	0.37	S	S	.	.	H	α-helix	trans	-64.4	-42.1	176.9	-72	-18.5	0	0	0	112.3	M330 H331 L336 H337 L338	M330-N334 VanDerWaalsContact O-CG 3.29Å; M330-N334 PolarHBondContact O-N 2.65Å; M330-N334 PolarHBondContact O-ND2 3.02Å; H331-N334 PolarHBondContact O-N 2.87Å; N334-L336 VanDerWaalsContact C-N 3.34Å; N334-H337 PolarHBondContact O-N 3.01Å; N334-L338 PolarHBondContact O-N 2.78Å
335	E	77.7	Confident	74.5	Confident	79 Å²	79	77.2 Å²	77.2	37%	0.369	37%	0.372	S	S	.	.	H	α-helix	trans	-62.7	-40.3	174.3	-79.4	-65.3	140.9	0	0	112.2	L269 H331 W332 L338 C339	L269-E335 HydrophobicContact CD1-CB 4.2Å; L269-E335 HydrophobicContact CD2-CB 4.31Å; H331-E335 PolarHBondContact O-N 3.42Å; H331-E335 VanDerWaalsContact O-N 3.12Å; W332-E335 PolarHBondContact O-N 3.3Å; E335-L338 PolarHBondContact O-N 2.8Å; E335-C339 PolarHBondContact O-N 2.78Å; E335-C339 PolarHBondContact O-SG 3.34Å
336	L	73.9	Confident	73.8	Confident	19 Å²	19	72.9 Å²	72.9	10%	0.099	36%	0.363	C	S	.	.	H	α-helix	trans	-61.8	-49.7	176	-178.5	66.7	0	0	0	111	V266 L269 V273 W332 V333 N334 L338 C339 E340	V266-L336 HydrophobicContact CB-CD1 4.48Å; V266-L336 HydrophobicContact CG1-CD1 3.94Å; L269-L336 HydrophobicContact CB-CB 4.38Å; L269-L336 HydrophobicContact CB-CD1 3.82Å; V273-L336 HydrophobicContact CG2-CD2 4.47Å; W332-L336 WeakPolarHBondContact O-CB 3.49Å; W332-L336 PolarHBondContact O-N 3.43Å; V333-L336 PolarHBondContact O-N 2.66Å; N334-L336 VanDerWaalsContact C-N 3.34Å; L336-L338 VanDerWaalsContact C-N 3.28Å; L336-L338 PolarHBondContact O-N 3.08Å; L336-C339 PolarHBondContact O-N 3.43Å; L336-C339 VanDerWaalsContact O-N 3.09Å; L336-E340 HydrophobicContact CD1-CG 4.48Å; L336-E340 WeakPolarHBondContact O-CG 3.49Å; L336-E340 PolarHBondContact O-N 3.17Å
337	H	72.6	Confident	73.3	Confident	107 Å²	107	70.9 Å²	70.9	50%	0.495	36%	0.357	S	S	.	.	H	α-helix	trans	-60	-37.9	177.3	-69.3	163.6	0	0	0	112.4	V333 N334 C339 E340 A341	V333-H337 PolarHBondContact O-N 3.46Å; N334-H337 PolarHBondContact O-N 3.01Å; H337-C339 VanDerWaalsContact C-N 3.33Å; H337-C339 PolarHBondContact O-N 2.86Å; H337-E340 IonicContact CD2-OE2 2.8Å; H337-E340 PolarHBondContact O-N 2.92Å; H337-A341 VanDerWaalsContact O-CB 3.26Å; H337-A341 WeakPolarHBondContact O-CB 3.16Å; H337-A341 PolarHBondContact O-N 3.22Å
338	L	74.2	Confident	72.5	Confident	84 Å²	84	68.8 Å²	68.8	44%	0.44	36%	0.355	S	S	.	.	H	α-helix	trans	-64	-39.4	175.9	-175.6	65.3	0	0	0	111.7	N334 E335 L336 K342	N334-L338 PolarHBondContact O-N 2.78Å; E335-L338 PolarHBondContact O-N 2.8Å; L336-L338 VanDerWaalsContact C-N 3.28Å; L336-L338 PolarHBondContact O-N 3.08Å; L338-K342 WeakPolarHBondContact O-CG 3.48Å; L338-K342 PolarHBondContact O-N 2.73Å; L338-K342 VanDerWaalsContact O-N 3.11Å
339	C	69.7	Low	71.9	Confident	9 Å²	9	72.6 Å²	72.6	6%	0.061	36%	0.361	C	S	.	.	H	α-helix	trans	-71.3	-42.4	177.8	-65.3	0	0	0	0	112.1	L265 V266 L269 E335 L336 H337 A341 K342 L343	L265-C339 HydrophobicContact CD2-CB 4.46Å; L265-C339 WeakPolarHBondContact CD2-SG 3.32Å; V266-C339 HydrophobicContact CG2-CB 3.69Å; L269-C339 HydrophobicContact CD1-CB 4.45Å; E335-C339 PolarHBondContact O-N 2.78Å; E335-C339 PolarHBondContact O-SG 3.34Å; L336-C339 PolarHBondContact O-N 3.43Å; L336-C339 VanDerWaalsContact O-N 3.09Å; H337-C339 VanDerWaalsContact C-N 3.33Å; H337-C339 PolarHBondContact O-N 2.86Å; C339-A341 VanDerWaalsContact C-N 3.35Å; C339-K342 PolarHBondContact O-N 2.76Å; C339-L343 WeakPolarHBondContact O-CB 3.22Å; C339-L343 PolarHBondContact O-N 3.26Å
340	E	71.1	Confident	71.1	Confident	80 Å²	80	75.5 Å²	75.5	37%	0.374	37%	0.371	S	S	.	.	H	α-helix	trans	-62.5	-40.5	174.2	-72.4	177.3	164.4	0	0	111.8	V266 L336 H337 K342 L343 T344	V266-E340 HydrophobicContact CG1-CG 4.33Å; L336-E340 HydrophobicContact CD1-CG 4.48Å; L336-E340 WeakPolarHBondContact O-CG 3.49Å; L336-E340 PolarHBondContact O-N 3.17Å; H337-E340 IonicContact CD2-OE2 2.8Å; H337-E340 PolarHBondContact O-N 2.92Å; E340-K342 PolarHBondContact O-N 2.86Å; E340-L343 PolarHBondContact O-N 3.48Å; E340-T344 WeakPolarHBondContact O-CB 3.4Å; E340-T344 VanDerWaalsContact O-CG2 3.31Å; E340-T344 WeakPolarHBondContact O-CG2 3.46Å; E340-T344 PolarHBondContact O-N 3.16Å; E340-T344 PolarHBondContact O-OG1 3.25Å
341	A	67.7	Low	70.5	Confident	37 Å²	37	79.5 Å²	79.5	31%	0.306	38%	0.382	S	S	.	.	H	α-helix	trans	-62	-41	174	0	0	0	0	0	112.1	H337 C339 T344 M345	H337-A341 VanDerWaalsContact O-CB 3.26Å; H337-A341 WeakPolarHBondContact O-CB 3.16Å; H337-A341 PolarHBondContact O-N 3.22Å; C339-A341 VanDerWaalsContact C-N 3.35Å; A341-T344 WeakPolarHBondContact CA-OG1 3.44Å; A341-T344 PolarHBondContact O-OG1 2.91Å; A341-M345 WeakPolarHBondContact O-CB 3.34Å; A341-M345 VanDerWaalsContact O-CG 3.31Å; A341-M345 WeakPolarHBondContact O-CG 3.16Å; A341-M345 PolarHBondContact O-N 3.32Å
342	K	69.7	Low	69.6	Low	116 Å²	116	79.5 Å²	79.5	50%	0.504	38%	0.382	S	S	.	.	H	α-helix	trans	-65.7	-42.3	174.7	-74.9	175.7	-179.4	177.1	0	112.1	L262 L338 C339 E340 A346	L262-K342 HydrophobicContact CD2-CB 4.15Å; L338-K342 WeakPolarHBondContact O-CG 3.48Å; L338-K342 PolarHBondContact O-N 2.73Å; L338-K342 VanDerWaalsContact O-N 3.11Å; C339-K342 PolarHBondContact O-N 2.76Å; E340-K342 PolarHBondContact O-N 2.86Å; K342-A346 WeakPolarHBondContact O-CB 3.47Å; K342-A346 PolarHBondContact O-N 2.81Å
343	L	67.7	Low	68.3	Low	23 Å²	23	80.2 Å²	80.2	12%	0.12	39%	0.391	C	S	.	.	H	α-helix	trans	-63.6	-47.8	178.8	-168.2	77.1	0	0	0	111.1	L259 L262 C339 E340 M345 A346 E347	L259-L343 HydrophobicContact CD2-CD1 3.94Å; L262-L343 HydrophobicContact CB-CD1 4.22Å; C339-L343 WeakPolarHBondContact O-CB 3.22Å; C339-L343 PolarHBondContact O-N 3.26Å; E340-L343 PolarHBondContact O-N 3.48Å; L343-M345 PolarHBondContact O-N 2.94Å; L343-A346 PolarHBondContact O-N 3.1Å; L343-E347 WeakPolarHBondContact O-CG 3.21Å; L343-E347 PolarHBondContact O-N 3.24Å
344	T	66.8	Low	67.4	Low	80 Å²	80	83.3 Å²	83.3	49%	0.491	40%	0.404	S	S	.	.	H	α-helix	trans	-64.5	-39	178.6	50.6	0	0	0	0	112.6	E340 A341 E347 S348	E340-T344 WeakPolarHBondContact O-CB 3.4Å; E340-T344 VanDerWaalsContact O-CG2 3.31Å; E340-T344 WeakPolarHBondContact O-CG2 3.46Å; E340-T344 PolarHBondContact O-N 3.16Å; E340-T344 PolarHBondContact O-OG1 3.25Å; A341-T344 WeakPolarHBondContact CA-OG1 3.44Å; A341-T344 PolarHBondContact O-OG1 2.91Å; T344-E347 PolarHBondContact O-N 2.75Å; T344-S348 VanDerWaalsContact O-CB 3.24Å; T344-S348 WeakPolarHBondContact O-CB 3.27Å; T344-S348 PolarHBondContact O-N 3.22Å
345	M	61.8	Low	66.9	Low	112 Å²	112	84 Å²	84	55%	0.552	41%	0.407	S	S	*	.	H	α-helix	trans	-62.7	-41.3	172.4	-76.2	-171.9	-138.5	0	0	112.1	A341 L343 R349	A341-M345 WeakPolarHBondContact O-CB 3.34Å; A341-M345 VanDerWaalsContact O-CG 3.31Å; A341-M345 WeakPolarHBondContact O-CG 3.16Å; A341-M345 PolarHBondContact O-N 3.32Å; L343-M345 PolarHBondContact O-N 2.94Å; M345-R349 WeakPolarHBondContact O-CB 3.46Å; M345-R349 VanDerWaalsContact O-CG 3.3Å; M345-R349 WeakPolarHBondContact O-CG 3.4Å; M345-R349 PolarHBondContact O-N 3.09Å
346	A	66.3	Low	65.8	Low	34 Å²	34	83.7 Å²	83.7	28%	0.281	41%	0.408	S	S	.	.	H	α-helix	trans	-67.7	-42	178.4	0	0	0	0	0	112	L259 K342 L343 R349 R350	L259-A346 HydrophobicContact CD2-CB 3.74Å; K342-A346 WeakPolarHBondContact O-CB 3.47Å; K342-A346 PolarHBondContact O-N 2.81Å; L343-A346 PolarHBondContact O-N 3.1Å; A346-R349 PolarHBondContact O-N 3.32Å; A346-R350 WeakPolarHBondContact O-CB 3.43Å; A346-R350 PolarHBondContact O-N 3.3Å
347	E	68	Low	64.7	Low	61 Å²	61	87 Å²	87	29%	0.285	43%	0.428	S	S	.	.	H	α-helix	trans	-66.1	-39.9	174.7	-73.3	-176.3	174.3	0	0	112.4	R263 L343 T344 R350 R351	R263-E347 IonicContact NH2-OE1 2.78Å; R263-E347 PolarHBondContact NH2-OE1 3.5Å; L343-E347 WeakPolarHBondContact O-CG 3.21Å; L343-E347 PolarHBondContact O-N 3.24Å; T344-E347 PolarHBondContact O-N 2.75Å; E347-R350 WeakPolarHBondContact O-CB 3.31Å; E347-R350 PolarHBondContact O-N 2.99Å; E347-R351 WeakPolarHBondContact O-CG 3.41Å; E347-R351 PolarHBondContact O-N 2.71Å
348	S	67.8	Low	64	Low	63 Å²	63	85.4 Å²	85.4	44%	0.441	42%	0.421	S	S	.	.	H	α-helix	trans	-61.3	-47	174.5	-178.5	0	0	0	0	111.4	T344 R350 R351 E352	T344-S348 VanDerWaalsContact O-CB 3.24Å; T344-S348 WeakPolarHBondContact O-CB 3.27Å; T344-S348 PolarHBondContact O-N 3.22Å; S348-R350 VanDerWaalsContact C-N 3.31Å; S348-R350 PolarHBondContact O-N 3.09Å; S348-R351 PolarHBondContact O-N 2.95Å; S348-E352 PolarHBondContact O-N 2.94Å
349	R	66.8	Low	63.4	Low	179 Å²	179	88.9 Å²	88.9	68%	0.675	43%	0.428	S	S	*	.	H	α-helix	trans	-60.7	-39.6	174.8	-74.6	175.5	-178.6	-176.1	0.8	112.3	M345 A346 E352 L353	M345-R349 WeakPolarHBondContact O-CB 3.46Å; M345-R349 VanDerWaalsContact O-CG 3.3Å; M345-R349 WeakPolarHBondContact O-CG 3.4Å; M345-R349 PolarHBondContact O-N 3.09Å; A346-R349 PolarHBondContact O-N 3.32Å; R349-E352 PolarHBondContact O-N 2.56Å; R349-L353 WeakPolarHBondContact O-CB 3.49Å; R349-L353 PolarHBondContact O-N 2.85Å
350	R	63.6	Low	62.3	Low	112 Å²	112	91.7 Å²	91.7	42%	0.423	45%	0.445	S	S	.	.	H	α-helix	trans	-60.6	-49	174.3	178.9	-178.2	171.2	163.5	4	111.2	A346 E347 S348 E352 L353 E354	A346-R350 WeakPolarHBondContact O-CB 3.43Å; A346-R350 PolarHBondContact O-N 3.3Å; E347-R350 WeakPolarHBondContact O-CB 3.31Å; E347-R350 PolarHBondContact O-N 2.99Å; S348-R350 VanDerWaalsContact C-N 3.31Å; S348-R350 PolarHBondContact O-N 3.09Å; R350-E352 PolarHBondContact O-N 2.96Å; R350-L353 PolarHBondContact O-N 3.35Å; R350-E354 WeakPolarHBondContact CG-OE1 3.41Å; R350-E354 IonicContact CZ-OE1 3.43Å; R350-E354 IonicContact NE-OE1 3.33Å; R350-E354 PolarHBondContact NE-OE1 2.97Å; R350-E354 IonicContact NH2-OE1 2.73Å; R350-E354 WeakPolarHBondContact O-CG 3.47Å; R350-E354 PolarHBondContact O-N 2.88Å
351	R	67.3	Low	61.2	Low	159 Å²	159	91.7 Å²	91.7	60%	0.6	44%	0.442	S	S	*	.	H	α-helix	trans	-63.6	-40.3	177.8	-71.3	-175.6	-159.9	162.2	8.3	112.6	E347 S348 L353 E354 L355	E347-R351 WeakPolarHBondContact O-CG 3.41Å; E347-R351 PolarHBondContact O-N 2.71Å; S348-R351 PolarHBondContact O-N 2.95Å; R351-L353 VanDerWaalsContact C-N 3.33Å; R351-L353 PolarHBondContact O-N 2.83Å; R351-E354 PolarHBondContact O-N 2.86Å; R351-L355 WeakPolarHBondContact O-CB 3.44Å; R351-L355 WeakPolarHBondContact O-CG 3.34Å; R351-L355 PolarHBondContact O-N 2.79Å
352	E	62.2	Low	60.8	Low	106 Å²	106	95 Å²	95	50%	0.495	45%	0.451	S	S	.	.	H	α-helix	trans	-60.9	-43.1	174.3	-79.8	-169.4	165.7	0	0	111.3	S348 R349 R350 L355 L356	S348-E352 PolarHBondContact O-N 2.94Å; R349-E352 PolarHBondContact O-N 2.56Å; R350-E352 PolarHBondContact O-N 2.96Å; E352-L355 PolarHBondContact O-N 3.45Å; E352-L356 WeakPolarHBondContact O-CB 3.47Å; E352-L356 PolarHBondContact O-N 3.17Å
353	L	48.7	Very low	59.9	Low	97 Å²	97	92.9 Å²	92.9	51%	0.508	44%	0.442	S	S	.	.	H	α-helix	trans	-64.5	-44.1	176.7	-156.2	89.1	0	0	0	111.5	R349 R350 R351 L355 L356 V357	R349-L353 WeakPolarHBondContact O-CB 3.49Å; R349-L353 PolarHBondContact O-N 2.85Å; R350-L353 PolarHBondContact O-N 3.35Å; R351-L353 VanDerWaalsContact C-N 3.33Å; R351-L353 PolarHBondContact O-N 2.83Å; L353-L355 PolarHBondContact O-N 3.37Å; L353-L356 PolarHBondContact O-N 3.48Å; L353-L356 VanDerWaalsContact O-N 3.14Å; L353-V357 WeakPolarHBondContact O-CB 3.15Å; L353-V357 VanDerWaalsContact O-CG2 3.31Å; L353-V357 WeakPolarHBondContact O-CG2 3.21Å; L353-V357 PolarHBondContact O-N 2.73Å
354	E	58.1	Low	58.9	Low	94 Å²	94	96.1 Å²	96.1	44%	0.439	46%	0.459	S	S	.	.	H	α-helix	trans	-59.2	-45	175.3	-74.7	169.6	-179.6	0	0	111.1	R350 R351 L356 V357 E358	R350-E354 WeakPolarHBondContact CG-OE1 3.41Å; R350-E354 IonicContact CZ-OE1 3.43Å; R350-E354 IonicContact NE-OE1 3.33Å; R350-E354 PolarHBondContact NE-OE1 2.97Å; R350-E354 IonicContact NH2-OE1 2.73Å; R350-E354 WeakPolarHBondContact O-CG 3.47Å; R350-E354 PolarHBondContact O-N 2.88Å; R351-E354 PolarHBondContact O-N 2.86Å; E354-L356 VanDerWaalsContact C-N 3.32Å; E354-L356 PolarHBondContact O-N 2.66Å; E354-V357 PolarHBondContact O-N 3.41Å; E354-E358 WeakPolarHBondContact O-CB 3.32Å; E354-E358 PolarHBondContact O-N 3.4Å
355	L	64.5	Low	58.3	Low	112 Å²	112	98 Å²	98	59%	0.586	46%	0.462	S	S	*	.	H	α-helix	trans	-63.9	-35.4	174.4	-75.2	170.9	0	0	0	112.6	R351 E352 L353 R359	R351-L355 WeakPolarHBondContact O-CB 3.44Å; R351-L355 WeakPolarHBondContact O-CG 3.34Å; R351-L355 PolarHBondContact O-N 2.79Å; E352-L355 PolarHBondContact O-N 3.45Å; L353-L355 PolarHBondContact O-N 3.37Å; L355-R359 WeakPolarHBondContact O-CB 3.4Å; L355-R359 PolarHBondContact O-N 3.28Å
356	L	53.5	Low	58	Low	74 Å²	74	99 Å²	99	39%	0.387	47%	0.47	S	S	.	.	H	α-helix	trans	-72.6	-41.9	179.5	-146.3	148.9	0	0	0	110.8	E352 L353 E354 E358 R359 V360	E352-L356 WeakPolarHBondContact O-CB 3.47Å; E352-L356 PolarHBondContact O-N 3.17Å; L353-L356 PolarHBondContact O-N 3.48Å; L353-L356 VanDerWaalsContact O-N 3.14Å; E354-L356 VanDerWaalsContact C-N 3.32Å; E354-L356 PolarHBondContact O-N 2.66Å; L356-E358 VanDerWaalsContact C-N 3.35Å; L356-R359 PolarHBondContact O-N 3.32Å; L356-V360 HydrophobicContact CD2-CG2 4.3Å; L356-V360 WeakPolarHBondContact O-CG2 3.44Å; L356-V360 PolarHBondContact O-N 2.84Å
357	V	51	Low	57	Low	87 Å²	87	101.2 Å²	101.2	53%	0.527	48%	0.477	S	S	.	.	H	α-helix	trans	-60	-45.6	171.4	170.2	0	0	0	0	110.3	L353 E354 R359 V360 R361	L353-V357 WeakPolarHBondContact O-CB 3.15Å; L353-V357 VanDerWaalsContact O-CG2 3.31Å; L353-V357 WeakPolarHBondContact O-CG2 3.21Å; L353-V357 PolarHBondContact O-N 2.73Å; E354-V357 PolarHBondContact O-N 3.41Å; V357-R359 VanDerWaalsContact C-N 3.33Å; V357-R359 PolarHBondContact O-N 3.18Å; V357-V360 PolarHBondContact O-N 2.91Å; V357-R361 WeakPolarHBondContact O-CB 3.11Å; V357-R361 PolarHBondContact O-N 3.07Å
358	E	57.6	Low	56.1	Low	75 Å²	75	102.4 Å²	102.4	35%	0.35	50%	0.497	S	S	.	.	H	α-helix	trans	-64.9	-37.7	178.2	-166.2	56.6	-144.8	0	0	111.7	E354 L356 R361 Q362	E354-E358 WeakPolarHBondContact O-CB 3.32Å; E354-E358 PolarHBondContact O-N 3.4Å; L356-E358 VanDerWaalsContact C-N 3.35Å; E358-R361 WeakPolarHBondContact O-CB 3.03Å; E358-R361 PolarHBondContact O-N 3.31Å; E358-R361 IonicContact OE1-NE 3.38Å; E358-R361 PolarHBondContact OE1-NE 3.23Å; E358-R361 WeakPolarHBondContact OE2-CD 3.24Å; E358-R361 IonicContact OE2-NE 2.83Å; E358-R361 PolarHBondContact OE2-NE 3.4Å; E358-Q362 WeakPolarHBondContact O-CB 3.33Å; E358-Q362 VanDerWaalsContact O-CG 3.3Å; E358-Q362 WeakPolarHBondContact O-CG 3.27Å; E358-Q362 PolarHBondContact O-N 2.9Å
359	R	62	Low	54.9	Low	156 Å²	156	105.6 Å²	105.6	59%	0.589	51%	0.513	S	S	*	.	H	α-helix	trans	-67	-41.9	176.4	-143.1	-176	-53.7	-179	3.4	112.5	L355 L356 V357 R361 K363	L355-R359 WeakPolarHBondContact O-CB 3.4Å; L355-R359 PolarHBondContact O-N 3.28Å; L356-R359 PolarHBondContact O-N 3.32Å; V357-R359 VanDerWaalsContact C-N 3.33Å; V357-R359 PolarHBondContact O-N 3.18Å; R359-R361 VanDerWaalsContact C-N 3.31Å; R359-K363 PolarHBondContact O-N 3.3Å
360	V	45.9	Very low	54	Low	69 Å²	69	104.7 Å²	104.7	42%	0.418	52%	0.517	S	S	.	.	H	α-helix	trans	-63.6	-41.9	174.9	169.2	0	0	0	0	110.1	L356 V357 K363 L364	L356-V360 HydrophobicContact CD2-CG2 4.3Å; L356-V360 WeakPolarHBondContact O-CG2 3.44Å; L356-V360 PolarHBondContact O-N 2.84Å; V357-V360 PolarHBondContact O-N 2.91Å; V360-K363 PolarHBondContact O-N 3.46Å; V360-L364 HydrophobicContact CG1-CD1 3.87Å; V360-L364 HydrophobicContact CG1-CG 4.41Å; V360-L364 WeakPolarHBondContact O-CB 3.45Å; V360-L364 WeakPolarHBondContact O-CG 3.25Å; V360-L364 PolarHBondContact O-N 3.26Å
361	R	49.4	Very low	53.3	Low	80 Å²	80	107.1 Å²	107.1	30%	0.302	53%	0.53	S	S	.	.	H	α-helix	trans	-64.1	-45.8	177.6	177.8	-179.9	141.5	96.6	38.9	112.5	V357 E358 R359 K363 L364 Q365 Y733	V357-R361 WeakPolarHBondContact O-CB 3.11Å; V357-R361 PolarHBondContact O-N 3.07Å; E358-R361 WeakPolarHBondContact O-CB 3.03Å; E358-R361 PolarHBondContact O-N 3.31Å; E358-R361 IonicContact OE1-NE 3.38Å; E358-R361 PolarHBondContact OE1-NE 3.23Å; E358-R361 WeakPolarHBondContact OE2-CD 3.24Å; E358-R361 IonicContact OE2-NE 2.83Å; E358-R361 PolarHBondContact OE2-NE 3.4Å; R359-R361 VanDerWaalsContact C-N 3.31Å; R361-K363 VanDerWaalsContact C-N 3.34Å; R361-K363 PolarHBondContact O-N 3.13Å; R361-L364 PolarHBondContact O-N 3.32Å; R361-Q365 VanDerWaalsContact O-CB 3.28Å; R361-Q365 WeakPolarHBondContact O-CB 3.26Å; R361-Q365 PolarHBondContact O-N 3.47Å; R361-Y733 VanDerWaalsContact CZ-CE1 3.47Å; R361-Y733 PolarHBondContact NH1-OH 3.44Å; R361-Y733 VanDerWaalsContact NH1-OH 3.07Å; R361-Y733 PolarHBondContact NH2-OH 3.05Å
362	Q	57.9	Low	52.5	Low	105 Å²	105	106.1 Å²	106.1	49%	0.491	54%	0.537	S	S	.	.	H	α-helix	trans	-60.4	-42	173.1	-74.8	176.1	0.7	0	0	111.8	E358 Q365 N366	E358-Q362 WeakPolarHBondContact O-CB 3.33Å; E358-Q362 VanDerWaalsContact O-CG 3.3Å; E358-Q362 WeakPolarHBondContact O-CG 3.27Å; E358-Q362 PolarHBondContact O-N 2.9Å; Q362-Q365 PolarHBondContact O-N 2.94Å; Q362-N366 PolarHBondContact O-N 3.15Å; Q362-N366 VanDerWaalsContact O-N 3.09Å
363	K	51.4	Low	51.9	Low	72 Å²	72	102.7 Å²	102.7	31%	0.313	53%	0.53	S	S	.	.	H	α-helix	trans	-67.5	-42.6	176.6	-76.8	-166.7	172.7	-161.2	0	113	R359 V360 R361 Q365 N366 D367	R359-K363 PolarHBondContact O-N 3.3Å; V360-K363 PolarHBondContact O-N 3.46Å; R361-K363 VanDerWaalsContact C-N 3.34Å; R361-K363 PolarHBondContact O-N 3.13Å; K363-Q365 PolarHBondContact O-N 3.45Å; K363-N366 PolarHBondContact O-N 3.3Å; K363-N366 VanDerWaalsContact O-N 3.13Å; K363-D367 PolarHBondContact O-N 3.08Å
364	L	46.6	Very low	51.8	Low	92 Å²	92	99.9 Å²	99.9	48%	0.482	52%	0.515	S	S	.	.	H	α-helix	trans	-63.3	-30.3	173.7	-78.7	169.4	0	0	0	112.5	V360 R361 N366	V360-L364 HydrophobicContact CG1-CD1 3.87Å; V360-L364 HydrophobicContact CG1-CG 4.41Å; V360-L364 WeakPolarHBondContact O-CB 3.45Å; V360-L364 WeakPolarHBondContact O-CG 3.25Å; V360-L364 PolarHBondContact O-N 3.26Å; R361-L364 PolarHBondContact O-N 3.32Å; L364-N366 VanDerWaalsContact C-N 3.34Å
365	Q	54.9	Low	51.1	Low	119 Å²	119	100.6 Å²	100.6	56%	0.556	52%	0.518	S	S	*	.	H	α-helix	trans	-72.9	-29.7	176	-166.2	162	-4.7	0	0	111.8	R361 Q362 K363	R361-Q365 VanDerWaalsContact O-CB 3.28Å; R361-Q365 WeakPolarHBondContact O-CB 3.26Å; R361-Q365 PolarHBondContact O-N 3.47Å; Q362-Q365 PolarHBondContact O-N 2.94Å; K363-Q365 PolarHBondContact O-N 3.45Å
366	N	55.1	Low	50.4	Low	134 Å²	134	100.9 Å²	100.9	72%	0.717	52%	0.517	S	S	*	.	H	α-helix	trans	-79.3	-38.4	174.2	-66.7	-11.7	0	0	0	112.5	Q362 K363 L364 A368	Q362-N366 PolarHBondContact O-N 3.15Å; Q362-N366 VanDerWaalsContact O-N 3.09Å; K363-N366 PolarHBondContact O-N 3.3Å; K363-N366 VanDerWaalsContact O-N 3.13Å; L364-N366 VanDerWaalsContact C-N 3.34Å; N366-A368 PolarHBondContact O-N 3.29Å
367	D	44.4	Very low	50.1	Low	80 Å²	80	100.8 Å²	100.8	43%	0.428	51%	0.513	S	S	.	.			trans	-93.2	71.7	-179.1	-74.8	-23.1	0	0	0	111.7	K363 V369	K363-D367 PolarHBondContact O-N 3.08Å; D367-V369 PolarHBondContact O-N 3.12Å
368	A	48.5	Very low	49.9	Very low	85 Å²	85	100.7 Å²	100.7	70%	0.702	51%	0.509	S	S	*	.			trans	-71.6	-10.6	177	0	0	0	0	0	114.1	N366	N366-A368 PolarHBondContact O-N 3.29Å
369	V	44	Very low	49.4	Very low	130 Å²	130	99.6 Å²	99.6	79%	0.788	51%	0.509	S	S	*	.	S	Bend	trans	-101.6	-27.1	-160.2	-177.8	0	0	0	0	115.8	D367	D367-V369 PolarHBondContact O-N 3.12Å
370	E	46.7	Very low	48.6	Very low	161 Å²	161	96.7 Å²	96.7	75%	0.752	51%	0.505	S	S	*	.			trans	-144.6	94.7	177.4	-75.3	-174.3	165.6	0	0	113.1
371	K	50.8	Low	48.3	Very low	163 Å²	163	95.5 Å²	95.5	71%	0.709	50%	0.496	S	S	*	.			trans	-71.6	-27.7	179.6	-79.3	179.9	174.5	175.8	0	113.9	H375	K371-H375 WeakPolarHBondContact O-CB 3.37Å; K371-H375 PolarHBondContact O-N 3.49Å; K371-H375 VanDerWaalsContact O-N 3.13Å
372	D	49.4	Very low	48.1	Very low	138 Å²	138	97.1 Å²	97.1	74%	0.738	51%	0.507	S	S	*	.	H	α-helix	trans	-75.9	-38.5	-162.5	-60.3	-21	0	0	0	113.3	L374 H375 Q376	D372-L374 VanDerWaalsContact C-N 3.35Å; D372-L374 PolarHBondContact O-N 3.15Å; D372-H375 WeakPolarHBondContact O-CB 3.34Å; D372-H375 PolarHBondContact O-N 2.87Å; D372-Q376 PolarHBondContact O-N 3.42Å
373	G	48.8	Very low	47.4	Very low	33 Å²	33	97.9 Å²	97.9	34%	0.34	52%	0.519	S	S	.	.	H	α-helix	trans	-71.6	-28.6	179.8	0	0	0	0	0	114
374	L	47.9	Very low	46.7	Very low	38 Å²	38	99 Å²	99	20%	0.199	53%	0.528	C	S	.	.	H	α-helix	trans	-81	-32.5	178.2	-148	140.9	0	0	0	110.6	D372 K377 L378 L411	D372-L374 VanDerWaalsContact C-N 3.35Å; D372-L374 PolarHBondContact O-N 3.15Å; L374-K377 PolarHBondContact O-N 3.12Å; L374-L378 HydrophobicContact CD2-CD1 3.71Å; L374-L378 PolarHBondContact O-N 3.46Å; L374-L411 HydrophobicContact CD1-CD1 4.34Å; L374-L411 HydrophobicContact CD1-CD2 3.47Å; L374-L411 VanDerWaalsContact CD1-CD2 3.47Å; L374-L411 HydrophobicContact CG-CD2 4.35Å
375	H	43.3	Very low	46.2	Very low	110 Å²	110	99.1 Å²	99.1	51%	0.509	53%	0.528	S	S	.	.	H	α-helix	trans	-59.4	-46.4	174.3	-164.4	67.3	0	0	0	112.2	K371 D372 L378 C379	K371-H375 WeakPolarHBondContact O-CB 3.37Å; K371-H375 PolarHBondContact O-N 3.49Å; K371-H375 VanDerWaalsContact O-N 3.13Å; D372-H375 WeakPolarHBondContact O-CB 3.34Å; D372-H375 PolarHBondContact O-N 2.87Å; H375-L378 PolarHBondContact O-N 2.89Å; H375-C379 PolarHBondContact O-N 2.87Å; H375-C379 VanDerWaalsContact O-N 3.13Å; H375-C379 PolarHBondContact O-SG 3.38Å
376	Q	50.3	Low	45.3	Very low	118 Å²	118	97.6 Å²	97.6	55%	0.551	53%	0.528	S	S	*	.	H	α-helix	trans	-66.5	-42.4	179.4	-166.7	63.4	31.9	0	0	112.4	D372 L378 C379 D380	D372-Q376 PolarHBondContact O-N 3.42Å; Q376-L378 VanDerWaalsContact C-N 3.29Å; Q376-L378 PolarHBondContact O-N 3.4Å; Q376-C379 WeakPolarHBondContact O-CA 3.39Å; Q376-C379 VanDerWaalsContact O-CB 3.3Å; Q376-C379 WeakPolarHBondContact O-CB 3.4Å; Q376-C379 PolarHBondContact O-N 3.49Å; Q376-C379 VanDerWaalsContact O-N 3.08Å; Q376-D380 PolarHBondContact O-N 2.99Å
377	K	46.5	Very low	44.6	Very low	71 Å²	71	96 Å²	96	31%	0.309	53%	0.528	S	S	.	.	H	α-helix	trans	-67.8	-28.9	177.7	-72.6	-177.1	175.1	178.5	0	113	L374 C379 D380 L381 L407 S410	L374-K377 PolarHBondContact O-N 3.12Å; K377-C379 VanDerWaalsContact C-N 3.34Å; K377-D380 PolarHBondContact O-N 2.96Å; K377-L381 PolarHBondContact O-N 2.88Å; K377-L407 HydrophobicContact CB-CD1 3.92Å; K377-S410 PolarHBondContact NZ-OG 3.38Å
378	L	47.6	Very low	44.4	Very low	86 Å²	86	97.5 Å²	97.5	45%	0.45	55%	0.545	S	S	.	.	H	α-helix	trans	-68.2	-35.5	171.1	-121.1	110.6	0	0	0	111.6	L374 H375 Q376 L381 H382	L374-L378 HydrophobicContact CD2-CD1 3.71Å; L374-L378 PolarHBondContact O-N 3.46Å; H375-L378 PolarHBondContact O-N 2.89Å; Q376-L378 VanDerWaalsContact C-N 3.29Å; Q376-L378 PolarHBondContact O-N 3.4Å; L378-L381 PolarHBondContact O-N 3.27Å; L378-H382 PolarHBondContact O-N 2.84Å; L378-H382 VanDerWaalsContact O-N 3.11Å
379	C	46.9	Very low	44	Very low	52 Å²	52	103.4 Å²	103.4	35%	0.351	55%	0.549	S	S	.	.	H	α-helix	trans	-64.7	-40	173	-62.8	0	0	0	0	111.4	H375 Q376 K377 L381 H382 V383	H375-C379 PolarHBondContact O-N 2.87Å; H375-C379 VanDerWaalsContact O-N 3.13Å; H375-C379 PolarHBondContact O-SG 3.38Å; Q376-C379 WeakPolarHBondContact O-CA 3.39Å; Q376-C379 VanDerWaalsContact O-CB 3.3Å; Q376-C379 WeakPolarHBondContact O-CB 3.4Å; Q376-C379 PolarHBondContact O-N 3.49Å; Q376-C379 VanDerWaalsContact O-N 3.08Å; K377-C379 VanDerWaalsContact C-N 3.34Å; C379-L381 VanDerWaalsContact C-N 3.31Å; C379-L381 PolarHBondContact O-N 3.17Å; C379-H382 WeakPolarHBondContact O-CA 3.39Å; C379-H382 WeakPolarHBondContact O-CB 2.79Å; C379-H382 PolarHBondContact O-N 3.2Å; C379-V383 PolarHBondContact O-N 3.07Å
380	D	44.5	Very low	44.1	Very low	95 Å²	95	101.7 Å²	101.7	51%	0.508	54%	0.538	S	S	.	.	H	α-helix	trans	-65	-34.6	176.3	-64	-20.6	0	0	0	112.2	Q376 K377 H382 V383	Q376-D380 PolarHBondContact O-N 2.99Å; K377-D380 PolarHBondContact O-N 2.96Å; D380-H382 VanDerWaalsContact C-N 3.28Å; D380-H382 PolarHBondContact O-N 2.96Å; D380-V383 PolarHBondContact O-N 2.95Å
381	L	40.3	Very low	44	Very low	43 Å²	43	99.1 Å²	99.1	23%	0.225	53%	0.53	C	S	.	.	H	α-helix	trans	-69.6	-28.2	173.4	-142.7	91.2	0	0	0	112.2	K377 L378 C379 V383 L384 V404	K377-L381 PolarHBondContact O-N 2.88Å; L378-L381 PolarHBondContact O-N 3.27Å; C379-L381 VanDerWaalsContact C-N 3.31Å; C379-L381 PolarHBondContact O-N 3.17Å; L381-V383 VanDerWaalsContact C-N 3.27Å; L381-V383 PolarHBondContact O-N 3.43Å; L381-L384 PolarHBondContact O-N 3.37Å; L381-L384 VanDerWaalsContact O-N 3.13Å; L381-V404 HydrophobicContact CD2-CG2 3.99Å
382	H	44.3	Very low	43.9	Very low	114 Å²	114	101.5 Å²	101.5	53%	0.528	54%	0.54	S	S	.	.	H	α-helix	trans	-64.2	-30.4	178.4	-130.9	101	0	0	0	112.4	L378 C379 D380 L384 L385	L378-H382 PolarHBondContact O-N 2.84Å; L378-H382 VanDerWaalsContact O-N 3.11Å; C379-H382 WeakPolarHBondContact O-CA 3.39Å; C379-H382 WeakPolarHBondContact O-CB 2.79Å; C379-H382 PolarHBondContact O-N 3.2Å; D380-H382 VanDerWaalsContact C-N 3.28Å; D380-H382 PolarHBondContact O-N 2.96Å; H382-L384 PolarHBondContact O-N 3.41Å; H382-L385 PolarHBondContact O-N 3.24Å
383	V	44.1	Very low	44.3	Very low	121 Å²	121	101.7 Å²	101.7	73%	0.733	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-20.3	176.1	-178.8	0	0	0	0	111.9	C379 D380 L381	C379-V383 PolarHBondContact O-N 3.07Å; D380-V383 PolarHBondContact O-N 2.95Å; L381-V383 VanDerWaalsContact C-N 3.27Å; L381-V383 PolarHBondContact O-N 3.43Å
384	L	35.9	Very low	44.6	Very low	97 Å²	97	101.3 Å²	101.3	51%	0.508	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	8.9	-178.7	-67.8	173.7	0	0	0	114.4	L381 H382 P386	L381-L384 PolarHBondContact O-N 3.37Å; L381-L384 VanDerWaalsContact O-N 3.13Å; H382-L384 PolarHBondContact O-N 3.41Å; L384-P386 VanDerWaalsContact O-CD 3.27Å; L384-P386 WeakPolarHBondContact O-CD 3.45Å
385	L	35.2	Very low	45.5	Very low	94 Å²	94	102.2 Å²	102.2	49%	0.492	55%	0.547	S	S	.	.			trans	-113.8	69.5	178.1	-68.9	169.1	0	0	0	112.3	H382 S387 I400	H382-L385 PolarHBondContact O-N 3.24Å; L385-S387 PolarHBondContact O-N 3.48Å; L385-I400 HydrophobicContact CD2-CD1 3.42Å; L385-I400 VanDerWaalsContact CD2-CD1 3.42Å; L385-I400 HydrophobicContact CD2-CG1 3.68Å; L385-I400 HydrophobicContact CD2-CG2 4.35Å
386	P	36.8	Very low	46	Very low	86 Å²	86	99.8 Å²	99.8	56%	0.558	54%	0.536	S	S	*	.			trans	-73	117.4	167.7	-0.2	16.1	0	0	0	110.8	L384 S388	L384-P386 VanDerWaalsContact O-CD 3.27Å; L384-P386 WeakPolarHBondContact O-CD 3.45Å; P386-S388 PolarHBondContact O-N 3.03Å
387	S	39.9	Very low	46.5	Very low	100 Å²	100	100.8 Å²	100.8	70%	0.699	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	19.5	96	134.6	176.6	0	0	0	0	118	L385 R389	L385-S387 PolarHBondContact O-N 3.48Å; S387-R389 VanDerWaalsContact C-N 3.33Å; S387-R389 PolarHBondContact O-N 3.05Å
388	S	40.8	Very low	47.5	Very low	112 Å²	112	104.8 Å²	104.8	78%	0.783	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.2	12.7	139.6	74.1	0	0	0	0	121.2	P386	P386-S388 PolarHBondContact O-N 3.03Å
389	R	40.5	Very low	48.2	Very low	209 Å²	209	105.7 Å²	105.7	79%	0.789	56%	0.557	S	S	*	*			trans	-123.4	64.2	169.8	-72.9	-170	179.4	-173.3	2.1	111.3	S387 D391	S387-R389 VanDerWaalsContact C-N 3.33Å; S387-R389 PolarHBondContact O-N 3.05Å; R389-D391 PolarHBondContact O-N 3.42Å
390	V	44.9	Very low	48.6	Very low	94 Å²	94	105.2 Å²	105.2	57%	0.57	55%	0.55	S	S	*	.			trans	-71	103.1	171.1	-175.3	0	0	0	0	107.9	E396	V390-E396 WeakPolarHBondContact CA-OE2 2.92Å
391	D	44.5	Very low	49.4	Very low	108 Å²	108	107.6 Å²	107.6	58%	0.578	56%	0.556	S	S	*	*			trans	-52	145.9	173.9	-78.7	-27.7	0	0	0	110.8	R389 D393 G394	R389-D391 PolarHBondContact O-N 3.42Å; D391-D393 PolarHBondContact O-N 3.46Å; D391-G394 PolarHBondContact O-N 2.72Å
392	K	50	Low	50.8	Low	212 Å²	212	112.4 Å²	112.4	92%	0.922	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.9	-22.5	-174.9	-75.3	-178.4	177.1	176.5	0	114	G394	K392-G394 VanDerWaalsContact C-N 3.33Å; K392-G394 PolarHBondContact O-N 3.03Å
393	D	56.8	Low	51.9	Low	142 Å²	142	107.8 Å²	107.8	76%	0.759	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-0	-174	-57.2	-20.5	0	0	0	113.6	D391 S395	D391-D393 PolarHBondContact O-N 3.46Å; D393-S395 PolarHBondContact O-N 3.32Å; D393-S395 VanDerWaalsContact O-N 3.1Å
394	G	55.7	Low	52.5	Low	25 Å²	25	104.1 Å²	104.1	26%	0.258	54%	0.536	S	S	.	.			trans	63.7	19	172.6	0	0	0	0	0	114.4	D391 K392 W397 K398	D391-G394 PolarHBondContact O-N 2.72Å; K392-G394 VanDerWaalsContact C-N 3.33Å; K392-G394 PolarHBondContact O-N 3.03Å; G394-W397 PolarHBondContact O-N 2.94Å; G394-K398 PolarHBondContact O-N 3.24Å
395	S	66	Low	54	Low	57 Å²	57	104.1 Å²	104.1	40%	0.399	53%	0.533	S	S	.	.	H	α-helix	trans	-60.5	-44.5	179.5	51.3	0	0	0	0	111.5	D393 W397 K398 L399	D393-S395 PolarHBondContact O-N 3.32Å; D393-S395 VanDerWaalsContact O-N 3.1Å; S395-W397 VanDerWaalsContact C-N 3.35Å; S395-W397 PolarHBondContact O-N 3.33Å; S395-K398 PolarHBondContact O-N 2.95Å; S395-L399 PolarHBondContact O-N 2.9Å
396	E	55.5	Low	55.5	Low	60 Å²	60	106.7 Å²	106.7	28%	0.28	54%	0.541	S	S	.	.	H	α-helix	trans	-61.8	-41.7	176.3	-66	-170.5	155.6	0	0	111.8	V390 K398 L399 I400	V390-E396 WeakPolarHBondContact CA-OE2 2.92Å; E396-K398 PolarHBondContact O-N 3.05Å; E396-L399 WeakPolarHBondContact O-CA 3.41Å; E396-L399 VanDerWaalsContact O-CB 3.31Å; E396-L399 WeakPolarHBondContact O-CB 3.35Å; E396-L399 PolarHBondContact O-N 2.99Å; E396-L399 VanDerWaalsContact O-N 3.09Å; E396-I400 WeakPolarHBondContact O-CG1 3.18Å; E396-I400 PolarHBondContact O-N 2.89Å
397	W	59.9	Low	56.3	Low	138 Å²	138	104.4 Å²	104.4	52%	0.523	52%	0.524	S	S	.	.	H	α-helix	trans	-65.2	-39.2	177.5	-172.2	-113.6	0	0	0	112.5	G394 S395 L399 I400 K401	G394-W397 PolarHBondContact O-N 2.94Å; S395-W397 VanDerWaalsContact C-N 3.35Å; S395-W397 PolarHBondContact O-N 3.33Å; W397-L399 VanDerWaalsContact C-N 3.27Å; W397-L399 PolarHBondContact O-N 3.22Å; W397-I400 HydrophobicContact CE3-CD1 4.13Å; W397-I400 PolarHBondContact O-N 3.37Å; W397-K401 WeakPolarHBondContact O-CB 2.78Å; W397-K401 PolarHBondContact O-N 3.12Å
398	K	67.1	Low	57.4	Low	156 Å²	156	102 Å²	102	68%	0.678	50%	0.504	S	S	*	.	H	α-helix	trans	-61.5	-37.5	171.9	-81.5	-179.2	179.3	171.4	0	111.7	G394 S395 E396 K402	G394-K398 PolarHBondContact O-N 3.24Å; S395-K398 PolarHBondContact O-N 2.95Å; E396-K398 PolarHBondContact O-N 3.05Å; K398-K402 VanDerWaalsContact O-CB 3.3Å; K398-K402 WeakPolarHBondContact O-CB 3.3Å; K398-K402 PolarHBondContact O-N 3.41Å
399	L	62.8	Low	58.9	Low	105 Å²	105	100.6 Å²	100.6	55%	0.55	49%	0.488	S	S	.	.	H	α-helix	trans	-65.9	-47.7	176.7	-111.9	134.8	0	0	0	111.8	S395 E396 W397 K401 K402 G403	S395-L399 PolarHBondContact O-N 2.9Å; E396-L399 WeakPolarHBondContact O-CA 3.41Å; E396-L399 VanDerWaalsContact O-CB 3.31Å; E396-L399 WeakPolarHBondContact O-CB 3.35Å; E396-L399 PolarHBondContact O-N 2.99Å; E396-L399 VanDerWaalsContact O-N 3.09Å; W397-L399 VanDerWaalsContact C-N 3.27Å; W397-L399 PolarHBondContact O-N 3.22Å; L399-K401 PolarHBondContact O-N 3.1Å; L399-K402 PolarHBondContact O-N 3.34Å; L399-G403 PolarHBondContact O-N 3.19Å
400	I	54.2	Low	60.1	Low	41 Å²	41	92.3 Å²	92.3	21%	0.21	46%	0.462	C	S	.	.	H	α-helix	trans	-58.6	-49.5	175.4	-65.1	163.4	0	0	0	110	L385 E396 W397 K402 G403 V404	L385-I400 HydrophobicContact CD2-CD1 3.42Å; L385-I400 VanDerWaalsContact CD2-CD1 3.42Å; L385-I400 HydrophobicContact CD2-CG1 3.68Å; L385-I400 HydrophobicContact CD2-CG2 4.35Å; E396-I400 WeakPolarHBondContact O-CG1 3.18Å; E396-I400 PolarHBondContact O-N 2.89Å; W397-I400 HydrophobicContact CE3-CD1 4.13Å; W397-I400 PolarHBondContact O-N 3.37Å; I400-K402 VanDerWaalsContact C-N 3.28Å; I400-K402 PolarHBondContact O-N 3.21Å; I400-G403 PolarHBondContact O-N 3.44Å; I400-G403 VanDerWaalsContact O-N 3.13Å; I400-V404 HydrophobicContact CG2-CG2 4.42Å; I400-V404 WeakPolarHBondContact O-CG2 3.39Å; I400-V404 PolarHBondContact O-N 2.67Å
401	K	62.5	Low	60.7	Low	145 Å²	145	89.6 Å²	89.6	63%	0.63	44%	0.444	S	S	*	.	H	α-helix	trans	-57.7	-41	177.9	-170.6	175	-178.2	175.4	0	111.8	W397 L399 Q405	W397-K401 WeakPolarHBondContact O-CB 2.78Å; W397-K401 PolarHBondContact O-N 3.12Å; L399-K401 PolarHBondContact O-N 3.1Å; K401-Q405 WeakPolarHBondContact O-CB 3.08Å; K401-Q405 PolarHBondContact O-N 2.79Å
402	K	69	Low	62	Low	145 Å²	145	87.2 Å²	87.2	63%	0.63	44%	0.436	S	S	*	.	H	α-helix	trans	-69.3	-37.4	177.6	-162.4	175.5	-174.3	179.1	0	112.3	K398 L399 I400 K406	K398-K402 VanDerWaalsContact O-CB 3.3Å; K398-K402 WeakPolarHBondContact O-CB 3.3Å; K398-K402 PolarHBondContact O-N 3.41Å; L399-K402 PolarHBondContact O-N 3.34Å; I400-K402 VanDerWaalsContact C-N 3.28Å; I400-K402 PolarHBondContact O-N 3.21Å; K402-K406 PolarHBondContact O-N 2.82Å
403	G	66.9	Low	63.5	Low	17 Å²	17	82.5 Å²	82.5	18%	0.175	42%	0.42	C	S	.	.	H	α-helix	trans	-64.1	-47.7	174.4	0	0	0	0	0	112.1	L399 I400 Q405 K406 L407	L399-G403 PolarHBondContact O-N 3.19Å; I400-G403 PolarHBondContact O-N 3.44Å; I400-G403 VanDerWaalsContact O-N 3.13Å; G403-Q405 PolarHBondContact O-N 2.92Å; G403-K406 PolarHBondContact O-N 2.68Å; G403-L407 PolarHBondContact O-N 3.02Å; G403-L407 VanDerWaalsContact O-N 3.08Å
404	V	57.1	Low	63.5	Low	44 Å²	44	81 Å²	81	27%	0.267	40%	0.404	S	S	.	.	H	α-helix	trans	-62.6	-42.1	176.1	175.6	0	0	0	0	111.2	L381 I400 K406 L407 V408	L381-V404 HydrophobicContact CD2-CG2 3.99Å; I400-V404 HydrophobicContact CG2-CG2 4.42Å; I400-V404 WeakPolarHBondContact O-CG2 3.39Å; I400-V404 PolarHBondContact O-N 2.67Å; V404-K406 PolarHBondContact O-N 2.99Å; V404-L407 WeakPolarHBondContact O-CB 3.38Å; V404-L407 PolarHBondContact O-N 3.39Å; V404-L407 VanDerWaalsContact O-N 3.12Å; V404-V408 HydrophobicContact CG1-CG2 4.49Å; V404-V408 WeakPolarHBondContact O-CG2 3.44Å; V404-V408 PolarHBondContact O-N 2.82Å
405	Q	67.4	Low	64.1	Low	96 Å²	96	85.8 Å²	85.8	45%	0.449	42%	0.42	S	S	.	.	H	α-helix	trans	-61.3	-44.6	177.2	-171.2	62.4	49.7	0	0	111.8	K401 G403 L407 V408 D409	K401-Q405 WeakPolarHBondContact O-CB 3.08Å; K401-Q405 PolarHBondContact O-N 2.79Å; G403-Q405 PolarHBondContact O-N 2.92Å; Q405-L407 PolarHBondContact O-N 3.31Å; Q405-V408 WeakPolarHBondContact O-CB 3.15Å; Q405-V408 PolarHBondContact O-N 2.73Å; Q405-V408 VanDerWaalsContact O-N 3.15Å; Q405-D409 PolarHBondContact NE2-OD1 2.82Å; Q405-D409 PolarHBondContact O-N 3.25Å
406	K	66.5	Low	64.8	Low	149 Å²	149	86 Å²	86	65%	0.648	43%	0.425	S	S	*	.	H	α-helix	trans	-58.6	-36.7	173.9	-78.8	-175.6	174.6	-173.2	0	112.6	K402 G403 V404 S410	K402-K406 PolarHBondContact O-N 2.82Å; G403-K406 PolarHBondContact O-N 2.68Å; V404-K406 PolarHBondContact O-N 2.99Å; K406-S410 WeakPolarHBondContact O-CB 3.23Å; K406-S410 PolarHBondContact O-N 3Å
407	L	53.7	Low	65.9	Low	38 Å²	38	88.2 Å²	88.2	20%	0.199	44%	0.435	C	S	.	.	H	α-helix	trans	-66.5	-45.6	176.5	-158.9	108	0	0	0	110.8	K377 G403 V404 Q405 D409 S410 L411	K377-L407 HydrophobicContact CB-CD1 3.92Å; G403-L407 PolarHBondContact O-N 3.02Å; G403-L407 VanDerWaalsContact O-N 3.08Å; V404-L407 WeakPolarHBondContact O-CB 3.38Å; V404-L407 PolarHBondContact O-N 3.39Å; V404-L407 VanDerWaalsContact O-N 3.12Å; Q405-L407 PolarHBondContact O-N 3.31Å; L407-D409 PolarHBondContact O-N 3.06Å; L407-S410 PolarHBondContact O-N 3.04Å; L407-L411 HydrophobicContact CD2-CD1 4.18Å; L407-L411 VanDerWaalsContact O-CG 3.3Å; L407-L411 WeakPolarHBondContact O-CG 3.22Å; L407-L411 PolarHBondContact O-N 2.88Å
408	V	63.5	Low	66.3	Low	48 Å²	48	85.5 Å²	85.5	29%	0.291	43%	0.43	S	S	.	.	H	α-helix	trans	-58.4	-48.3	175	172.1	0	0	0	0	110.6	V404 Q405 S410 L411 S412	V404-V408 HydrophobicContact CG1-CG2 4.49Å; V404-V408 WeakPolarHBondContact O-CG2 3.44Å; V404-V408 PolarHBondContact O-N 2.82Å; Q405-V408 WeakPolarHBondContact O-CB 3.15Å; Q405-V408 PolarHBondContact O-N 2.73Å; Q405-V408 VanDerWaalsContact O-N 3.15Å; V408-S410 VanDerWaalsContact C-N 3.34Å; V408-S410 PolarHBondContact O-N 2.85Å; V408-L411 PolarHBondContact O-N 3.19Å; V408-L411 VanDerWaalsContact O-N 3.15Å; V408-S412 PolarHBondContact O-N 3.01Å; V408-S412 PolarHBondContact O-OG 3.17Å
409	D	71.4	Confident	67	Low	84 Å²	84	82.1 Å²	82.1	45%	0.449	42%	0.422	S	S	.	.	H	α-helix	trans	-63.9	-39.6	-179.6	-60.2	-18.5	0	0	0	111.6	Q405 L407 L411 S412 L413	Q405-D409 PolarHBondContact NE2-OD1 2.82Å; Q405-D409 PolarHBondContact O-N 3.25Å; L407-D409 PolarHBondContact O-N 3.06Å; D409-L411 VanDerWaalsContact C-N 3.32Å; D409-L411 PolarHBondContact O-N 3.04Å; D409-S412 PolarHBondContact O-N 3.12Å; D409-L413 PolarHBondContact O-N 3.32Å
410	S	67.3	Low	68	Low	35 Å²	35	80 Å²	80	25%	0.245	42%	0.417	C	S	.	.	H	α-helix	trans	-65	-33.5	175	178.4	0	0	0	0	112.9	K377 K406 L407 V408 R414	K377-S410 PolarHBondContact NZ-OG 3.38Å; K406-S410 WeakPolarHBondContact O-CB 3.23Å; K406-S410 PolarHBondContact O-N 3Å; L407-S410 PolarHBondContact O-N 3.04Å; V408-S410 VanDerWaalsContact C-N 3.34Å; V408-S410 PolarHBondContact O-N 2.85Å; S410-R414 PolarHBondContact O-N 3.15Å
411	L	57.2	Low	68.8	Low	37 Å²	37	82.9 Å²	82.9	19%	0.194	43%	0.432	C	S	.	.	H	α-helix	trans	-72.2	-43.2	176	-70.3	170.5	0	0	0	110.7	L374 L407 V408 D409 L413 R414 E415	L374-L411 HydrophobicContact CD1-CD1 4.34Å; L374-L411 HydrophobicContact CD1-CD2 3.47Å; L374-L411 VanDerWaalsContact CD1-CD2 3.47Å; L374-L411 HydrophobicContact CG-CD2 4.35Å; L407-L411 HydrophobicContact CD2-CD1 4.18Å; L407-L411 VanDerWaalsContact O-CG 3.3Å; L407-L411 WeakPolarHBondContact O-CG 3.22Å; L407-L411 PolarHBondContact O-N 2.88Å; V408-L411 PolarHBondContact O-N 3.19Å; V408-L411 VanDerWaalsContact O-N 3.15Å; D409-L411 VanDerWaalsContact C-N 3.32Å; D409-L411 PolarHBondContact O-N 3.04Å; L411-L413 VanDerWaalsContact C-N 3.29Å; L411-L413 PolarHBondContact O-N 2.7Å; L411-R414 PolarHBondContact O-N 3.22Å; L411-R414 VanDerWaalsContact O-N 3.12Å; L411-E415 PolarHBondContact O-N 3.38Å
412	S	72.4	Confident	69.6	Low	58 Å²	58	83 Å²	83	41%	0.406	43%	0.433	S	S	.	.	H	α-helix	trans	-58.6	-40.2	175.5	-50.5	0	0	0	0	112.2	V408 D409 E415 A416	V408-S412 PolarHBondContact O-N 3.01Å; V408-S412 PolarHBondContact O-OG 3.17Å; D409-S412 PolarHBondContact O-N 3.12Å; S412-E415 PolarHBondContact O-N 3.42Å; S412-A416 PolarHBondContact O-N 3.26Å
413	L	80.1	Confident	70.3	Confident	112 Å²	112	83 Å²	83	59%	0.586	44%	0.435	S	S	*	.	H	α-helix	trans	-63.2	-42.9	175.6	-174.4	70.2	0	0	0	111.8	D409 L411 A416 E417	D409-L413 PolarHBondContact O-N 3.32Å; L411-L413 VanDerWaalsContact C-N 3.29Å; L411-L413 PolarHBondContact O-N 2.7Å; L413-A416 WeakPolarHBondContact O-CB 3.42Å; L413-A416 PolarHBondContact O-N 3.33Å; L413-E417 PolarHBondContact O-N 2.98Å; L413-E417 VanDerWaalsContact O-N 3.15Å
414	R	58	Low	71.1	Confident	111 Å²	111	90.2 Å²	90.2	42%	0.419	46%	0.457	S	S	.	.	H	α-helix	trans	-69.5	-35.8	178.5	-79.4	-170	173.3	-169.2	-2.9	112.8	S410 L411 A416 E417 I418	S410-R414 PolarHBondContact O-N 3.15Å; L411-R414 PolarHBondContact O-N 3.22Å; L411-R414 VanDerWaalsContact O-N 3.12Å; R414-A416 PolarHBondContact O-N 2.77Å; R414-E417 WeakPolarHBondContact O-CB 3.37Å; R414-E417 PolarHBondContact O-N 2.89Å; R414-E417 VanDerWaalsContact O-N 3.12Å; R414-I418 WeakPolarHBondContact O-CG1 3.5Å; R414-I418 PolarHBondContact O-N 2.84Å
415	E	68.3	Low	72	Confident	125 Å²	125	93.5 Å²	93.5	58%	0.584	47%	0.472	S	S	*	.	H	α-helix	trans	-59.4	-40.5	173.5	-165.6	170.6	-173.5	0	0	110.6	L411 S412 E417 I418 T419	L411-E415 PolarHBondContact O-N 3.38Å; S412-E415 PolarHBondContact O-N 3.42Å; E415-E417 PolarHBondContact O-N 3.13Å; E415-I418 PolarHBondContact O-N 3.36Å; E415-T419 WeakPolarHBondContact O-CB 3.44Å; E415-T419 PolarHBondContact O-N 2.97Å; E415-T419 PolarHBondContact O-OG1 2.9Å
416	A	78.8	Confident	72.8	Confident	61 Å²	61	95.5 Å²	95.5	50%	0.504	48%	0.48	S	S	.	.	H	α-helix	trans	-62.8	-40.5	173	0	0	0	0	0	112.8	S412 L413 R414 T419 S420	S412-A416 PolarHBondContact O-N 3.26Å; L413-A416 WeakPolarHBondContact O-CB 3.42Å; L413-A416 PolarHBondContact O-N 3.33Å; R414-A416 PolarHBondContact O-N 2.77Å; A416-T419 PolarHBondContact O-N 3.37Å; A416-S420 PolarHBondContact O-N 3.45Å
417	E	78.9	Confident	73.8	Confident	107 Å²	107	91 Å²	91	50%	0.5	47%	0.467	S	S	.	.	H	α-helix	trans	-64.7	-45.5	175.4	-70.3	175.8	168.5	0	0	112.4	L413 R414 E415 T419 S420 L421	L413-E417 PolarHBondContact O-N 2.98Å; L413-E417 VanDerWaalsContact O-N 3.15Å; R414-E417 WeakPolarHBondContact O-CB 3.37Å; R414-E417 PolarHBondContact O-N 2.89Å; R414-E417 VanDerWaalsContact O-N 3.12Å; E415-E417 PolarHBondContact O-N 3.13Å; E417-T419 VanDerWaalsContact C-N 3.26Å; E417-T419 PolarHBondContact O-N 2.84Å; E417-S420 WeakPolarHBondContact O-CB 3.2Å; E417-S420 PolarHBondContact O-N 3.05Å; E417-S420 VanDerWaalsContact O-N 3.17Å; E417-L421 WeakPolarHBondContact O-CG 3.35Å; E417-L421 PolarHBondContact O-N 3.4Å
418	I	69.7	Low	75.1	Confident	82 Å²	82	91.5 Å²	91.5	42%	0.421	48%	0.476	S	S	.	.	H	α-helix	trans	-60.3	-41.2	176.4	-69.1	170.7	0	0	0	110	R414 E415 S420 L421 K422	R414-I418 WeakPolarHBondContact O-CG1 3.5Å; R414-I418 PolarHBondContact O-N 2.84Å; E415-I418 PolarHBondContact O-N 3.36Å; I418-S420 VanDerWaalsContact C-N 3.34Å; I418-S420 PolarHBondContact O-N 3.38Å; I418-L421 PolarHBondContact O-N 2.87Å; I418-K422 HydrophobicContact CG2-CD 4.37Å; I418-K422 WeakPolarHBondContact O-CG 3.38Å; I418-K422 PolarHBondContact O-N 3.32Å
419	T	80.5	Confident	75.8	Confident	84 Å²	84	93.6 Å²	93.6	52%	0.515	49%	0.486	S	S	.	.	H	α-helix	trans	-63.9	-41.5	178	-48.1	0	0	0	0	110.9	E415 A416 E417 K422 Q423	E415-T419 WeakPolarHBondContact O-CB 3.44Å; E415-T419 PolarHBondContact O-N 2.97Å; E415-T419 PolarHBondContact O-OG1 2.9Å; A416-T419 PolarHBondContact O-N 3.37Å; E417-T419 VanDerWaalsContact C-N 3.26Å; E417-T419 PolarHBondContact O-N 2.84Å; T419-K422 PolarHBondContact O-N 3.2Å; T419-Q423 PolarHBondContact O-N 3.35Å; T419-Q423 VanDerWaalsContact O-N 3.07Å
420	S	85	Confident	76.5	Confident	62 Å²	62	94.8 Å²	94.8	43%	0.434	49%	0.489	S	S	.	.	H	α-helix	trans	-61.8	-43.7	172.8	-176.5	0	0	0	0	112.5	A416 E417 I418 Q423 R424	A416-S420 PolarHBondContact O-N 3.45Å; E417-S420 WeakPolarHBondContact O-CB 3.2Å; E417-S420 PolarHBondContact O-N 3.05Å; E417-S420 VanDerWaalsContact O-N 3.17Å; I418-S420 VanDerWaalsContact C-N 3.34Å; I418-S420 PolarHBondContact O-N 3.38Å; S420-Q423 WeakPolarHBondContact O-CB 3.39Å; S420-Q423 PolarHBondContact O-N 3.34Å; S420-R424 WeakPolarHBondContact O-CG 3.27Å; S420-R424 PolarHBondContact O-N 2.85Å
421	L	71	Confident	77.5	Confident	101 Å²	101	98 Å²	98	53%	0.529	50%	0.502	S	S	.	.	H	α-helix	trans	-65.1	-41.7	177.6	-75	171.3	0	0	0	112.3	E417 I418 Q423 R424 L425	E417-L421 WeakPolarHBondContact O-CG 3.35Å; E417-L421 PolarHBondContact O-N 3.4Å; I418-L421 PolarHBondContact O-N 2.87Å; L421-Q423 VanDerWaalsContact C-N 3.28Å; L421-Q423 PolarHBondContact O-N 2.88Å; L421-R424 PolarHBondContact O-N 3.34Å; L421-L425 PolarHBondContact O-N 3.31Å
422	K	77.9	Confident	78.6	Confident	147 Å²	147	98.6 Å²	98.6	64%	0.639	51%	0.512	S	S	*	.	H	α-helix	trans	-59.2	-41.2	173.4	-77.7	179.9	178.1	176.4	0	111.4	I418 T419 L425 K426	I418-K422 HydrophobicContact CG2-CD 4.37Å; I418-K422 WeakPolarHBondContact O-CG 3.38Å; I418-K422 PolarHBondContact O-N 3.32Å; T419-K422 PolarHBondContact O-N 3.2Å; K422-L425 PolarHBondContact O-N 3.35Å; K422-K426 WeakPolarHBondContact O-CB 3.3Å; K422-K426 PolarHBondContact O-N 3.47Å
423	Q	85.6	Confident	78.9	Confident	145 Å²	145	103.7 Å²	103.7	68%	0.678	52%	0.524	S	S	*	.	H	α-helix	trans	-65.1	-40.6	176.7	-165.5	171.9	2.9	0	0	111.9	T419 S420 L421 K426 S427	T419-Q423 PolarHBondContact O-N 3.35Å; T419-Q423 VanDerWaalsContact O-N 3.07Å; S420-Q423 WeakPolarHBondContact O-CB 3.39Å; S420-Q423 PolarHBondContact O-N 3.34Å; L421-Q423 VanDerWaalsContact C-N 3.28Å; L421-Q423 PolarHBondContact O-N 2.88Å; Q423-K426 PolarHBondContact O-N 3.38Å; Q423-S427 PolarHBondContact O-N 3.01Å
424	R	82	Confident	79.1	Confident	168 Å²	168	102.2 Å²	102.2	63%	0.634	52%	0.523	S	S	*	.	H	α-helix	trans	-64	-43.6	173.5	-72	176.6	64	-175.3	-0.8	112.3	S420 L421 K426 S427 A428	S420-R424 WeakPolarHBondContact O-CG 3.27Å; S420-R424 PolarHBondContact O-N 2.85Å; L421-R424 PolarHBondContact O-N 3.34Å; R424-K426 VanDerWaalsContact C-N 3.32Å; R424-K426 PolarHBondContact O-N 3.09Å; R424-S427 WeakPolarHBondContact CA-OG 3.45Å; R424-S427 PolarHBondContact O-N 3.13Å; R424-S427 PolarHBondContact O-OG 2.92Å; R424-A428 PolarHBondContact O-N 3.02Å
425	L	76.9	Confident	80.5	Confident	114 Å²	114	103.7 Å²	103.7	60%	0.597	53%	0.532	S	S	*	.	H	α-helix	trans	-62.9	-41	177.7	-168.6	74.7	0	0	0	111.3	L421 K422 S427 A428 N429	L421-L425 PolarHBondContact O-N 3.31Å; K422-L425 PolarHBondContact O-N 3.35Å; L425-S427 PolarHBondContact O-N 2.94Å; L425-A428 PolarHBondContact O-N 3.29Å; L425-N429 PolarHBondContact O-N 3.46Å
426	K	84.6	Confident	80.9	Confident	138 Å²	138	103.5 Å²	103.5	60%	0.6	54%	0.535	S	S	*	.	H	α-helix	trans	-58.8	-47.3	174.2	-170.5	179	177.4	-176.8	0	111.2	K422 Q423 R424 A428 N429 E430	K422-K426 WeakPolarHBondContact O-CB 3.3Å; K422-K426 PolarHBondContact O-N 3.47Å; Q423-K426 PolarHBondContact O-N 3.38Å; R424-K426 VanDerWaalsContact C-N 3.32Å; R424-K426 PolarHBondContact O-N 3.09Å; K426-A428 VanDerWaalsContact C-N 3.32Å; K426-A428 PolarHBondContact O-N 3.46Å; K426-N429 PolarHBondContact O-N 3.09Å; K426-E430 WeakPolarHBondContact CE-OE1 3.4Å; K426-E430 WeakPolarHBondContact O-CG 3.33Å; K426-E430 PolarHBondContact O-N 3.47Å
427	S	86.7	Confident	81	Confident	55 Å²	55	104.8 Å²	104.8	39%	0.385	54%	0.536	S	S	.	.	H	α-helix	trans	-62.7	-36.6	176.5	68.9	0	0	0	0	113.1	Q423 R424 L425 E430 I431	Q423-S427 PolarHBondContact O-N 3.01Å; R424-S427 WeakPolarHBondContact CA-OG 3.45Å; R424-S427 PolarHBondContact O-N 3.13Å; R424-S427 PolarHBondContact O-OG 2.92Å; L425-S427 PolarHBondContact O-N 2.94Å; S427-E430 PolarHBondContact O-N 3.41Å; S427-I431 VanDerWaalsContact O-CG1 3.3Å; S427-I431 WeakPolarHBondContact O-CG1 3.47Å; S427-I431 PolarHBondContact O-N 2.9Å; S427-I431 VanDerWaalsContact O-N 3.13Å
428	A	80.7	Confident	81.3	Confident	48 Å²	48	102.5 Å²	102.5	40%	0.397	54%	0.536	S	S	.	.	H	α-helix	trans	-68.5	-40.5	177.3	0	0	0	0	0	112.2	R424 L425 K426 I431 A432	R424-A428 PolarHBondContact O-N 3.02Å; L425-A428 PolarHBondContact O-N 3.29Å; K426-A428 VanDerWaalsContact C-N 3.32Å; K426-A428 PolarHBondContact O-N 3.46Å; A428-I431 PolarHBondContact O-N 3.13Å; A428-A432 PolarHBondContact O-N 3.31Å
429	N	78.1	Confident	81.6	Confident	91 Å²	91	104 Å²	104	49%	0.487	54%	0.544	S	S	.	.	H	α-helix	trans	-65.5	-39.2	175.4	-87.1	-6.4	0	0	0	112	L425 K426 I431 A432 Y433	L425-N429 PolarHBondContact O-N 3.46Å; K426-N429 PolarHBondContact O-N 3.09Å; N429-I431 VanDerWaalsContact C-N 3.3Å; N429-I431 PolarHBondContact O-N 2.9Å; N429-A432 PolarHBondContact O-N 2.91Å; N429-Y433 WeakPolarHBondContact O-CB 3.37Å; N429-Y433 PolarHBondContact O-N 3.48Å
430	E	87.1	Confident	81.1	Confident	110 Å²	110	103.2 Å²	103.2	51%	0.514	54%	0.542	S	S	.	.	H	α-helix	trans	-61.3	-38.9	174.3	-73.2	170.5	-174.3	0	0	111.4	K426 S427 S434	K426-E430 WeakPolarHBondContact CE-OE1 3.4Å; K426-E430 WeakPolarHBondContact O-CG 3.33Å; K426-E430 PolarHBondContact O-N 3.47Å; S427-E430 PolarHBondContact O-N 3.41Å; E430-S434 WeakPolarHBondContact O-CB 3.47Å; E430-S434 PolarHBondContact O-N 3.28Å; E430-S434 PolarHBondContact O-OG 2.86Å
431	I	87.6	Confident	80.7	Confident	101 Å²	101	103.5 Å²	103.5	52%	0.518	54%	0.544	S	S	.	.	H	α-helix	trans	-66.5	-43.7	173.6	-66.2	164.4	0	0	0	111.4	S427 A428 N429 S434 K435	S427-I431 VanDerWaalsContact O-CG1 3.3Å; S427-I431 WeakPolarHBondContact O-CG1 3.47Å; S427-I431 PolarHBondContact O-N 2.9Å; S427-I431 VanDerWaalsContact O-N 3.13Å; A428-I431 PolarHBondContact O-N 3.13Å; N429-I431 VanDerWaalsContact C-N 3.3Å; N429-I431 PolarHBondContact O-N 2.9Å; I431-S434 PolarHBondContact O-N 3.04Å; I431-K435 PolarHBondContact O-N 3.2Å
432	A	80.1	Confident	80.7	Confident	50 Å²	50	101.4 Å²	101.4	41%	0.413	54%	0.542	S	S	.	.	H	α-helix	trans	-63.9	-44.9	-179.9	0	0	0	0	0	111.7	A428 N429 S434 K435 L436	A428-A432 PolarHBondContact O-N 3.31Å; N429-A432 PolarHBondContact O-N 2.91Å; A432-S434 VanDerWaalsContact C-N 3.33Å; A432-S434 PolarHBondContact O-N 2.92Å; A432-K435 PolarHBondContact O-N 3.15Å; A432-L436 PolarHBondContact O-N 3.12Å
433	Y	78.9	Confident	79.9	Confident	166 Å²	166	99 Å²	99	65%	0.651	54%	0.539	S	S	*	.	H	α-helix	trans	-61	-42.7	173.7	-99.8	-82.7	0	0	0	111.7	N429 K435 L436 T437	N429-Y433 WeakPolarHBondContact O-CB 3.37Å; N429-Y433 PolarHBondContact O-N 3.48Å; Y433-K435 VanDerWaalsContact C-N 3.29Å; Y433-K435 PolarHBondContact O-N 3.47Å; Y433-L436 PolarHBondContact O-N 3.33Å; Y433-T437 PolarHBondContact O-N 3.49Å; Y433-T437 PolarHBondContact O-OG1 2.99Å
434	S	85.8	Confident	78.5	Confident	81 Å²	81	96.6 Å²	96.6	57%	0.566	53%	0.534	S	S	*	.	H	α-helix	trans	-59.9	-39.8	176.4	-58.6	0	0	0	0	112.1	E430 I431 A432 A438	E430-S434 WeakPolarHBondContact O-CB 3.47Å; E430-S434 PolarHBondContact O-N 3.28Å; E430-S434 PolarHBondContact O-OG 2.86Å; I431-S434 PolarHBondContact O-N 3.04Å; A432-S434 VanDerWaalsContact C-N 3.33Å; A432-S434 PolarHBondContact O-N 2.92Å; S434-A438 PolarHBondContact O-N 3.29Å; S434-A438 VanDerWaalsContact O-N 3.16Å
435	K	86.9	Confident	77.3	Confident	142 Å²	142	94.1 Å²	94.1	62%	0.617	54%	0.537	S	S	*	.	H	α-helix	trans	-68.9	-41	174.8	-77.1	-175.1	177.6	-177.3	0	112.9	I431 A432 Y433 T437 A438 L439	I431-K435 PolarHBondContact O-N 3.2Å; A432-K435 PolarHBondContact O-N 3.15Å; Y433-K435 VanDerWaalsContact C-N 3.29Å; Y433-K435 PolarHBondContact O-N 3.47Å; K435-T437 VanDerWaalsContact C-N 3.32Å; K435-T437 PolarHBondContact O-N 2.96Å; K435-A438 PolarHBondContact O-N 2.87Å; K435-L439 WeakPolarHBondContact O-CG 3.47Å; K435-L439 PolarHBondContact O-N 2.86Å
436	L	77.2	Confident	76	Confident	121 Å²	121	96.1 Å²	96.1	63%	0.634	54%	0.544	S	S	*	.	H	α-helix	trans	-63.2	-42.4	179.6	-149.5	99.6	0	0	0	110.7	A432 Y433 A438 L439 S440	A432-L436 PolarHBondContact O-N 3.12Å; Y433-L436 PolarHBondContact O-N 3.33Å; L436-A438 VanDerWaalsContact C-N 3.32Å; L436-A438 PolarHBondContact O-N 2.96Å; L436-L439 PolarHBondContact O-N 3.07Å; L436-S440 PolarHBondContact O-N 2.97Å
437	T	80.6	Confident	74.1	Confident	87 Å²	87	97 Å²	97	53%	0.534	55%	0.547	S	S	.	.	H	α-helix	trans	-64.1	-36.5	176	-49.8	0	0	0	0	111.9	Y433 K435 S440 S441	Y433-T437 PolarHBondContact O-N 3.49Å; Y433-T437 PolarHBondContact O-OG1 2.99Å; K435-T437 VanDerWaalsContact C-N 3.32Å; K435-T437 PolarHBondContact O-N 2.96Å; T437-S440 PolarHBondContact O-OG 3.19Å; T437-S441 PolarHBondContact O-N 2.64Å; T437-S441 PolarHBondContact O-OG 3.4Å
438	A	83.6	Confident	72.3	Confident	59 Å²	59	101.5 Å²	101.5	49%	0.488	57%	0.567	S	S	.	*	H	α-helix	trans	-69.4	-32.8	174	0	0	0	0	0	113	S434 K435 L436 S441 A442	S434-A438 PolarHBondContact O-N 3.29Å; S434-A438 VanDerWaalsContact O-N 3.16Å; K435-A438 PolarHBondContact O-N 2.87Å; L436-A438 VanDerWaalsContact C-N 3.32Å; L436-A438 PolarHBondContact O-N 2.96Å; A438-S441 PolarHBondContact O-OG 3.44Å; A438-A442 PolarHBondContact O-N 3.47Å
439	L	77	Confident	70.9	Confident	113 Å²	113	103.3 Å²	103.3	59%	0.592	58%	0.582	S	S	*	*	H	α-helix	trans	-72.9	-39.9	174.7	-76.4	164.3	0	0	0	111.6	K435 L436 S441 A442 V443	K435-L439 WeakPolarHBondContact O-CG 3.47Å; K435-L439 PolarHBondContact O-N 2.86Å; L436-L439 PolarHBondContact O-N 3.07Å; L439-S441 VanDerWaalsContact C-N 3.28Å; L439-S441 PolarHBondContact O-N 3.01Å; L439-A442 PolarHBondContact O-N 3.37Å; L439-V443 WeakPolarHBondContact O-CG2 3.48Å; L439-V443 PolarHBondContact O-N 2.93Å
440	S	70.4	Confident	69.1	Low	69 Å²	69	105.9 Å²	105.9	48%	0.483	60%	0.596	S	S	.	*	H	α-helix	trans	-63	-36.5	178.3	63.1	0	0	0	0	112.3	L436 T437 V443 T444	L436-S440 PolarHBondContact O-N 2.97Å; T437-S440 PolarHBondContact O-OG 3.19Å; S440-V443 PolarHBondContact O-N 3.31Å; S440-T444 PolarHBondContact O-N 3.41Å; S440-T444 PolarHBondContact O-OG1 3.36Å
441	S	75.2	Confident	66.7	Low	67 Å²	67	111.8 Å²	111.8	47%	0.469	61%	0.614	S	S	.	*	H	α-helix	trans	-71.2	-30	176.8	55.9	0	0	0	0	112.9	T437 A438 L439 T444	T437-S441 PolarHBondContact O-N 2.64Å; T437-S441 PolarHBondContact O-OG 3.4Å; A438-S441 PolarHBondContact O-OG 3.44Å; L439-S441 VanDerWaalsContact C-N 3.28Å; L439-S441 PolarHBondContact O-N 3.01Å; S441-T444 PolarHBondContact O-OG1 2.88Å
442	A	70.9	Confident	64.3	Low	58 Å²	58	116.5 Å²	116.5	48%	0.479	63%	0.63	S	S	.	*	H	α-helix	trans	-71.1	-40.2	174	0	0	0	0	0	112.4	A438 L439 T444 V445	A438-A442 PolarHBondContact O-N 3.47Å; L439-A442 PolarHBondContact O-N 3.37Å; A442-T444 VanDerWaalsContact C-N 3.32Å; A442-T444 PolarHBondContact O-N 3.49Å; A442-V445 PolarHBondContact O-N 3.41Å
443	V	62.9	Low	62.3	Low	95 Å²	95	122.7 Å²	122.7	58%	0.576	65%	0.651	S	S	*	*	H	α-helix	trans	-67.1	-32.1	-178.2	172.6	0	0	0	0	112.1	L439 S440 V445 Q446	L439-V443 WeakPolarHBondContact O-CG2 3.48Å; L439-V443 PolarHBondContact O-N 2.93Å; S440-V443 PolarHBondContact O-N 3.31Å; V443-V445 VanDerWaalsContact C-N 3.27Å; V443-V445 PolarHBondContact O-N 3.44Å; V443-Q446 PolarHBondContact O-N 2.93Å
444	T	55.3	Low	60.3	Low	95 Å²	95	124 Å²	124	58%	0.583	66%	0.663	S	S	*	*	H	α-helix	trans	-66.4	-26.3	175.7	38.5	0	0	0	0	113.6	S440 S441 A442 Q446	S440-T444 PolarHBondContact O-N 3.41Å; S440-T444 PolarHBondContact O-OG1 3.36Å; S441-T444 PolarHBondContact O-OG1 2.88Å; A442-T444 VanDerWaalsContact C-N 3.32Å; A442-T444 PolarHBondContact O-N 3.49Å; T444-Q446 VanDerWaalsContact C-N 3.32Å; T444-Q446 PolarHBondContact O-N 2.9Å
445	V	56.2	Low	57.8	Low	116 Å²	116	127.8 Å²	127.8	70%	0.703	68%	0.677	S	S	*	*	H	α-helix	trans	-75.5	-24.2	178.4	-179.9	0	0	0	0	111.8	A442 V443	A442-V445 PolarHBondContact O-N 3.41Å; V443-V445 VanDerWaalsContact C-N 3.27Å; V443-V445 PolarHBondContact O-N 3.44Å
446	Q	50.5	Low	55.3	Low	157 Å²	157	129.8 Å²	129.8	73%	0.734	69%	0.688	S	S	*	*	H	α-helix	trans	-89.4	-18.2	-173.3	-153.2	166.1	5.1	0	0	113.7	V443 T444	V443-Q446 PolarHBondContact O-N 2.93Å; T444-Q446 VanDerWaalsContact C-N 3.32Å; T444-Q446 PolarHBondContact O-N 2.9Å
447	K	44.5	Very low	53.3	Low	155 Å²	155	131.1 Å²	131.1	67%	0.674	70%	0.695	S	S	*	*	H	α-helix	trans	-79.6	-22.2	-175.1	-148.2	174.9	-176.7	179.6	0	113.7	A449	K447-A449 VanDerWaalsContact C-N 3.32Å; K447-A449 PolarHBondContact O-N 3.24Å
448	D	49	Very low	51.8	Low	150 Å²	150	131.7 Å²	131.7	80%	0.802	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-11.8	179.2	-72.2	-18.7	0	0	0	113.7
449	A	50	Low	49.4	Very low	86 Å²	86	136.2 Å²	136.2	71%	0.711	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-17.3	-178.3	0	0	0	0	0	114.5	K447	K447-A449 VanDerWaalsContact C-N 3.32Å; K447-A449 PolarHBondContact O-N 3.24Å
450	N	42.3	Very low	47.1	Very low	145 Å²	145	134.9 Å²	134.9	78%	0.775	72%	0.72	S	S	*	*	S	Bend	trans	-108.1	8.2	-162.6	-145.8	17.9	0	0	0	116.1
451	W	34.8	Very low	45.5	Very low	235 Å²	235	139.6 Å²	139.6	89%	0.89	74%	0.738	S	S	*	*	S	Bend	trans	-95.8	20.1	-177.5	-93.9	88	0	0	0	115.1
452	K	37.5	Very low	43.8	Very low	199 Å²	199	141.6 Å²	141.6	87%	0.865	75%	0.75	S	S	*	*	S	Bend	trans	-117.8	2.3	-173.6	-116.8	-178.5	-177.7	-179.6	0	118.6
453	E	37.8	Very low	42.9	Very low	181 Å²	181	144.3 Å²	144.3	85%	0.846	76%	0.762	S	S	*	*			trans	-138.4	94.8	177.7	-73.1	-177.1	169.3	0	0	111
454	Q	37.8	Very low	41.5	Very low	194 Å²	194	146 Å²	146	91%	0.907	78%	0.778	S	S	*	*			trans	176.9	82.5	150.7	-98.8	169.3	25.7	0	0	109.7
455	N	32.5	Very low	40.2	Very low	159 Å²	159	146.5 Å²	146.5	85%	0.85	79%	0.785	S	S	*	*			trans	-143.1	129	163.3	-91.6	-27.3	0	0	0	106
456	E	34.2	Very low	39	Very low	185 Å²	185	147.8 Å²	147.8	86%	0.864	79%	0.788	S	S	*	*			trans	135.2	127.4	171.3	-78.9	175	-162.7	0	0	107.8
457	L	35.5	Very low	38.1	Very low	148 Å²	148	150.8 Å²	150.8	78%	0.775	79%	0.794	S	S	*	*			cis	-173.6	-179.4	12.2	-107	162.8	0	0	0	107
458	P	50.1	Low	37.4	Very low	99 Å²	99	146.9 Å²	146.9	64%	0.643	80%	0.798	S	S	*	*			trans	-134.5	-156	-133.2	39.3	-15.4	0	0	0	115.8
459	I	32.3	Very low	36.5	Very low	155 Å²	155	148.4 Å²	148.4	80%	0.795	81%	0.805	S	S	*	*			trans	107	103.6	160.5	-55	166.7	0	0	0	112.5
460	A	28.7	Very low	35.7	Very low	84 Å²	84	149.8 Å²	149.8	69%	0.694	81%	0.809	S	S	*	*				93.4	120.1	52.6	0	0	0	0	0	113.9
461	I	38	Very low	35.2	Very low	168 Å²	168	150 Å²	150	86%	0.862	81%	0.81	S	S	*	*				-174.1	146.5	124.3	-86.8	155	0	0	0	109.3
462	P	39.6	Very low	35	Very low	110 Å²	110	148.2 Å²	148.2	71%	0.714	81%	0.812	S	S	*	*			trans	-118.9	-154.6	-162.1	37.4	-15.3	0	0	0	112.2
463	P	51.8	Low	34.7	Very low	115 Å²	115	142.6 Å²	142.6	75%	0.747	81%	0.81	S	S	*	*				-124.7	172.7	-83.2	38.5	-21.8	0	0	0	113.1
464	S	32.6	Very low	34.2	Very low	129 Å²	129	145 Å²	145	90%	0.902	81%	0.812	S	S	*	*			trans	-134.4	123.2	160.4	-70.6	0	0	0	0	109.7
465	S	29	Very low	33.8	Very low	106 Å²	106	142.2 Å²	142.2	74%	0.741	80%	0.803	S	S	*	*			trans	-99.7	145.2	179.5	50.2	0	0	0	0	110.3
466	L	29.7	Very low	33.7	Very low	143 Å²	143	145.6 Å²	145.6	75%	0.749	80%	0.804	S	S	*	*				164.9	131.9	128	-93.5	151.8	0	0	0	112.7
467	Y	32.1	Very low	33.4	Very low	220 Å²	220	147.8 Å²	147.8	86%	0.863	81%	0.806	S	S	*	*			trans	65.6	113.1	168	-70	-79	0	0	0	117.1
468	G	30.6	Very low	33.2	Very low	73 Å²	73	146.7 Å²	146.7	75%	0.753	80%	0.801	S	S	*	*			cis	121.6	64.1	21.1	0	0	0	0	0	109.6
469	L	30.8	Very low	32.1	Very low	182 Å²	182	151.5 Å²	151.5	95%	0.953	82%	0.815	S	S	*	*			trans	-93	109	172.3	-94.5	127.2	0	0	0	108.2
470	S	33.1	Very low	32	Very low	115 Å²	115	150.4 Å²	150.4	80%	0.804	81%	0.809	S	S	*	*			trans	-91.5	113.6	171.7	-168	0	0	0	0	108.7
471	D	30.8	Very low	32	Very low	150 Å²	150	154 Å²	154	80%	0.802	82%	0.817	S	S	*	*			trans	-62	144.3	148.4	-80.1	-44.3	0	0	0	109.3
472	E	31.3	Very low	31.6	Very low	197 Å²	197	155 Å²	155	92%	0.921	82%	0.815	S	S	*	*			trans	149.5	127.9	146	-86.6	176.4	167.8	0	0	111.1
473	G	29.6	Very low	31.1	Very low	81 Å²	81	160.5 Å²	160.5	84%	0.835	82%	0.822	S	S	*	*			trans	150.8	71.8	160.6	0	0	0	0	0	116.6
474	R	27.4	Very low	30.2	Very low	232 Å²	232	161 Å²	161	88%	0.875	82%	0.822	S	S	*	*			trans	-50.8	150.9	165.5	-78.3	174.9	172.7	177.1	-2.9	113.9
475	N	30.4	Very low	30.1	Very low	135 Å²	135	163.1 Å²	163.1	72%	0.722	82%	0.818	S	S	*	*			trans	56.3	104.6	143.9	-64.9	-6.1	0	0	0	119.1
476	R	30.8	Very low	30.1	Very low	231 Å²	231	165.7 Å²	165.7	87%	0.872	82%	0.823	S	S	*	*			trans	-140.8	91.7	143	-72.1	-168.4	-171.4	179.6	2.9	109.7	N478	R476-N478 PolarHBondContact O-N 2.9Å
477	Y	26.7	Very low	29.9	Very low	230 Å²	230	161.9 Å²	161.9	90%	0.902	82%	0.819	S	S	*	*			trans	-81.8	99.2	155	-86.9	-89	0	0	0	106.1
478	N	32.4	Very low	29.9	Very low	126 Å²	126	158.6 Å²	158.6	67%	0.674	82%	0.822	S	S	*	*			trans	-108.9	107.1	165.5	-81.6	5.1	0	0	0	107.6	R476 I480	R476-N478 PolarHBondContact O-N 2.9Å; N478-I480 PolarHBondContact O-N 3.2Å
479	E	26.1	Very low	29.7	Very low	199 Å²	199	162.6 Å²	162.6	93%	0.93	83%	0.826	S	S	*	*			trans	-43.5	118.2	156.2	-156.3	166.4	-155.4	0	0	109.4
480	I	30.6	Very low	29.7	Very low	133 Å²	133	160.1 Å²	160.1	68%	0.682	82%	0.822	S	S	*	*			trans	-124.2	107.2	174.2	-64.6	177.1	0	0	0	107.5	N478 F482	N478-I480 PolarHBondContact O-N 3.2Å; I480-F482 PolarHBondContact O-N 2.96Å
481	D	29.2	Very low	29.6	Very low	159 Å²	159	158.9 Å²	158.9	85%	0.85	82%	0.82	S	S	*	*			trans	-52.8	117.1	167.1	-93.1	-37.6	0	0	0	111.3	R483	D481-R483 PolarHBondContact O-N 3.27Å
482	F	29.8	Very low	29.4	Very low	189 Å²	189	162.5 Å²	162.5	83%	0.829	82%	0.822	S	S	*	*			trans	-87.4	91.3	166.4	-88.6	-87.6	0	0	0	109.9	I480 V484	I480-F482 PolarHBondContact O-N 2.96Å; F482-V484 PolarHBondContact O-N 2.79Å
483	R	28.4	Very low	29.4	Very low	225 Å²	225	159.6 Å²	159.6	85%	0.849	82%	0.817	S	S	*	*			trans	-73.1	111.3	157.4	-106.2	-174.3	-176.5	-165	2.2	108.7	D481 E485	D481-R483 PolarHBondContact O-N 3.27Å; R483-E485 PolarHBondContact O-N 2.67Å
484	V	32.3	Very low	29.5	Very low	125 Å²	125	162 Å²	162	76%	0.758	81%	0.811	S	S	*	*			trans	-76.7	97.7	171.8	178.2	0	0	0	0	108.5	F482	F482-V484 PolarHBondContact O-N 2.79Å
485	E	32	Very low	29.9	Very low	174 Å²	174	158.2 Å²	158.2	81%	0.813	81%	0.808	S	S	*	*			trans	-82	111.7	166.2	-83.7	-174.9	165	0	0	109.9	R483 G487	R483-E485 PolarHBondContact O-N 2.67Å; E485-G487 PolarHBondContact O-N 3.49Å
486	N	29	Very low	30	Very low	160 Å²	160	156 Å²	156	86%	0.856	80%	0.803	S	S	*	*			trans	-63.2	115	166.6	-81.6	-29.1	0	0	0	110.1
487	G	25	Very low	30.1	Very low	64 Å²	64	151.9 Å²	151.9	66%	0.66	80%	0.798	S	S	*	*			trans	-168.7	103.6	171.3	0	0	0	0	0	111.5	E485	E485-G487 PolarHBondContact O-N 3.49Å
488	T	31.1	Very low	30.5	Very low	151 Å²	151	148.4 Å²	148.4	93%	0.926	80%	0.796	S	S	*	*			trans	-161.4	97.6	146	12.5	0	0	0	0	109.7
489	N	27.7	Very low	30.5	Very low	157 Å²	157	149.2 Å²	149.2	84%	0.84	80%	0.8	S	S	*	*			trans	-56	142.5	152.2	-73.2	-48	0	0	0	110.8
490	C	31.1	Very low	30.6	Very low	129 Å²	129	144.6 Å²	144.6	87%	0.872	79%	0.785	S	S	*	*			trans	-172.8	92.9	143.5	-89.7	0	0	0	0	105.7
491	A	29.4	Very low	30.8	Very low	90 Å²	90	146.8 Å²	146.8	74%	0.744	79%	0.792	S	S	*	*				65.6	113.1	72.3	0	0	0	0	0	114.8
492	R	26.6	Very low	30.8	Very low	225 Å²	225	145.6 Å²	145.6	85%	0.849	79%	0.786	S	S	*	*			trans	68.4	130	152.6	-76.9	176.8	164.2	155.3	-3.4	118.6
493	V	33.1	Very low	31	Very low	136 Å²	136	144.9 Å²	144.9	82%	0.824	79%	0.789	S	S	*	*				-160.1	135.6	87.3	159.3	0	0	0	0	109.2
494	D	31	Very low	31	Very low	131 Å²	131	140.2 Å²	140.2	70%	0.701	78%	0.782	S	S	*	*			trans	-70.4	144.8	176.4	-61.2	-67.2	0	0	0	112.8
495	D	35.4	Very low	30.8	Very low	153 Å²	153	139.3 Å²	139.3	82%	0.818	78%	0.781	S	S	*	*			trans	-162.2	95.4	149.4	-92.2	-33.5	0	0	0	106.6
496	S	33.5	Very low	30.6	Very low	89 Å²	89	135 Å²	135	62%	0.622	78%	0.775	S	S	*	*				75.2	110	78.7	79.6	0	0	0	0	114.2
497	D	31.3	Very low	30.6	Very low	144 Å²	144	134.2 Å²	134.2	77%	0.77	77%	0.771	S	S	*	*			trans	63.9	111.3	144.7	-53.5	-24.3	0	0	0	121.3
498	N	35	Very low	30.7	Very low	157 Å²	157	136.8 Å²	136.8	84%	0.84	77%	0.774	S	S	*	*				-171.7	98.3	121.4	-93.6	-33.6	0	0	0	112.4
499	D	32.5	Very low	30.6	Very low	143 Å²	143	133.5 Å²	133.5	77%	0.765	76%	0.757	S	S	*	*				32.9	122.5	125.3	-77.4	-22.4	0	0	0	122.8
500	V	29.7	Very low	30.5	Very low	102 Å²	102	133.2 Å²	133.2	62%	0.618	76%	0.756	S	S	*	*				73.2	106.1	125.3	-173.8	0	0	0	0	118.3
501	H	34	Very low	30.5	Very low	180 Å²	180	132.3 Å²	132.3	83%	0.833	75%	0.751	S	S	*	*				-171.6	123.1	105.9	-102.7	-65.3	0	0	0	112.9
502	N	28.8	Very low	30.5	Very low	133 Å²	133	132.1 Å²	132.1	71%	0.711	75%	0.749	S	S	*	*			trans	-41.9	145.4	158.4	-76.6	-46.4	0	0	0	112.9
503	L	33.8	Very low	30.7	Very low	174 Å²	174	131.9 Å²	131.9	91%	0.911	75%	0.748	S	S	*	*				-158.8	127.1	125.1	-102.6	163.9	0	0	0	110.9
504	N	28.7	Very low	30.8	Very low	128 Å²	128	131.8 Å²	131.8	68%	0.684	74%	0.743	S	S	*	*			trans	-72.7	171.9	-172.9	-76.5	-45.8	0	0	0	113.9
505	S	28.6	Very low	30.7	Very low	105 Å²	105	130 Å²	130	73%	0.734	75%	0.746	S	S	*	*			trans	77.5	104.4	136.3	41.2	0	0	0	0	116.4
506	A	27.5	Very low	30.8	Very low	85 Å²	85	128.8 Å²	128.8	70%	0.702	75%	0.747	S	S	*	*				78.1	117.2	80.9	0	0	0	0	0	111.9
507	N	29.8	Very low	30.7	Very low	143 Å²	143	128.8 Å²	128.8	77%	0.765	75%	0.752	S	S	*	*			trans	176	109.2	134	-95.2	-25.5	0	0	0	108.5
508	T	27.3	Very low	31	Very low	117 Å²	117	128.3 Å²	128.3	72%	0.718	76%	0.757	S	S	*	*				65.7	139.2	94.9	53.1	0	0	0	0	111.8
509	S	27	Very low	30.8	Very low	82 Å²	82	126 Å²	126	57%	0.573	75%	0.753	S	S	*	*			cis	171.6	154.6	-7	51	0	0	0	0	104.3
510	N	27	Very low	30.8	Very low	152 Å²	152	123.7 Å²	123.7	81%	0.813	75%	0.754	S	S	*	*			trans	70.7	120.4	147.1	-57.1	-19.8	0	0	0	119.6
511	S	31	Very low	30.9	Very low	110 Å²	110	125.3 Å²	125.3	77%	0.769	76%	0.763	S	S	*	*				172.5	96.4	106.7	-170	0	0	0	0	106.8
512	A	28.5	Very low	30.7	Very low	85 Å²	85	126.1 Å²	126.1	70%	0.702	77%	0.768	S	S	*	*				44.7	109.5	83.4	0	0	0	0	0	113.2
513	R	31.2	Very low	30.7	Very low	221 Å²	221	124 Å²	124	83%	0.834	76%	0.764	S	S	*	*				179.3	135.1	119.9	-105.3	-176.4	159.4	147.4	-1.1	114.7
514	D	35.5	Very low	30.6	Very low	134 Å²	134	124.7 Å²	124.7	72%	0.717	76%	0.759	S	S	*	*			trans	86.4	97.5	139.4	-55.4	-22.8	0	0	0	120.8
515	A	27.8	Very low	30.7	Very low	93 Å²	93	127.2 Å²	127.2	77%	0.769	77%	0.767	S	S	*	*			trans	-62.4	163.3	151.7	0	0	0	0	0	112.1
516	P	38.4	Very low	31.8	Very low	128 Å²	128	127.4 Å²	127.4	83%	0.831	77%	0.766	S	S	*	*				-144.9	148.5	96.1	33.7	-16.3	0	0	0	115.5
517	A	31.1	Very low	31.9	Very low	88 Å²	88	132.3 Å²	132.3	73%	0.727	78%	0.776	S	S	*	*			trans	-74.3	164.3	170.8	0	0	0	0	0	113.1
518	P	38.9	Very low	31.9	Very low	135 Å²	135	130.6 Å²	130.6	88%	0.877	78%	0.775	S	S	*	*				-133.6	137.8	122.1	25.7	-8.1	0	0	0	113.4
519	S	30.2	Very low	32	Very low	107 Å²	107	132.8 Å²	132.8	75%	0.748	78%	0.783	S	S	*	*			trans	-87.2	144.2	178.6	48.6	0	0	0	0	113.7
520	A	32.6	Very low	32.2	Very low	96 Å²	96	133.7 Å²	133.7	79%	0.793	79%	0.789	S	S	*	*			trans	-168	94.4	147.9	0	0	0	0	0	106.7
521	V	31.4	Very low	32.4	Very low	135 Å²	135	133.5 Å²	133.5	82%	0.818	79%	0.788	S	S	*	*				51.5	93.2	85.3	-173	0	0	0	0	112.8
522	E	29.9	Very low	32.3	Very low	197 Å²	197	132.2 Å²	132.2	92%	0.921	78%	0.784	S	S	*	*			trans	-154.4	155.1	134.6	-124.1	173.2	-171.9	0	0	109.9
523	S	29.6	Very low	32.5	Very low	90 Å²	90	135.6 Å²	135.6	63%	0.629	79%	0.79	S	S	*	*			trans	-138	159.4	-137.1	53.6	0	0	0	0	112.4
524	K	31.4	Very low	32.4	Very low	187 Å²	187	132.2 Å²	132.2	81%	0.813	79%	0.789	S	S	*	*			trans	86.3	109	159.8	-64.6	174.4	171.7	176.8	0	116.1
525	E	30.4	Very low	32	Very low	182 Å²	182	131 Å²	131	85%	0.85	79%	0.786	S	S	*	*				99.8	154.9	66.8	-97	-158.7	162.2	0	0	112.4
526	P	52.5	Low	31.9	Very low	109 Å²	109	132.3 Å²	132.3	71%	0.708	79%	0.785	S	S	*	*				-122.8	165.6	-126	41.5	-29.2	0	0	0	115.2
527	M	29.6	Very low	31.5	Very low	187 Å²	187	130.3 Å²	130.3	92%	0.921	78%	0.779	S	S	*	*			trans	-153.6	146.1	156.6	-71.4	-157.8	-175	0	0	107.5
528	S	29.9	Very low	31.5	Very low	107 Å²	107	133.9 Å²	133.9	75%	0.748	79%	0.785	S	S	*	*			cis	-172.9	134.3	-14.4	50.2	0	0	0	0	104.3
529	N	28.2	Very low	31.1	Very low	164 Å²	164	135 Å²	135	88%	0.877	78%	0.783	S	S	*	*			trans	-57.1	140.8	172.7	-73.5	-28.7	0	0	0	112.7
530	S	31.6	Very low	31.1	Very low	101 Å²	101	137.9 Å²	137.9	71%	0.706	78%	0.784	S	S	*	*			trans	-160.3	107.9	143.2	58.7	0	0	0	0	112.3
531	N	31	Very low	31.1	Very low	147 Å²	147	138.1 Å²	138.1	79%	0.786	78%	0.78	S	S	*	*			trans	48.4	114.5	130	-56.4	-10.2	0	0	0	118
532	A	28.7	Very low	31	Very low	83 Å²	83	139.3 Å²	139.3	69%	0.686	78%	0.78	S	S	*	*				52.5	108.6	66.5	0	0	0	0	0	113.2
533	N	32.1	Very low	31	Very low	156 Å²	156	134 Å²	134	83%	0.834	77%	0.765	S	S	*	*			trans	153.3	97.8	149.3	-75.3	-9.4	0	0	0	106.7
534	D	29.4	Very low	31	Very low	151 Å²	151	136.4 Å²	136.4	81%	0.807	78%	0.776	S	S	*	*				73.4	142.9	71.6	-152.3	11.8	0	0	0	112.4
535	V	27.8	Very low	31	Very low	109 Å²	109	136 Å²	136	66%	0.661	78%	0.777	S	S	*	*			trans	101.1	92.6	161.1	-172.8	0	0	0	0	118.4
536	T	26.3	Very low	31	Very low	120 Å²	120	135.2 Å²	135.2	74%	0.736	78%	0.779	S	S	*	*			trans	66.3	114.9	131.2	53.7	0	0	0	0	123.2
537	A	29.8	Very low	30.1	Very low	85 Å²	85	136.6 Å²	136.6	70%	0.702	79%	0.785	S	S	*	*				31.9	104.4	113.8	0	0	0	0	0	118
538	N	30.7	Very low	30.2	Very low	163 Å²	163	130.5 Å²	130.5	87%	0.872	77%	0.769	S	S	*	*			trans	-120.2	102.4	148.3	-95.8	-11.6	0	0	0	108.7
539	I	29.3	Very low	30.3	Very low	160 Å²	160	131.6 Å²	131.6	82%	0.821	77%	0.771	S	S	*	*			trans	-72.8	115.2	155.4	-67.1	167.1	0	0	0	105.4
540	E	30.7	Very low	30.6	Very low	167 Å²	167	132.7 Å²	132.7	78%	0.78	77%	0.771	S	S	*	*			trans	-155.3	96.3	155	-114.8	170.5	-162.6	0	0	109.3
541	S	33.1	Very low	30.7	Very low	101 Å²	101	133 Å²	133	71%	0.706	77%	0.769	S	S	*	*			trans	10.8	117.1	139.6	54	0	0	0	0	117.2
542	I	28.4	Very low	31	Very low	159 Å²	159	130.6 Å²	130.6	82%	0.815	76%	0.763	S	S	*	*			trans	-145.1	117.9	146.3	-88.6	128.5	0	0	0	109
543	S	29.7	Very low	31.7	Very low	85 Å²	85	132.3 Å²	132.3	59%	0.594	77%	0.765	S	S	*	*			trans	10.9	126.9	158	58.3	0	0	0	0	120.9	E545	S543-E545 PolarHBondContact O-N 3.4Å
544	T	30.3	Very low	32.6	Very low	142 Å²	142	129.9 Å²	129.9	87%	0.871	75%	0.752	S	S	*	*			trans	-12.3	93.9	137.7	49.7	0	0	0	0	114.5
545	E	31.1	Very low	33.3	Very low	178 Å²	178	131 Å²	131	83%	0.832	75%	0.75	S	S	*	*			trans	-80.5	114.7	160.6	-81.8	-175.8	155.6	0	0	108.2	S543 V547	S543-E545 PolarHBondContact O-N 3.4Å; E545-V547 PolarHBondContact O-N 3.35Å
546	D	31.6	Very low	34.4	Very low	166 Å²	166	129.5 Å²	129.5	89%	0.888	75%	0.749	S	S	*	*			trans	-46.4	107.5	162.7	-90.7	-42.6	0	0	0	109	G548	D546-G548 PolarHBondContact O-N 3.36Å
547	V	33	Very low	35.8	Very low	138 Å²	138	129.7 Å²	129.7	84%	0.836	74%	0.739	S	S	*	*			trans	-67.5	88	169.3	179.1	0	0	0	0	106.7	E545 V549	E545-V547 PolarHBondContact O-N 3.35Å; V547-V549 PolarHBondContact O-N 3.37Å; V547-V549 VanDerWaalsContact O-N 3.16Å
548	G	31.2	Very low	36.7	Very low	58 Å²	58	129.8 Å²	129.8	60%	0.598	73%	0.726	S	S	*	*			trans	-51.5	119.1	171.3	0	0	0	0	0	109.1	D546 Q550	D546-G548 PolarHBondContact O-N 3.36Å; G548-Q550 VanDerWaalsContact C-N 3.32Å; G548-Q550 PolarHBondContact O-N 3.21Å
549	V	32.4	Very low	37.9	Very low	130 Å²	130	124.9 Å²	124.9	79%	0.788	71%	0.707	S	S	*	*			trans	-56.5	97.2	172.1	178.2	0	0	0	0	107.5	V547 T551	V547-V549 PolarHBondContact O-N 3.37Å; V547-V549 VanDerWaalsContact O-N 3.16Å; V549-T551 HydrophobicContact CG1-CG2 4.1Å; V549-T551 PolarHBondContact O-N 2.79Å
550	Q	34.2	Very low	39.8	Very low	188 Å²	188	121.6 Å²	121.6	88%	0.879	69%	0.689	S	S	*	*			trans	-72.8	88.1	173.8	-163.3	159.4	8.1	0	0	106.9	G548 C552	G548-Q550 VanDerWaalsContact C-N 3.32Å; G548-Q550 PolarHBondContact O-N 3.21Å; Q550-C552 PolarHBondContact O-N 2.03Å; Q550-C552 VanDerWaalsContact O-N 3.12Å
551	T	34.5	Very low	41.5	Very low	107 Å²	107	119 Å²	119	66%	0.656	67%	0.674	S	S	*	*			trans	-61.3	112.9	175.3	46.4	0	0	0	0	108.7	V549 T553	V549-T551 HydrophobicContact CG1-CG2 4.1Å; V549-T551 PolarHBondContact O-N 2.79Å; T551-T553 PolarHBondContact O-N 2.01Å
552	C	36.6	Very low	42.4	Very low	97 Å²	97	121 Å²	121	66%	0.655	67%	0.668	S	S	*	*			trans	-42.9	106.8	175.4	-84.8	0	0	0	0	112.4	Q550	Q550-C552 PolarHBondContact O-N 2.03Å; Q550-C552 VanDerWaalsContact O-N 3.12Å
553	T	44.2	Very low	44.5	Very low	118 Å²	118	120 Å²	120	72%	0.724	66%	0.659	S	S	*	*			trans	-83.2	3.1	165.4	41.5	0	0	0	0	112.7	T551 F555 A556	T551-T553 PolarHBondContact O-N 2.01Å; T553-F555 VanDerWaalsContact C-N 3.29Å; T553-F555 PolarHBondContact O-N 3.44Å; T553-A556 PolarHBondContact O-N 3.04Å
554	D	50.1	Low	46.8	Very low	105 Å²	105	121.5 Å²	121.5	56%	0.561	66%	0.655	S	S	*	*	H	α-helix	trans	-63.2	-26.9	-172.9	-65.9	-35.3	0	0	0	114.7	A556 F557 E558	D554-A556 PolarHBondContact O-N 3.37Å; D554-F557 PolarHBondContact O-N 2.87Å; D554-E558 PolarHBondContact O-N 2.78Å
555	F	43.9	Very low	48.4	Very low	176 Å²	176	118.6 Å²	118.6	77%	0.772	63%	0.634	S	S	*	*	H	α-helix	trans	-68.6	-33.4	-179	-85.6	-78.5	0	0	0	113.6	T553 F557 A559	T553-F555 VanDerWaalsContact C-N 3.29Å; T553-F555 PolarHBondContact O-N 3.44Å; F555-F557 VanDerWaalsContact C-N 3.32Å; F555-A559 PolarHBondContact O-N 3.34Å; F555-A559 VanDerWaalsContact O-N 3.17Å
556	A	50.3	Low	49.9	Very low	77 Å²	77	115.5 Å²	115.5	64%	0.636	62%	0.623	S	S	*	*	H	α-helix	trans	-69	-35.5	178.2	0	0	0	0	0	111.3	T553 D554 E560	T553-A556 PolarHBondContact O-N 3.04Å; D554-A556 PolarHBondContact O-N 3.37Å; A556-E560 PolarHBondContact O-N 3.44Å
557	F	55.9	Low	52.2	Low	123 Å²	123	113.4 Å²	113.4	54%	0.539	61%	0.608	S	S	.	*	H	α-helix	trans	-71.3	-36.3	178.9	-172.5	-105	0	0	0	112.8	D554 F555 K561	D554-F557 PolarHBondContact O-N 2.87Å; F555-F557 VanDerWaalsContact C-N 3.32Å; F557-K561 HydrophobicContact CE1-CD 4.35Å; F557-K561 VanDerWaalsContact CE1-CE 3.48Å; F557-K561 PolarHBondContact O-N 3.16Å
558	E	50.5	Low	54	Low	88 Å²	88	114.3 Å²	114.3	41%	0.411	60%	0.596	S	S	.	*	H	α-helix	trans	-66.6	-43.1	173.4	-78.9	-76.6	133.9	0	0	111.8	D554 E560 K561 Y562	D554-E558 PolarHBondContact O-N 2.78Å; E558-E560 PolarHBondContact O-N 3.46Å; E558-K561 WeakPolarHBondContact O-CB 3.47Å; E558-K561 PolarHBondContact O-N 3.44Å; E558-Y562 VanDerWaalsContact O-CD2 3.3Å; E558-Y562 WeakPolarHBondContact O-CD2 3.42Å; E558-Y562 PolarHBondContact O-N 3.04Å; E558-Y562 VanDerWaalsContact O-N 3.15Å
559	A	55.6	Low	55.3	Low	59 Å²	59	115.6 Å²	115.6	49%	0.488	59%	0.588	S	S	.	*	H	α-helix	trans	-60.4	-43.9	179.3	0	0	0	0	0	112.4	F555 K561 Y562 E563	F555-A559 PolarHBondContact O-N 3.34Å; F555-A559 VanDerWaalsContact O-N 3.17Å; A559-K561 VanDerWaalsContact C-N 3.26Å; A559-K561 PolarHBondContact O-N 3.04Å; A559-Y562 PolarHBondContact O-N 3.46Å; A559-E563 PolarHBondContact O-N 2.99Å
560	E	68.5	Low	57.1	Low	92 Å²	92	112 Å²	112	43%	0.43	57%	0.572	S	S	.	*	H	α-helix	trans	-62.1	-32.7	177.9	-162.6	-167.7	149.4	0	0	112.3	A556 E558 K564	A556-E560 PolarHBondContact O-N 3.44Å; E558-E560 PolarHBondContact O-N 3.46Å; E560-K564 PolarHBondContact O-N 3.37Å; E560-K564 WeakPolarHBondContact OE1-CE 3.39Å; E560-K564 IonicContact OE1-NZ 2.73Å; E560-K564 PolarHBondContact OE1-NZ 3.15Å
561	K	66.5	Low	59.1	Low	111 Å²	111	107 Å²	107	48%	0.483	55%	0.552	S	S	.	*	H	α-helix	trans	-70.1	-42.9	175.5	-83.3	-177.6	177.3	176.1	0	112.8	F557 E558 A559 E563 K564 L565	F557-K561 HydrophobicContact CE1-CD 4.35Å; F557-K561 VanDerWaalsContact CE1-CE 3.48Å; F557-K561 PolarHBondContact O-N 3.16Å; E558-K561 WeakPolarHBondContact O-CB 3.47Å; E558-K561 PolarHBondContact O-N 3.44Å; A559-K561 VanDerWaalsContact C-N 3.26Å; A559-K561 PolarHBondContact O-N 3.04Å; K561-E563 VanDerWaalsContact C-N 3.29Å; K561-K564 PolarHBondContact O-N 3.02Å; K561-L565 PolarHBondContact O-N 3.09Å; K561-L565 VanDerWaalsContact O-N 3.1Å
562	Y	52.8	Low	60.6	Low	145 Å²	145	104.7 Å²	104.7	57%	0.569	54%	0.535	S	S	*	.	H	α-helix	trans	-64.6	-37.3	176.5	-83	-78.5	0	0	0	111.5	E558 A559 L565 L566	E558-Y562 VanDerWaalsContact O-CD2 3.3Å; E558-Y562 WeakPolarHBondContact O-CD2 3.42Å; E558-Y562 PolarHBondContact O-N 3.04Å; E558-Y562 VanDerWaalsContact O-N 3.15Å; A559-Y562 PolarHBondContact O-N 3.46Å; Y562-L565 PolarHBondContact O-N 2.88Å; Y562-L566 WeakPolarHBondContact O-CB 3.48Å; Y562-L566 VanDerWaalsContact O-CG 3.3Å; Y562-L566 WeakPolarHBondContact O-CG 3.15Å; Y562-L566 PolarHBondContact O-N 2.79Å
563	E	71.3	Confident	61.8	Low	136 Å²	136	105.3 Å²	105.3	64%	0.636	53%	0.528	S	S	*	.	H	α-helix	trans	-63.1	-45.8	177.5	-162.6	168.2	-163.3	0	0	111.7	A559 K561 L565 L566 E567	A559-E563 PolarHBondContact O-N 2.99Å; K561-E563 VanDerWaalsContact C-N 3.29Å; E563-L565 VanDerWaalsContact C-N 3.33Å; E563-L565 PolarHBondContact O-N 3.31Å; E563-L566 PolarHBondContact O-N 2.79Å; E563-E567 WeakPolarHBondContact O-CB 3.3Å; E563-E567 PolarHBondContact O-N 2.91Å
564	K	77.7	Confident	63.5	Low	118 Å²	118	105.1 Å²	105.1	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-62.2	-36.5	174.2	-73.9	176.6	-173.5	161.8	0	113.2	E560 K561 R568	E560-K564 PolarHBondContact O-N 3.37Å; E560-K564 WeakPolarHBondContact OE1-CE 3.39Å; E560-K564 IonicContact OE1-NZ 2.73Å; E560-K564 PolarHBondContact OE1-NZ 3.15Å; K561-K564 PolarHBondContact O-N 3.02Å; K564-R568 WeakPolarHBondContact O-CB 3.19Å; K564-R568 PolarHBondContact O-N 3.18Å; K564-R568 VanDerWaalsContact O-N 3.16Å
565	L	64.2	Low	64.6	Low	81 Å²	81	104.3 Å²	104.3	42%	0.424	51%	0.513	S	S	.	.	H	α-helix	trans	-67	-44.5	175.6	-177.8	69	0	0	0	111.2	K561 Y562 E563 R568 I569	K561-L565 PolarHBondContact O-N 3.09Å; K561-L565 VanDerWaalsContact O-N 3.1Å; Y562-L565 PolarHBondContact O-N 2.88Å; E563-L565 VanDerWaalsContact C-N 3.33Å; E563-L565 PolarHBondContact O-N 3.31Å; L565-R568 PolarHBondContact O-N 3.42Å; L565-I569 HydrophobicContact CG-CD1 4.07Å; L565-I569 WeakPolarHBondContact O-CG1 3.48Å; L565-I569 PolarHBondContact O-N 2.95Å
566	L	62.5	Low	65.6	Low	113 Å²	113	102 Å²	102	59%	0.592	50%	0.5	S	S	*	.	H	α-helix	trans	-64.8	-41.8	179.2	-73.3	170.4	0	0	0	111.9	Y562 E563 R568 I569 A570	Y562-L566 WeakPolarHBondContact O-CB 3.48Å; Y562-L566 VanDerWaalsContact O-CG 3.3Å; Y562-L566 WeakPolarHBondContact O-CG 3.15Å; Y562-L566 PolarHBondContact O-N 2.79Å; E563-L566 PolarHBondContact O-N 2.79Å; L566-R568 VanDerWaalsContact C-N 3.29Å; L566-R568 PolarHBondContact O-N 3.49Å; L566-I569 PolarHBondContact O-N 2.93Å; L566-A570 WeakPolarHBondContact O-CB 3.38Å; L566-A570 PolarHBondContact O-N 2.65Å
567	E	79.5	Confident	66.5	Low	122 Å²	122	102.5 Å²	102.5	57%	0.57	49%	0.489	S	S	*	.	H	α-helix	trans	-58.9	-41.8	173.6	-171	179.4	-170.1	0	0	111.1	E563 A570 N571	E563-E567 WeakPolarHBondContact O-CB 3.3Å; E563-E567 PolarHBondContact O-N 2.91Å; E567-A570 PolarHBondContact O-N 2.69Å; E567-N571 PolarHBondContact O-N 2.84Å; E567-N571 PolarHBondContact O-ND2 2.96Å
568	R	72.3	Confident	67.5	Low	157 Å²	157	100.9 Å²	100.9	59%	0.592	49%	0.485	S	S	*	.	H	α-helix	trans	-69.6	-36.4	179.3	-148.2	162.9	-176.2	175.4	-2.6	112.8	K564 L565 L566 L572	K564-R568 WeakPolarHBondContact O-CB 3.19Å; K564-R568 PolarHBondContact O-N 3.18Å; K564-R568 VanDerWaalsContact O-N 3.16Å; L565-R568 PolarHBondContact O-N 3.42Å; L566-R568 VanDerWaalsContact C-N 3.29Å; L566-R568 PolarHBondContact O-N 3.49Å; R568-L572 PolarHBondContact O-N 3.09Å; R568-L572 VanDerWaalsContact O-N 3.12Å
569	I	58.2	Low	68.2	Low	84 Å²	84	99 Å²	99	43%	0.431	48%	0.478	S	S	.	.	H	α-helix	trans	-65.8	-42.1	172.9	-69.3	167.6	0	0	0	110.6	L565 L566 N571 L572 H573	L565-I569 HydrophobicContact CG-CD1 4.07Å; L565-I569 WeakPolarHBondContact O-CG1 3.48Å; L565-I569 PolarHBondContact O-N 2.95Å; L566-I569 PolarHBondContact O-N 2.93Å; I569-N571 PolarHBondContact O-N 3.42Å; I569-L572 PolarHBondContact O-N 3.48Å; I569-H573 WeakPolarHBondContact O-CB 3.43Å; I569-H573 PolarHBondContact O-N 2.73Å
570	A	70.3	Confident	68.7	Low	55 Å²	55	99.3 Å²	99.3	46%	0.455	47%	0.471	S	S	.	.	H	α-helix	trans	-60.8	-45	177.2	0	0	0	0	0	111.5	L566 E567 L572 H573 E574	L566-A570 WeakPolarHBondContact O-CB 3.38Å; L566-A570 PolarHBondContact O-N 2.65Å; E567-A570 PolarHBondContact O-N 2.69Å; A570-L572 PolarHBondContact O-N 3.09Å; A570-H573 WeakPolarHBondContact O-CB 3.07Å; A570-H573 PolarHBondContact O-N 3.43Å; A570-E574 PolarHBondContact O-N 3.04Å
571	N	76.2	Confident	68.8	Low	84 Å²	84	98.7 Å²	98.7	45%	0.449	47%	0.474	S	S	.	.	H	α-helix	trans	-62.6	-40.8	176.7	-70	-19.7	0	0	0	112.7	E567 I569 H573 E574 M575	E567-N571 PolarHBondContact O-N 2.84Å; E567-N571 PolarHBondContact O-ND2 2.96Å; I569-N571 PolarHBondContact O-N 3.42Å; N571-H573 VanDerWaalsContact C-N 3.34Å; N571-E574 PolarHBondContact O-N 3.4Å; N571-M575 PolarHBondContact O-N 3.47Å
572	L	66.2	Low	68.6	Low	57 Å²	57	97.9 Å²	97.9	30%	0.298	47%	0.47	S	S	.	.	H	α-helix	trans	-63.7	-40.3	174.6	-94.8	156.1	0	0	0	112.1	R568 I569 A570 M575 Y576 M615	R568-L572 PolarHBondContact O-N 3.09Å; R568-L572 VanDerWaalsContact O-N 3.12Å; I569-L572 PolarHBondContact O-N 3.48Å; A570-L572 PolarHBondContact O-N 3.09Å; L572-M575 PolarHBondContact O-N 3.45Å; L572-Y576 WeakPolarHBondContact O-CB 3.32Å; L572-Y576 PolarHBondContact O-N 3.06Å; L572-M615 HydrophobicContact CD1-SD 4.3Å
573	H	61.2	Low	69.1	Low	111 Å²	111	97.2 Å²	97.2	51%	0.514	47%	0.473	S	S	.	.	H	α-helix	trans	-67.2	-40.5	178	-167.3	-108.2	0	0	0	111.6	I569 A570 N571 Y576 H577	I569-H573 WeakPolarHBondContact O-CB 3.43Å; I569-H573 PolarHBondContact O-N 2.73Å; A570-H573 WeakPolarHBondContact O-CB 3.07Å; A570-H573 PolarHBondContact O-N 3.43Å; N571-H573 VanDerWaalsContact C-N 3.34Å; H573-Y576 PolarHBondContact O-N 3.21Å; H573-H577 AromaticContact CE1-CD2 3.35Å; H573-H577 PolarHBondContact CE1-CD2 3.19Å; H573-H577 AromaticContact CE1-NE2 3.06Å; H573-H577 PolarHBondContact CE1-NE2 2.83Å; H573-H577 AromaticContact ND1-CD2 3.54Å; H573-H577 AromaticContact ND1-NE2 3.76Å; H573-H577 AromaticContact NE2-CD2 3.87Å; H573-H577 AromaticContact NE2-NE2 3.43Å; H573-H577 PolarHBondContact NE2-NE2 3.2Å; H573-H577 PolarHBondContact O-CD2 3.33Å; H573-H577 VanDerWaalsContact O-CD2 3.31Å; H573-H577 PolarHBondContact O-N 3.45Å
574	E	80.2	Confident	69.1	Low	114 Å²	114	93.9 Å²	93.9	53%	0.533	47%	0.468	S	S	.	.	H	α-helix	trans	-63.5	-46.9	173.6	-173.5	177.5	177.6	0	0	111.7	A570 N571 Y576 H577 N578	A570-E574 PolarHBondContact O-N 3.04Å; N571-E574 PolarHBondContact O-N 3.4Å; E574-Y576 VanDerWaalsContact C-N 3.3Å; E574-Y576 PolarHBondContact O-N 3.26Å; E574-H577 PolarHBondContact O-N 2.89Å; E574-N578 WeakPolarHBondContact O-CB 3.23Å; E574-N578 VanDerWaalsContact O-CG 3.29Å; E574-N578 PolarHBondContact O-N 3.14Å; E574-N578 PolarHBondContact O-ND2 3.08Å
575	M	72.3	Confident	68.9	Low	87 Å²	87	94.2 Å²	94.2	43%	0.429	48%	0.475	S	S	.	.	H	α-helix	trans	-56.4	-43.3	173.7	-90.3	176.4	38.5	0	0	112.4	N571 L572 N578 L579 I608	N571-M575 PolarHBondContact O-N 3.47Å; L572-M575 PolarHBondContact O-N 3.45Å; M575-N578 PolarHBondContact O-N 2.67Å; M575-L579 PolarHBondContact O-N 3.07Å; M575-I608 HydrophobicContact CE-CG1 4.3Å
576	Y	65	Low	68.7	Low	129 Å²	129	91.5 Å²	91.5	51%	0.506	46%	0.462	S	S	.	.	H	α-helix	trans	-63.6	-41.3	177.7	-179.4	-103.9	0	0	0	112	L572 H573 E574 L579 L580	L572-Y576 WeakPolarHBondContact O-CB 3.32Å; L572-Y576 PolarHBondContact O-N 3.06Å; H573-Y576 PolarHBondContact O-N 3.21Å; E574-Y576 VanDerWaalsContact C-N 3.3Å; E574-Y576 PolarHBondContact O-N 3.26Å; Y576-L579 WeakPolarHBondContact O-CB 3.39Å; Y576-L579 PolarHBondContact O-N 3.3Å; Y576-L580 HydrophobicContact CD1-CD1 3.9Å; Y576-L580 HydrophobicContact CE1-CD1 3.38Å; Y576-L580 HydrophobicContact CE1-CG 4.12Å; Y576-L580 WeakPolarHBondContact O-CG 3.43Å; Y576-L580 PolarHBondContact O-N 3.36Å
577	H	68.7	Low	68.5	Low	87 Å²	87	90.7 Å²	90.7	40%	0.403	47%	0.466	S	S	.	.	H	α-helix	trans	-68.2	-36.2	175.1	-85.1	-62.3	0	0	0	113.3	H573 E574 L579 L580 T581	H573-H577 AromaticContact CE1-CD2 3.35Å; H573-H577 PolarHBondContact CE1-CD2 3.19Å; H573-H577 AromaticContact CE1-NE2 3.06Å; H573-H577 PolarHBondContact CE1-NE2 2.83Å; H573-H577 AromaticContact ND1-CD2 3.54Å; H573-H577 AromaticContact ND1-NE2 3.76Å; H573-H577 AromaticContact NE2-CD2 3.87Å; H573-H577 AromaticContact NE2-NE2 3.43Å; H573-H577 PolarHBondContact NE2-NE2 3.2Å; H573-H577 PolarHBondContact O-CD2 3.33Å; H573-H577 VanDerWaalsContact O-CD2 3.31Å; H573-H577 PolarHBondContact O-N 3.45Å; E574-H577 PolarHBondContact O-N 2.89Å; H577-L579 VanDerWaalsContact C-N 3.3Å; H577-L579 PolarHBondContact O-N 3.35Å; H577-L580 PolarHBondContact O-N 3.43Å; H577-T581 PolarHBondContact O-N 3.43Å; H577-T581 PolarHBondContact O-OG1 3.49Å
578	N	76.7	Confident	67.5	Low	88 Å²	88	92 Å²	92	47%	0.471	48%	0.477	S	S	.	.	H	α-helix	trans	-64	-37.9	173	-70.8	-20.7	0	0	0	110.9	E574 M575 T581 F582	E574-N578 WeakPolarHBondContact O-CB 3.23Å; E574-N578 VanDerWaalsContact O-CG 3.29Å; E574-N578 PolarHBondContact O-N 3.14Å; E574-N578 PolarHBondContact O-ND2 3.08Å; M575-N578 PolarHBondContact O-N 2.67Å; N578-T581 WeakPolarHBondContact CA-OG1 2.75Å; N578-T581 PolarHBondContact O-OG1 2.88Å; N578-T581 VanDerWaalsContact O-OG1 3.05Å; N578-F582 VanDerWaalsContact O-CB 3.25Å; N578-F582 WeakPolarHBondContact O-CB 3.5Å; N578-F582 PolarHBondContact O-N 2.82Å
579	L	66.8	Low	66.4	Low	49 Å²	49	90.6 Å²	90.6	26%	0.257	48%	0.475	S	S	.	.	H	α-helix	trans	-63.5	-45.7	173.4	-156.2	89.2	0	0	0	111.8	M575 Y576 H577 F582 Q583 I604	M575-L579 PolarHBondContact O-N 3.07Å; Y576-L579 WeakPolarHBondContact O-CB 3.39Å; Y576-L579 PolarHBondContact O-N 3.3Å; H577-L579 VanDerWaalsContact C-N 3.3Å; H577-L579 PolarHBondContact O-N 3.35Å; L579-F582 PolarHBondContact O-N 3.49Å; L579-Q583 WeakPolarHBondContact O-CB 3.48Å; L579-Q583 PolarHBondContact O-N 3.44Å; L579-I604 HydrophobicContact CD1-CB 4.46Å; L579-I604 HydrophobicContact CD1-CD1 4.04Å; L579-I604 HydrophobicContact CD1-CG2 3.74Å
580	L	65.6	Low	66.3	Low	66 Å²	66	93.2 Å²	93.2	35%	0.346	49%	0.49	S	S	.	.	H	α-helix	trans	-65.3	-41.3	179.4	-74.4	176.4	0	0	0	112.8	Y576 H577 Q583 A584	Y576-L580 HydrophobicContact CD1-CD1 3.9Å; Y576-L580 HydrophobicContact CE1-CD1 3.38Å; Y576-L580 HydrophobicContact CE1-CG 4.12Å; Y576-L580 WeakPolarHBondContact O-CG 3.43Å; Y576-L580 PolarHBondContact O-N 3.36Å; H577-L580 PolarHBondContact O-N 3.43Å; L580-Q583 PolarHBondContact O-N 2.95Å; L580-A584 PolarHBondContact O-N 3.3Å
581	T	71.6	Confident	65.8	Low	79 Å²	79	94.2 Å²	94.2	49%	0.485	50%	0.498	S	S	.	.	H	α-helix	trans	-69.1	-36.2	176.7	42.9	0	0	0	0	111.7	H577 N578 A584 N585	H577-T581 PolarHBondContact O-N 3.43Å; H577-T581 PolarHBondContact O-OG1 3.49Å; N578-T581 WeakPolarHBondContact CA-OG1 2.75Å; N578-T581 PolarHBondContact O-OG1 2.88Å; N578-T581 VanDerWaalsContact O-OG1 3.05Å; T581-A584 PolarHBondContact O-N 2.92Å; T581-N585 PolarHBondContact O-N 2.9Å; T581-N585 PolarHBondContact O-ND2 2.95Å
582	F	62.4	Low	65	Low	93 Å²	93	97.1 Å²	97.1	41%	0.408	51%	0.514	S	S	.	.	H	α-helix	trans	-64.8	-42.2	172	-178.9	-98	0	0	0	112.3	N578 L579 A584 N585 T586 V597	N578-F582 VanDerWaalsContact O-CB 3.25Å; N578-F582 WeakPolarHBondContact O-CB 3.5Å; N578-F582 PolarHBondContact O-N 2.82Å; L579-F582 PolarHBondContact O-N 3.49Å; F582-A584 VanDerWaalsContact C-N 3.29Å; F582-A584 PolarHBondContact O-N 3.02Å; F582-N585 PolarHBondContact O-N 2.86Å; F582-N585 VanDerWaalsContact O-N 3.14Å; F582-T586 HydrophobicContact CD1-CG2 4.33Å; F582-T586 HydrophobicContact CE1-CG2 3.76Å; F582-T586 HydrophobicContact CE2-CG2 4.17Å; F582-T586 HydrophobicContact CZ-CG2 3.67Å; F582-T586 PolarHBondContact O-N 3.43Å; F582-T586 VanDerWaalsContact O-N 3.08Å; F582-T586 PolarHBondContact O-OG1 2.69Å; F582-V597 HydrophobicContact CE1-CG1 3.61Å; F582-V597 HydrophobicContact CZ-CG1 4Å; F582-V597 HydrophobicContact CZ-CG2 4.26Å
583	Q	63.1	Low	64.3	Low	132 Å²	132	99.5 Å²	99.5	62%	0.617	52%	0.523	S	S	*	.	H	α-helix	trans	-61.6	-38	175	-167.9	179.3	13.6	0	0	111.8	L579 L580 N585 T586	L579-Q583 WeakPolarHBondContact O-CB 3.48Å; L579-Q583 PolarHBondContact O-N 3.44Å; L580-Q583 PolarHBondContact O-N 2.95Å; Q583-N585 VanDerWaalsContact C-N 3.35Å; Q583-T586 WeakPolarHBondContact CA-OG1 2.83Å; Q583-T586 PolarHBondContact O-N 3.1Å; Q583-T586 PolarHBondContact O-OG1 3.06Å; Q583-T586 VanDerWaalsContact O-OG1 3.09Å
584	A	70.5	Confident	63.8	Low	65 Å²	65	97.6 Å²	97.6	54%	0.537	52%	0.517	S	S	.	.	H	α-helix	trans	-66.5	-35.9	174.8	0	0	0	0	0	112.4	L580 T581 F582 S587	L580-A584 PolarHBondContact O-N 3.3Å; T581-A584 PolarHBondContact O-N 2.92Å; F582-A584 VanDerWaalsContact C-N 3.29Å; F582-A584 PolarHBondContact O-N 3.02Å; A584-S587 PolarHBondContact O-OG 3.4Å
585	N	73.4	Confident	62.5	Low	125 Å²	125	95.2 Å²	95.2	67%	0.668	52%	0.516	S	S	*	.	H	α-helix	trans	-79.2	-15.8	-179.8	-72.1	-21.3	0	0	0	114.1	T581 F582 Q583	T581-N585 PolarHBondContact O-N 2.9Å; T581-N585 PolarHBondContact O-ND2 2.95Å; F582-N585 PolarHBondContact O-N 2.86Å; F582-N585 VanDerWaalsContact O-N 3.14Å; Q583-N585 VanDerWaalsContact C-N 3.35Å
586	T	59.1	Low	61.3	Low	25 Å²	25	97 Å²	97	15%	0.153	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-5.5	-177.4	32.8	0	0	0	0	113.9	F582 Q583 D588 K589	F582-T586 HydrophobicContact CD1-CG2 4.33Å; F582-T586 HydrophobicContact CE1-CG2 3.76Å; F582-T586 HydrophobicContact CE2-CG2 4.17Å; F582-T586 HydrophobicContact CZ-CG2 3.67Å; F582-T586 PolarHBondContact O-N 3.43Å; F582-T586 VanDerWaalsContact O-N 3.08Å; F582-T586 PolarHBondContact O-OG1 2.69Å; Q583-T586 WeakPolarHBondContact CA-OG1 2.83Å; Q583-T586 PolarHBondContact O-N 3.1Å; Q583-T586 PolarHBondContact O-OG1 3.06Å; Q583-T586 VanDerWaalsContact O-OG1 3.09Å; T586-D588 PolarHBondContact O-N 3.37Å; T586-D588 VanDerWaalsContact O-N 3.09Å; T586-K589 PolarHBondContact O-N 3.02Å
587	S	58.7	Low	60.8	Low	95 Å²	95	92.3 Å²	92.3	66%	0.664	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-18.6	-178.8	68	0	0	0	0	114.6	A584	A584-S587 PolarHBondContact O-OG 3.4Å
588	D	58.3	Low	60.2	Low	150 Å²	150	93.9 Å²	93.9	80%	0.802	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	10.4	-172.6	-76.9	-0.5	0	0	0	114.7	T586	T586-D588 PolarHBondContact O-N 3.37Å; T586-D588 VanDerWaalsContact O-N 3.09Å
589	K	50.6	Low	59.1	Low	127 Å²	127	95.6 Å²	95.6	55%	0.552	53%	0.527	S	S	*	.	S	Bend	trans	-108.4	144.8	-175.5	-61	-151.1	-174.4	-178.8	0	114.7	T586 E593	T586-K589 PolarHBondContact O-N 3.02Å; K589-E593 WeakPolarHBondContact CD-OE2 3.45Å; K589-E593 IonicContact NZ-OE2 3.66Å
590	N	55.9	Low	58.7	Low	140 Å²	140	97.9 Å²	97.9	75%	0.749	54%	0.54	S	S	*	.			trans	-59.3	148.3	-173.7	-91.6	-23.7	0	0	0	113.3	D592 E593 L594	N590-D592 VanDerWaalsContact C-N 3.25Å; N590-D592 PolarHBondContact O-N 2.92Å; N590-D592 VanDerWaalsContact O-N 3.08Å; N590-E593 PolarHBondContact O-N 3.43Å; N590-L594 PolarHBondContact O-N 2.91Å
591	A	60.2	Low	58.3	Low	75 Å²	75	97.1 Å²	97.1	62%	0.62	54%	0.536	S	S	*	.	H	α-helix	trans	-55.5	-30	-169.6	0	0	0	0	0	115.6	L594 A595	A591-L594 VanDerWaalsContact O-CB 3.32Å; A591-L594 WeakPolarHBondContact O-CB 3.25Å; A591-L594 PolarHBondContact O-N 3.42Å; A591-A595 PolarHBondContact O-N 3.3Å
592	D	57.7	Low	57.9	Low	145 Å²	145	100.1 Å²	100.1	78%	0.775	55%	0.546	S	S	*	.	H	α-helix	trans	-73.2	-29.8	178.8	-67.1	-24.1	0	0	0	112.4	N590	N590-D592 VanDerWaalsContact C-N 3.25Å; N590-D592 PolarHBondContact O-N 2.92Å; N590-D592 VanDerWaalsContact O-N 3.08Å
593	E	52.9	Low	58.2	Low	108 Å²	108	101.9 Å²	101.9	51%	0.505	56%	0.556	S	S	.	*	H	α-helix	trans	-72.3	-33.5	170.5	-68.7	-172.5	177.2	0	0	110.9	K589 N590 A595 L596 V597	K589-E593 WeakPolarHBondContact CD-OE2 3.45Å; K589-E593 IonicContact NZ-OE2 3.66Å; N590-E593 PolarHBondContact O-N 3.43Å; E593-A595 VanDerWaalsContact C-N 3.28Å; E593-A595 PolarHBondContact O-N 2.99Å; E593-L596 PolarHBondContact O-N 2.88Å; E593-V597 WeakPolarHBondContact O-CG2 3.49Å; E593-V597 PolarHBondContact O-N 3.12Å; E593-V597 VanDerWaalsContact O-N 3.09Å
594	L	50.9	Low	58.5	Low	71 Å²	71	98.6 Å²	98.6	37%	0.372	54%	0.542	S	S	.	.	H	α-helix	trans	-61.7	-33.2	179.9	-145.9	88.6	0	0	0	113	N590 A591 V597 H598	N590-L594 PolarHBondContact O-N 2.91Å; A591-L594 VanDerWaalsContact O-CB 3.32Å; A591-L594 WeakPolarHBondContact O-CB 3.25Å; A591-L594 PolarHBondContact O-N 3.42Å; L594-V597 PolarHBondContact O-N 2.89Å; L594-H598 PolarHBondContact O-N 2.8Å
595	A	51.7	Low	58	Low	63 Å²	63	98.6 Å²	98.6	52%	0.521	54%	0.537	S	S	.	.	H	α-helix	trans	-68.7	-35.2	178.4	0	0	0	0	0	112.7	A591 E593	A591-A595 PolarHBondContact O-N 3.3Å; E593-A595 VanDerWaalsContact C-N 3.28Å; E593-A595 PolarHBondContact O-N 2.99Å
596	L	48.6	Very low	57.9	Low	125 Å²	125	98.4 Å²	98.4	65%	0.654	53%	0.534	S	S	*	.	H	α-helix	trans	-73	-35.5	172.9	-98.1	144.3	0	0	0	111.6	E593 L599	E593-L596 PolarHBondContact O-N 2.88Å; L596-L599 PolarHBondContact O-N 2.76Å
597	V	53.2	Low	58.6	Low	31 Å²	31	101.7 Å²	101.7	19%	0.188	55%	0.55	C	S	.	*	H	α-helix	trans	-63.9	-41.7	174.3	176.8	0	0	0	0	111.8	F582 E593 L594 L599 N600 D601	F582-V597 HydrophobicContact CE1-CG1 3.61Å; F582-V597 HydrophobicContact CZ-CG1 4Å; F582-V597 HydrophobicContact CZ-CG2 4.26Å; E593-V597 WeakPolarHBondContact O-CG2 3.49Å; E593-V597 PolarHBondContact O-N 3.12Å; E593-V597 VanDerWaalsContact O-N 3.09Å; L594-V597 PolarHBondContact O-N 2.89Å; V597-L599 PolarHBondContact O-N 3.5Å; V597-N600 PolarHBondContact O-N 2.97Å; V597-N600 VanDerWaalsContact O-N 3.08Å; V597-D601 PolarHBondContact O-N 3.13Å
598	H	55.7	Low	59.2	Low	120 Å²	120	99.9 Å²	99.9	56%	0.556	53%	0.532	S	S	*	.	H	α-helix	trans	-61.2	-28.6	-179.5	-96.6	-54.8	0	0	0	114.5	L594 M602	L594-H598 PolarHBondContact O-N 2.8Å; H598-M602 PolarHBondContact O-N 3.2Å
599	L	54.4	Low	59.4	Low	123 Å²	123	97.9 Å²	97.9	64%	0.644	52%	0.52	S	S	*	.	H	α-helix	trans	-71.1	-41.4	174.8	-83.4	159.6	0	0	0	111.5	L596 V597 D601 M602 E603	L596-L599 PolarHBondContact O-N 2.76Å; V597-L599 PolarHBondContact O-N 3.5Å; L599-D601 VanDerWaalsContact C-N 3.35Å; L599-M602 PolarHBondContact O-N 2.59Å; L599-E603 PolarHBondContact O-N 3.1Å
600	N	58.9	Low	60.6	Low	97 Å²	97	95.3 Å²	95.3	52%	0.519	52%	0.518	S	S	.	.	H	α-helix	trans	-66.7	-35.7	175.4	-72.6	-3.5	0	0	0	112.1	V597 M602 E603 I604	V597-N600 PolarHBondContact O-N 2.97Å; V597-N600 VanDerWaalsContact O-N 3.08Å; N600-M602 VanDerWaalsContact C-N 3.27Å; N600-M602 PolarHBondContact O-N 3.18Å; N600-E603 PolarHBondContact O-N 2.83Å; N600-I604 WeakPolarHBondContact O-CG1 3.5Å; N600-I604 PolarHBondContact O-N 3.28Å; N600-I604 VanDerWaalsContact O-N 3.09Å
601	D	57.7	Low	61.6	Low	51 Å²	51	91.9 Å²	91.9	27%	0.273	50%	0.499	S	S	.	.	H	α-helix	trans	-61.3	-36.1	176.1	-76.7	-19.5	0	0	0	112.4	V597 L599 C605	V597-D601 PolarHBondContact O-N 3.13Å; L599-D601 VanDerWaalsContact C-N 3.35Å; D601-C605 WeakPolarHBondContact O-CB 3.42Å; D601-C605 PolarHBondContact O-N 3.22Å; D601-C605 PolarHBondContact O-SG 3.48Å
602	M	61.6	Low	62.2	Low	141 Å²	141	95 Å²	95	70%	0.695	50%	0.499	S	S	*	.	H	α-helix	trans	-69.7	-39	-179.4	-139.3	-171.4	-162.6	0	0	111.4	H598 L599 N600 C605 M606	H598-M602 PolarHBondContact O-N 3.2Å; L599-M602 PolarHBondContact O-N 2.59Å; N600-M602 VanDerWaalsContact C-N 3.27Å; N600-M602 PolarHBondContact O-N 3.18Å; M602-C605 PolarHBondContact O-N 2.94Å; M602-M606 WeakPolarHBondContact O-CB 3.41Å; M602-M606 VanDerWaalsContact O-CG 3.24Å; M602-M606 WeakPolarHBondContact O-CG 3.43Å; M602-M606 PolarHBondContact O-N 3.03Å
603	E	68.4	Low	62.7	Low	130 Å²	130	93.3 Å²	93.3	61%	0.607	49%	0.489	S	S	*	.	H	α-helix	trans	-65.8	-44.8	176.8	-156.1	168.3	-155.8	0	0	110.8	L599 N600 C605 M606 D607	L599-E603 PolarHBondContact O-N 3.1Å; N600-E603 PolarHBondContact O-N 2.83Å; E603-C605 PolarHBondContact O-N 3.45Å; E603-M606 PolarHBondContact O-N 3.06Å; E603-D607 PolarHBondContact O-N 3.46Å
604	I	69.2	Low	63.9	Low	64 Å²	64	90.2 Å²	90.2	33%	0.328	48%	0.482	S	S	.	.	H	α-helix	trans	-63.6	-41.5	175.8	-61.4	164.7	0	0	0	111.6	L579 N600 M606 D607 I608	L579-I604 HydrophobicContact CD1-CB 4.46Å; L579-I604 HydrophobicContact CD1-CD1 4.04Å; L579-I604 HydrophobicContact CD1-CG2 3.74Å; N600-I604 WeakPolarHBondContact O-CG1 3.5Å; N600-I604 PolarHBondContact O-N 3.28Å; N600-I604 VanDerWaalsContact O-N 3.09Å; I604-M606 VanDerWaalsContact C-N 3.32Å; I604-M606 PolarHBondContact O-N 3.23Å; I604-D607 PolarHBondContact O-N 2.93Å; I604-I608 HydrophobicContact CG2-CD1 3.88Å; I604-I608 HydrophobicContact CG2-CG1 4.39Å; I604-I608 VanDerWaalsContact O-CG1 3.32Å; I604-I608 WeakPolarHBondContact O-CG1 3.39Å; I604-I608 PolarHBondContact O-N 3.47Å
605	C	61.8	Low	65.1	Low	64 Å²	64	90.6 Å²	90.6	43%	0.432	48%	0.482	S	S	.	.	H	α-helix	trans	-63.7	-38.6	176.7	-73.4	0	0	0	0	112.2	D601 M602 E603 I608 M609	D601-C605 WeakPolarHBondContact O-CB 3.42Å; D601-C605 PolarHBondContact O-N 3.22Å; D601-C605 PolarHBondContact O-SG 3.48Å; M602-C605 PolarHBondContact O-N 2.94Å; E603-C605 PolarHBondContact O-N 3.45Å; C605-I608 PolarHBondContact O-N 3.34Å; C605-M609 WeakPolarHBondContact O-CB 3.13Å; C605-M609 PolarHBondContact O-N 3.45Å
606	M	69.8	Low	65.7	Low	122 Å²	122	92.2 Å²	92.2	60%	0.601	48%	0.482	S	S	*	.	H	α-helix	trans	-65.7	-40.5	175.6	-75.2	-67.7	-68	0	0	111.3	M602 E603 I604 M609 S610	M602-M606 WeakPolarHBondContact O-CB 3.41Å; M602-M606 VanDerWaalsContact O-CG 3.24Å; M602-M606 WeakPolarHBondContact O-CG 3.43Å; M602-M606 PolarHBondContact O-N 3.03Å; E603-M606 PolarHBondContact O-N 3.06Å; I604-M606 VanDerWaalsContact C-N 3.32Å; I604-M606 PolarHBondContact O-N 3.23Å; M606-M609 PolarHBondContact O-N 2.68Å; M606-S610 VanDerWaalsContact O-CB 3.27Å; M606-S610 WeakPolarHBondContact O-CB 3.02Å; M606-S610 PolarHBondContact O-N 3.42Å
607	D	74.2	Confident	67	Low	94 Å²	94	90.1 Å²	90.1	50%	0.503	48%	0.475	S	S	.	.	H	α-helix	trans	-65.8	-41.4	175.5	-80.1	-11.5	0	0	0	112.5	E603 I604 S610 N611	E603-D607 PolarHBondContact O-N 3.46Å; I604-D607 PolarHBondContact O-N 2.93Å; D607-S610 PolarHBondContact O-N 3.05Å; D607-N611 WeakPolarHBondContact O-CB 3.48Å; D607-N611 PolarHBondContact O-N 3.44Å; D607-N611 PolarHBondContact O-ND2 3.32Å
608	I	71.5	Confident	68.4	Low	56 Å²	56	93.7 Å²	93.7	29%	0.287	49%	0.493	S	S	.	.	H	α-helix	trans	-63.8	-43.8	175.3	-67.7	168	0	0	0	110.7	M575 I604 C605 K612	M575-I608 HydrophobicContact CE-CG1 4.3Å; I604-I608 HydrophobicContact CG2-CD1 3.88Å; I604-I608 HydrophobicContact CG2-CG1 4.39Å; I604-I608 VanDerWaalsContact O-CG1 3.32Å; I604-I608 WeakPolarHBondContact O-CG1 3.39Å; I604-I608 PolarHBondContact O-N 3.47Å; C605-I608 PolarHBondContact O-N 3.34Å; I608-K612 WeakPolarHBondContact O-CB 3.2Å; I608-K612 PolarHBondContact O-N 3.11Å
609	M	62.3	Low	69.5	Low	109 Å²	109	93.1 Å²	93.1	54%	0.537	49%	0.49	S	S	.	.	H	α-helix	trans	-64.1	-44.2	176.1	-94.5	-172.8	-82	0	0	111.8	C605 M606 N611 K612 I613	C605-M609 WeakPolarHBondContact O-CB 3.13Å; C605-M609 PolarHBondContact O-N 3.45Å; M606-M609 PolarHBondContact O-N 2.68Å; M609-N611 PolarHBondContact O-N 2.91Å; M609-K612 PolarHBondContact O-N 2.98Å; M609-I613 WeakPolarHBondContact O-CB 3.14Å; M609-I613 VanDerWaalsContact O-CG1 3.27Å; M609-I613 WeakPolarHBondContact O-CG1 3.5Å; M609-I613 PolarHBondContact O-N 2.97Å
610	S	75.1	Confident	70.2	Confident	73 Å²	73	91.8 Å²	91.8	51%	0.51	49%	0.487	S	S	.	.	H	α-helix	trans	-59.4	-46.9	177.3	-171.1	0	0	0	0	111.3	M606 D607 K612 I613 A614	M606-S610 VanDerWaalsContact O-CB 3.27Å; M606-S610 WeakPolarHBondContact O-CB 3.02Å; M606-S610 PolarHBondContact O-N 3.42Å; D607-S610 PolarHBondContact O-N 3.05Å; S610-K612 VanDerWaalsContact C-N 3.34Å; S610-K612 PolarHBondContact O-N 3.35Å; S610-I613 PolarHBondContact O-N 3Å; S610-A614 WeakPolarHBondContact O-CB 3.11Å; S610-A614 PolarHBondContact O-N 2.92Å
611	N	78.5	Confident	71.4	Confident	67 Å²	67	92.3 Å²	92.3	36%	0.358	49%	0.486	S	S	.	.	H	α-helix	trans	-62.7	-38.4	176.3	-78.9	-37	0	0	0	112.7	D607 M609 A614 M615	D607-N611 WeakPolarHBondContact O-CB 3.48Å; D607-N611 PolarHBondContact O-N 3.44Å; D607-N611 PolarHBondContact O-ND2 3.32Å; M609-N611 PolarHBondContact O-N 2.91Å; N611-A614 PolarHBondContact O-N 3.25Å; N611-M615 PolarHBondContact O-N 2.88Å
612	K	72.3	Confident	72.6	Confident	142 Å²	142	95 Å²	95	62%	0.617	50%	0.497	S	S	*	.	H	α-helix	trans	-71.7	-36.4	178.2	-164.3	153.9	-174.5	169.8	0	112.4	I608 M609 S610 M615 L616	I608-K612 WeakPolarHBondContact O-CB 3.2Å; I608-K612 PolarHBondContact O-N 3.11Å; M609-K612 PolarHBondContact O-N 2.98Å; S610-K612 VanDerWaalsContact C-N 3.34Å; S610-K612 PolarHBondContact O-N 3.35Å; K612-M615 PolarHBondContact O-N 3.45Å; K612-L616 WeakPolarHBondContact O-CG 3.5Å; K612-L616 PolarHBondContact O-N 3.45Å
613	I	67.6	Low	72.9	Confident	108 Å²	108	93 Å²	93	55%	0.554	49%	0.488	S	S	*	.	H	α-helix	trans	-64.7	-42.7	172.6	-70.1	167.3	0	0	0	110.2	M609 S610 L616 T617	M609-I613 WeakPolarHBondContact O-CB 3.14Å; M609-I613 VanDerWaalsContact O-CG1 3.27Å; M609-I613 WeakPolarHBondContact O-CG1 3.5Å; M609-I613 PolarHBondContact O-N 2.97Å; S610-I613 PolarHBondContact O-N 3Å; I613-L616 PolarHBondContact O-N 3.19Å; I613-T617 WeakPolarHBondContact O-CB 3.22Å; I613-T617 PolarHBondContact O-N 3Å; I613-T617 PolarHBondContact O-OG1 3.28Å
614	A	78.4	Confident	73.3	Confident	43 Å²	43	92 Å²	92	36%	0.355	48%	0.482	S	S	.	.	H	α-helix	trans	-60.4	-47.6	175.4	0	0	0	0	0	111.7	S610 N611 L616 T617 D618	S610-A614 WeakPolarHBondContact O-CB 3.11Å; S610-A614 PolarHBondContact O-N 2.92Å; N611-A614 PolarHBondContact O-N 3.25Å; A614-L616 PolarHBondContact O-N 3.05Å; A614-T617 PolarHBondContact O-N 3.39Å; A614-T617 VanDerWaalsContact O-N 3.17Å; A614-D618 PolarHBondContact O-N 2.98Å
615	M	76.5	Confident	74.1	Confident	79 Å²	79	95.9 Å²	95.9	39%	0.389	50%	0.496	S	S	.	.	H	α-helix	trans	-56.7	-47.4	175	-90.8	-173.3	58.8	0	0	113.1	L572 N611 K612 T617 D618 E619	L572-M615 HydrophobicContact CD1-SD 4.3Å; N611-M615 PolarHBondContact O-N 2.88Å; K612-M615 PolarHBondContact O-N 3.45Å; M615-T617 VanDerWaalsContact C-N 3.27Å; M615-T617 PolarHBondContact O-N 2.95Å; M615-D618 PolarHBondContact O-N 3.47Å; M615-E619 WeakPolarHBondContact O-CB 3.3Å; M615-E619 PolarHBondContact O-N 3.45Å
616	L	63.7	Low	74.9	Confident	97 Å²	97	100.2 Å²	100.2	51%	0.508	50%	0.504	S	S	.	.	H	α-helix	trans	-65.6	-33.8	179.5	-73.1	170.2	0	0	0	111.8	K612 I613 A614 V620	K612-L616 WeakPolarHBondContact O-CG 3.5Å; K612-L616 PolarHBondContact O-N 3.45Å; I613-L616 PolarHBondContact O-N 3.19Å; A614-L616 PolarHBondContact O-N 3.05Å; L616-V620 WeakPolarHBondContact O-CB 3.45Å; L616-V620 VanDerWaalsContact O-CG2 3.23Å; L616-V620 WeakPolarHBondContact O-CG2 3.35Å; L616-V620 PolarHBondContact O-N 3.23Å
617	T	75.6	Confident	74.6	Confident	82 Å²	82	98.4 Å²	98.4	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-68	-44.3	177	-54.6	0	0	0	0	111	I613 A614 M615 E619 V620 E621	I613-T617 WeakPolarHBondContact O-CB 3.22Å; I613-T617 PolarHBondContact O-N 3Å; I613-T617 PolarHBondContact O-OG1 3.28Å; A614-T617 PolarHBondContact O-N 3.39Å; A614-T617 VanDerWaalsContact O-N 3.17Å; M615-T617 VanDerWaalsContact C-N 3.27Å; M615-T617 PolarHBondContact O-N 2.95Å; T617-E619 VanDerWaalsContact C-N 3.34Å; T617-E619 PolarHBondContact O-N 2.88Å; T617-V620 PolarHBondContact O-N 3.4Å; T617-E621 PolarHBondContact O-N 2.93Å
618	D	83.4	Confident	74.9	Confident	106 Å²	106	99.4 Å²	99.4	57%	0.567	50%	0.498	S	S	*	.	H	α-helix	trans	-62.7	-39.9	175.9	-72	-14.8	0	0	0	111.8	A614 M615 E621 H622	A614-D618 PolarHBondContact O-N 2.98Å; M615-D618 PolarHBondContact O-N 3.47Å; D618-E621 PolarHBondContact O-N 2.99Å; D618-H622 WeakPolarHBondContact O-CB 3.48Å; D618-H622 PolarHBondContact O-N 3.48Å
619	E	79.3	Confident	75.4	Confident	108 Å²	108	101 Å²	101	51%	0.505	51%	0.507	S	S	.	.	H	α-helix	trans	-67.5	-40.2	177.6	-169.4	172.3	-169.6	0	0	112.2	M615 T617 H622 L623	M615-E619 WeakPolarHBondContact O-CB 3.3Å; M615-E619 PolarHBondContact O-N 3.45Å; T617-E619 VanDerWaalsContact C-N 3.34Å; T617-E619 PolarHBondContact O-N 2.88Å; E619-H622 PolarHBondContact O-N 3.21Å; E619-L623 HydrophobicContact CG-CD1 4.47Å; E619-L623 WeakPolarHBondContact O-CB 3.41Å; E619-L623 WeakPolarHBondContact O-CG 3.28Å; E619-L623 PolarHBondContact O-N 3.49Å
620	V	68.3	Low	75.5	Confident	94 Å²	94	99.9 Å²	99.9	57%	0.57	50%	0.503	S	S	*	.	H	α-helix	trans	-63.2	-44.1	175	168.2	0	0	0	0	111.2	L616 T617 H622 L623 K624	L616-V620 WeakPolarHBondContact O-CB 3.45Å; L616-V620 VanDerWaalsContact O-CG2 3.23Å; L616-V620 WeakPolarHBondContact O-CG2 3.35Å; L616-V620 PolarHBondContact O-N 3.23Å; T617-V620 PolarHBondContact O-N 3.4Å; V620-H622 VanDerWaalsContact C-N 3.35Å; V620-L623 PolarHBondContact O-N 3.5Å; V620-K624 WeakPolarHBondContact O-CB 3.45Å; V620-K624 PolarHBondContact O-N 2.88Å
621	E	83.4	Confident	75.1	Confident	108 Å²	108	103.2 Å²	103.2	51%	0.505	51%	0.505	S	S	.	.	H	α-helix	trans	-68.5	-35.9	178.9	-159.5	62.9	-158.5	0	0	111.5	T617 D618 K624 K625	T617-E621 PolarHBondContact O-N 2.93Å; D618-E621 PolarHBondContact O-N 2.99Å; E621-K624 PolarHBondContact O-N 2.94Å; E621-K624 IonicContact OE1-NZ 3.81Å; E621-K624 PolarHBondContact OE1-NZ 3.31Å; E621-K624 IonicContact OE2-NZ 3.25Å; E621-K625 PolarHBondContact O-N 3.45Å
622	H	83.5	Confident	74.9	Confident	108 Å²	108	103.1 Å²	103.1	50%	0.5	51%	0.509	S	S	.	.	H	α-helix	trans	-62.1	-46.2	172	176	-93.8	0	0	0	112.4	D618 E619 V620 K624 K625 R626	D618-H622 WeakPolarHBondContact O-CB 3.48Å; D618-H622 PolarHBondContact O-N 3.48Å; E619-H622 PolarHBondContact O-N 3.21Å; V620-H622 VanDerWaalsContact C-N 3.35Å; H622-K624 VanDerWaalsContact C-N 3.3Å; H622-K624 PolarHBondContact O-N 3.25Å; H622-K625 PolarHBondContact O-N 2.94Å; H622-R626 WeakPolarHBondContact O-CB 3.41Å; H622-R626 PolarHBondContact O-N 2.61Å
623	L	67.5	Low	74.8	Confident	98 Å²	98	103 Å²	103	51%	0.513	51%	0.508	S	S	.	.	H	α-helix	trans	-64.2	-36.6	177.2	-73.7	173.6	0	0	0	112.1	E619 V620 R626 N627	E619-L623 HydrophobicContact CG-CD1 4.47Å; E619-L623 WeakPolarHBondContact O-CB 3.41Å; E619-L623 WeakPolarHBondContact O-CG 3.28Å; E619-L623 PolarHBondContact O-N 3.49Å; V620-L623 PolarHBondContact O-N 3.5Å; L623-R626 PolarHBondContact O-N 3.32Å; L623-N627 WeakPolarHBondContact O-CB 3.31Å; L623-N627 PolarHBondContact O-N 2.91Å
624	K	77.1	Confident	74.4	Confident	110 Å²	110	102.8 Å²	102.8	48%	0.478	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-49	175	-173	-179	168.5	-158.1	0	111.4	V620 E621 H622 R626 N627 E628	V620-K624 WeakPolarHBondContact O-CB 3.45Å; V620-K624 PolarHBondContact O-N 2.88Å; E621-K624 PolarHBondContact O-N 2.94Å; E621-K624 IonicContact OE1-NZ 3.81Å; E621-K624 PolarHBondContact OE1-NZ 3.31Å; E621-K624 IonicContact OE2-NZ 3.25Å; H622-K624 VanDerWaalsContact C-N 3.3Å; H622-K624 PolarHBondContact O-N 3.25Å; K624-R626 VanDerWaalsContact C-N 3.35Å; K624-R626 PolarHBondContact O-N 2.99Å; K624-N627 WeakPolarHBondContact O-CB 3.48Å; K624-N627 PolarHBondContact O-N 3.08Å; K624-N627 VanDerWaalsContact O-N 3.14Å; K624-E628 PolarHBondContact O-N 3.49Å
625	K	87.5	Confident	74	Confident	145 Å²	145	108.5 Å²	108.5	63%	0.63	52%	0.522	S	S	*	.	H	α-helix	trans	-59.6	-42.9	175.5	-171.6	175.7	-179.3	178.7	0	112.3	E621 H622 N627 E628 D629	E621-K625 PolarHBondContact O-N 3.45Å; H622-K625 PolarHBondContact O-N 2.94Å; K625-N627 VanDerWaalsContact C-N 3.3Å; K625-N627 PolarHBondContact O-N 2.78Å; K625-E628 WeakPolarHBondContact O-CB 3.36Å; K625-E628 PolarHBondContact O-N 3.05Å; K625-D629 PolarHBondContact O-N 2.88Å
626	R	76.8	Confident	73.7	Confident	155 Å²	155	113.6 Å²	113.6	59%	0.585	54%	0.537	S	S	*	.	H	α-helix	trans	-62.2	-36.8	176	-174.2	176.1	178.8	129.6	-2.4	112.5	H622 L623 K624 L630	H622-R626 WeakPolarHBondContact O-CB 3.41Å; H622-R626 PolarHBondContact O-N 2.61Å; L623-R626 PolarHBondContact O-N 3.32Å; K624-R626 VanDerWaalsContact C-N 3.35Å; K624-R626 PolarHBondContact O-N 2.99Å; R626-L630 HydrophobicContact CG-CD1 4.43Å; R626-L630 VanDerWaalsContact O-CG 3.32Å; R626-L630 WeakPolarHBondContact O-CG 3.44Å; R626-L630 PolarHBondContact O-N 3.22Å
627	N	64.9	Low	73.4	Confident	85 Å²	85	112.5 Å²	112.5	46%	0.455	54%	0.535	S	S	.	.	H	α-helix	trans	-69.2	-38.7	176.7	-160.9	-6.1	0	0	0	111.5	L623 K624 K625 L630 R631	L623-N627 WeakPolarHBondContact O-CB 3.31Å; L623-N627 PolarHBondContact O-N 2.91Å; K624-N627 WeakPolarHBondContact O-CB 3.48Å; K624-N627 PolarHBondContact O-N 3.08Å; K624-N627 VanDerWaalsContact O-N 3.14Å; K625-N627 VanDerWaalsContact C-N 3.3Å; K625-N627 PolarHBondContact O-N 2.78Å; N627-L630 PolarHBondContact O-N 3.11Å; N627-R631 WeakPolarHBondContact O-CG 3.5Å; N627-R631 PolarHBondContact O-N 2.96Å
628	E	80.7	Confident	72.3	Confident	115 Å²	115	113.7 Å²	113.7	54%	0.537	54%	0.536	S	S	.	.	H	α-helix	trans	-60	-46.6	172.5	-136.9	106.8	-135.3	0	0	111.6	K624 K625 L630 R631 S632	K624-E628 PolarHBondContact O-N 3.49Å; K625-E628 WeakPolarHBondContact O-CB 3.36Å; K625-E628 PolarHBondContact O-N 3.05Å; E628-L630 PolarHBondContact O-N 3.42Å; E628-R631 PolarHBondContact O-N 3.32Å; E628-S632 PolarHBondContact O-N 3.13Å
629	D	81.2	Confident	71.7	Confident	88 Å²	88	112.9 Å²	112.9	47%	0.471	53%	0.531	S	S	.	.	H	α-helix	trans	-63.4	-39.3	177.2	-79.3	-10.4	0	0	0	112.4	K625 S632 K633	K625-D629 PolarHBondContact O-N 2.88Å; D629-S632 PolarHBondContact O-N 3.31Å; D629-K633 WeakPolarHBondContact O-CG 3.4Å; D629-K633 PolarHBondContact O-N 3.2Å
630	L	63.9	Low	70.9	Confident	87 Å²	87	112.7 Å²	112.7	46%	0.455	53%	0.533	S	S	.	.	H	α-helix	trans	-66	-39	175.2	-75.6	170.7	0	0	0	111.9	R626 N627 E628 K633 N634	R626-L630 HydrophobicContact CG-CD1 4.43Å; R626-L630 VanDerWaalsContact O-CG 3.32Å; R626-L630 WeakPolarHBondContact O-CG 3.44Å; R626-L630 PolarHBondContact O-N 3.22Å; N627-L630 PolarHBondContact O-N 3.11Å; E628-L630 PolarHBondContact O-N 3.42Å; L630-K633 PolarHBondContact O-N 3Å; L630-N634 WeakPolarHBondContact O-CB 3.3Å; L630-N634 PolarHBondContact O-N 3.01Å
631	R	66.2	Low	70.1	Confident	143 Å²	143	113 Å²	113	54%	0.54	53%	0.531	S	S	.	.	H	α-helix	trans	-63.3	-45.6	173.6	-75.2	177.7	177.3	-175.3	-2.9	111.5	N627 E628 K633 N634 Y635	N627-R631 WeakPolarHBondContact O-CG 3.5Å; N627-R631 PolarHBondContact O-N 2.96Å; E628-R631 PolarHBondContact O-N 3.32Å; R631-K633 PolarHBondContact O-N 2.98Å; R631-N634 PolarHBondContact O-N 3.24Å; R631-Y635 HydrophobicContact CB-CE2 4.33Å; R631-Y635 WeakPolarHBondContact O-CD2 3.41Å; R631-Y635 PolarHBondContact O-N 3.49Å
632	S	76.3	Confident	69	Low	65 Å²	65	115.2 Å²	115.2	46%	0.455	54%	0.535	S	S	.	.	H	α-helix	trans	-59.2	-44.2	176.4	179.5	0	0	0	0	112.4	E628 D629 N634 Y635 R636	E628-S632 PolarHBondContact O-N 3.13Å; D629-S632 PolarHBondContact O-N 3.31Å; S632-N634 PolarHBondContact O-N 3.09Å; S632-Y635 PolarHBondContact O-N 2.77Å; S632-R636 PolarHBondContact O-N 3.46Å; S632-R636 VanDerWaalsContact O-N 3.09Å
633	K	70.1	Confident	68.4	Low	138 Å²	138	114.3 Å²	114.3	60%	0.6	53%	0.531	S	S	*	.	H	α-helix	trans	-63.4	-39.7	174.6	-73.9	176.6	-178.7	178.8	0	112.6	D629 L630 R631 R636 T637	D629-K633 WeakPolarHBondContact O-CG 3.4Å; D629-K633 PolarHBondContact O-N 3.2Å; L630-K633 PolarHBondContact O-N 3Å; R631-K633 PolarHBondContact O-N 2.98Å; K633-R636 PolarHBondContact O-N 3.16Å; K633-T637 PolarHBondContact O-N 2.99Å; K633-T637 PolarHBondContact O-OG1 3.48Å
634	N	58.3	Low	67.9	Low	104 Å²	104	114 Å²	114	56%	0.556	53%	0.533	S	S	*	.	H	α-helix	trans	-64.2	-41.9	175.6	-77.3	-6.7	0	0	0	111.8	L630 R631 S632 T637 M638	L630-N634 WeakPolarHBondContact O-CB 3.3Å; L630-N634 PolarHBondContact O-N 3.01Å; R631-N634 PolarHBondContact O-N 3.24Å; S632-N634 PolarHBondContact O-N 3.09Å; N634-T637 PolarHBondContact O-N 3.48Å; N634-M638 WeakPolarHBondContact O-CG 3.43Å; N634-M638 PolarHBondContact O-N 2.95Å
635	Y	70	Confident	66.8	Low	163 Å²	163	114.8 Å²	114.8	64%	0.639	54%	0.538	S	S	*	.	H	α-helix	trans	-62.6	-46.1	176.1	-71.8	-59.1	0	0	0	112.3	R631 S632 T637 M638 D639	R631-Y635 HydrophobicContact CB-CE2 4.33Å; R631-Y635 WeakPolarHBondContact O-CD2 3.41Å; R631-Y635 PolarHBondContact O-N 3.49Å; S632-Y635 PolarHBondContact O-N 2.77Å; Y635-T637 VanDerWaalsContact C-N 3.27Å; Y635-T637 PolarHBondContact O-N 3.33Å; Y635-M638 PolarHBondContact O-N 3.49Å; Y635-M638 VanDerWaalsContact O-N 3.13Å; Y635-D639 PolarHBondContact O-N 3.17Å
636	R	70.7	Confident	65.8	Low	186 Å²	186	111 Å²	111	70%	0.702	53%	0.53	S	S	*	.	H	α-helix	trans	-58.8	-37.7	173.7	-83	-173.6	177.8	-176.9	-0.3	113.1	S632 K633 D639 L640	S632-R636 PolarHBondContact O-N 3.46Å; S632-R636 VanDerWaalsContact O-N 3.09Å; K633-R636 PolarHBondContact O-N 3.16Å; R636-D639 PolarHBondContact O-N 2.94Å; R636-L640 WeakPolarHBondContact O-CG 3.39Å; R636-L640 PolarHBondContact O-N 3.21Å
637	T	57.2	Low	65.2	Low	75 Å²	75	111.5 Å²	111.5	46%	0.46	53%	0.532	S	S	.	.	H	α-helix	trans	-66.6	-40.5	177.5	-53.2	0	0	0	0	110.9	K633 N634 Y635 D639 L640 L641	K633-T637 PolarHBondContact O-N 2.99Å; K633-T637 PolarHBondContact O-OG1 3.48Å; N634-T637 PolarHBondContact O-N 3.48Å; Y635-T637 VanDerWaalsContact C-N 3.27Å; Y635-T637 PolarHBondContact O-N 3.33Å; T637-D639 VanDerWaalsContact C-N 3.35Å; T637-L640 PolarHBondContact O-N 3.31Å; T637-L641 HydrophobicContact CG2-CD1 4.49Å; T637-L641 WeakPolarHBondContact O-CG 3.38Å; T637-L641 PolarHBondContact O-N 2.91Å
638	M	51.9	Low	64.4	Low	107 Å²	107	110.5 Å²	110.5	53%	0.527	52%	0.524	S	S	.	.	H	α-helix	trans	-66.5	-34.5	176.1	-70.1	-61	-64	0	0	112.9	N634 Y635 L641 R642	N634-M638 WeakPolarHBondContact O-CG 3.43Å; N634-M638 PolarHBondContact O-N 2.95Å; Y635-M638 PolarHBondContact O-N 3.49Å; Y635-M638 VanDerWaalsContact O-N 3.13Å; M638-L641 PolarHBondContact O-N 3.01Å; M638-L641 HydrophobicContact SD-CD1 4.14Å; M638-R642 PolarHBondContact O-N 3.29Å
639	D	70.6	Confident	63.5	Low	88 Å²	88	108.3 Å²	108.3	47%	0.471	52%	0.518	S	S	.	.	H	α-helix	trans	-71.1	-40.1	176.1	-66.3	-22	0	0	0	111.6	Y635 R636 T637 L641 R642 E643	Y635-D639 PolarHBondContact O-N 3.17Å; R636-D639 PolarHBondContact O-N 2.94Å; T637-D639 VanDerWaalsContact C-N 3.35Å; D639-L641 VanDerWaalsContact C-N 3.32Å; D639-L641 PolarHBondContact O-N 3.42Å; D639-R642 PolarHBondContact O-N 3.47Å; D639-R642 IonicContact OD1-CZ 3.78Å; D639-R642 IonicContact OD1-NH2 2.65Å; D639-R642 PolarHBondContact OD1-NH2 2.98Å; D639-R642 VanDerWaalsContact OD1-NH2 3.11Å; D639-E643 PolarHBondContact O-N 3.04Å
640	L	63.3	Low	63.1	Low	104 Å²	104	108.9 Å²	108.9	55%	0.545	52%	0.521	S	S	.	.	H	α-helix	trans	-61.8	-38.5	171.7	-76.4	167.8	0	0	0	112.4	R636 T637 E643 T644	R636-L640 WeakPolarHBondContact O-CG 3.39Å; R636-L640 PolarHBondContact O-N 3.21Å; T637-L640 PolarHBondContact O-N 3.31Å; L640-E643 PolarHBondContact O-N 3.48Å; L640-T644 WeakPolarHBondContact O-CB 3.35Å; L640-T644 PolarHBondContact O-N 2.89Å; L640-T644 PolarHBondContact O-OG1 3.49Å
641	L	51.7	Low	63.5	Low	100 Å²	100	109.9 Å²	109.9	52%	0.524	52%	0.519	S	S	.	.	H	α-helix	trans	-64.1	-42.1	174.8	-74.5	171.2	0	0	0	111.4	T637 M638 D639 T644 E645	T637-L641 HydrophobicContact CG2-CD1 4.49Å; T637-L641 WeakPolarHBondContact O-CG 3.38Å; T637-L641 PolarHBondContact O-N 2.91Å; M638-L641 PolarHBondContact O-N 3.01Å; M638-L641 HydrophobicContact SD-CD1 4.14Å; D639-L641 VanDerWaalsContact C-N 3.32Å; D639-L641 PolarHBondContact O-N 3.42Å; L641-T644 PolarHBondContact O-N 3.24Å; L641-E645 WeakPolarHBondContact O-CB 3.32Å; L641-E645 PolarHBondContact O-N 3.11Å
642	R	60.6	Low	63.1	Low	155 Å²	155	104.8 Å²	104.8	59%	0.585	51%	0.507	S	S	*	.	H	α-helix	trans	-65.3	-40.3	175.5	-103.5	-175.7	-73	-179.5	3.9	113.2	M638 D639 T644 E645 S646	M638-R642 PolarHBondContact O-N 3.29Å; D639-R642 PolarHBondContact O-N 3.47Å; D639-R642 IonicContact OD1-CZ 3.78Å; D639-R642 IonicContact OD1-NH2 2.65Å; D639-R642 PolarHBondContact OD1-NH2 2.98Å; D639-R642 VanDerWaalsContact OD1-NH2 3.11Å; R642-T644 VanDerWaalsContact C-N 3.33Å; R642-E645 PolarHBondContact O-N 2.85Å; R642-S646 PolarHBondContact O-N 3.31Å
643	E	70.3	Confident	63	Low	90 Å²	90	105.8 Å²	105.8	42%	0.421	51%	0.508	S	S	.	.	H	α-helix	trans	-64	-40.6	174	-172.5	-175.6	164.7	0	0	111.4	D639 L640 S646 R647	D639-E643 PolarHBondContact O-N 3.04Å; L640-E643 PolarHBondContact O-N 3.48Å; E643-S646 PolarHBondContact O-N 3.41Å; E643-R647 WeakPolarHBondContact O-CG 3.38Å; E643-R647 PolarHBondContact O-N 3.4Å; E643-R647 IonicContact OE1-CZ 3.05Å; E643-R647 VanDerWaalsContact OE1-CZ 3.25Å; E643-R647 IonicContact OE1-NE 3.23Å; E643-R647 IonicContact OE1-NH1 3.86Å; E643-R647 IonicContact OE1-NH2 2.66Å; E643-R647 PolarHBondContact OE1-NH2 3.35Å
644	T	56.7	Low	63.3	Low	91 Å²	91	104.4 Å²	104.4	56%	0.558	50%	0.503	S	S	*	.	H	α-helix	trans	-65.3	-41.3	177.1	-53.3	0	0	0	0	111.3	L640 L641 R642 R647 F648	L640-T644 WeakPolarHBondContact O-CB 3.35Å; L640-T644 PolarHBondContact O-N 2.89Å; L640-T644 PolarHBondContact O-OG1 3.49Å; L641-T644 PolarHBondContact O-N 3.24Å; R642-T644 VanDerWaalsContact C-N 3.33Å; T644-R647 PolarHBondContact O-N 2.93Å; T644-F648 WeakPolarHBondContact O-CB 3.06Å; T644-F648 PolarHBondContact O-N 3.46Å
645	E	54	Low	63.4	Low	126 Å²	126	101.9 Å²	101.9	59%	0.589	49%	0.493	S	S	*	.	H	α-helix	trans	-60.3	-46.7	173.9	-175.4	177.8	-168.2	0	0	111.5	L641 R642 R647 F648 V649	L641-E645 WeakPolarHBondContact O-CB 3.32Å; L641-E645 PolarHBondContact O-N 3.11Å; R642-E645 PolarHBondContact O-N 2.85Å; E645-R647 PolarHBondContact O-N 3.36Å; E645-F648 WeakPolarHBondContact O-CB 2.95Å; E645-F648 PolarHBondContact O-N 2.88Å; E645-F648 VanDerWaalsContact O-N 3.16Å; E645-V649 WeakPolarHBondContact O-CG2 3.32Å; E645-V649 PolarHBondContact O-N 3.42Å
646	S	66.9	Low	63.5	Low	65 Å²	65	100.3 Å²	100.3	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-58.7	-47.6	176.6	-172.2	0	0	0	0	112.3	R642 E643 F648 V649 D650	R642-S646 PolarHBondContact O-N 3.31Å; E643-S646 PolarHBondContact O-N 3.41Å; S646-F648 PolarHBondContact O-N 3.34Å; S646-V649 PolarHBondContact O-N 3.47Å; S646-D650 PolarHBondContact O-N 3.21Å
647	R	64.8	Low	64	Low	167 Å²	167	97.3 Å²	97.3	63%	0.63	49%	0.486	S	S	*	.	H	α-helix	trans	-64.1	-31.6	177.9	-71.8	-175.7	-179.2	172.6	6.8	112.7	E643 T644 E645 W651	E643-R647 WeakPolarHBondContact O-CG 3.38Å; E643-R647 PolarHBondContact O-N 3.4Å; E643-R647 IonicContact OE1-CZ 3.05Å; E643-R647 VanDerWaalsContact OE1-CZ 3.25Å; E643-R647 IonicContact OE1-NE 3.23Å; E643-R647 IonicContact OE1-NH1 3.86Å; E643-R647 IonicContact OE1-NH2 2.66Å; E643-R647 PolarHBondContact OE1-NH2 3.35Å; T644-R647 PolarHBondContact O-N 2.93Å; E645-R647 PolarHBondContact O-N 3.36Å; R647-W651 WeakPolarHBondContact O-CB 3.47Å; R647-W651 PolarHBondContact O-N 3.22Å
648	F	47.5	Very low	64.8	Low	63 Å²	63	96.5 Å²	96.5	28%	0.276	48%	0.481	S	S	.	.	H	α-helix	trans	-69.3	-42.4	176.3	-172.6	-97	0	0	0	111.5	T644 E645 S646 W651 A652 A755	T644-F648 WeakPolarHBondContact O-CB 3.06Å; T644-F648 PolarHBondContact O-N 3.46Å; E645-F648 WeakPolarHBondContact O-CB 2.95Å; E645-F648 PolarHBondContact O-N 2.88Å; E645-F648 VanDerWaalsContact O-N 3.16Å; S646-F648 PolarHBondContact O-N 3.34Å; F648-W651 HydrophobicContact CD2-CE3 4.34Å; F648-W651 HydrophobicContact CE2-CE3 4.06Å; F648-W651 HydrophobicContact CE2-CZ3 4.06Å; F648-W651 HydrophobicContact CZ-CZ3 4.44Å; F648-W651 PolarHBondContact O-N 2.86Å; F648-A652 WeakPolarHBondContact O-CB 3.32Å; F648-A652 PolarHBondContact O-N 3.2Å; F648-A755 HydrophobicContact CE2-CB 4.25Å; F648-A755 VanDerWaalsContact CE2-O 3.25Å; F648-A755 WeakPolarHBondContact CE2-O 3.47Å; F648-A755 WeakPolarHBondContact CZ-O 3.39Å
649	V	61.5	Low	66.1	Low	70 Å²	70	97.6 Å²	97.6	42%	0.424	48%	0.48	S	S	.	.	H	α-helix	trans	-61	-45.7	174.4	172.7	0	0	0	0	110.9	E645 S646 W651 A652 N653	E645-V649 WeakPolarHBondContact O-CG2 3.32Å; E645-V649 PolarHBondContact O-N 3.42Å; S646-V649 PolarHBondContact O-N 3.47Å; V649-W651 VanDerWaalsContact C-N 3.31Å; V649-W651 PolarHBondContact O-N 2.9Å; V649-A652 PolarHBondContact O-N 3.46Å; V649-N653 WeakPolarHBondContact O-CB 3.34Å; V649-N653 PolarHBondContact O-N 3.42Å; V649-N653 PolarHBondContact O-ND2 3.23Å
650	D	72.1	Confident	66.7	Low	100 Å²	100	96.9 Å²	96.9	54%	0.535	47%	0.473	S	S	.	.	H	α-helix	trans	-60.6	-40.4	177.1	-67	-25.5	0	0	0	112.1	S646 H654	S646-D650 PolarHBondContact O-N 3.21Å; D650-H654 PolarHBondContact O-N 2.98Å; D650-H654 VanDerWaalsContact O-N 3.08Å
651	W	72.6	Confident	67.8	Low	107 Å²	107	96.1 Å²	96.1	41%	0.405	47%	0.47	S	S	.	.	H	α-helix	trans	-69.2	-42.5	176.9	177.9	75.8	0	0	0	112.9	R647 F648 V649 N653 H654 C655 C756	R647-W651 WeakPolarHBondContact O-CB 3.47Å; R647-W651 PolarHBondContact O-N 3.22Å; F648-W651 HydrophobicContact CD2-CE3 4.34Å; F648-W651 HydrophobicContact CE2-CE3 4.06Å; F648-W651 HydrophobicContact CE2-CZ3 4.06Å; F648-W651 HydrophobicContact CZ-CZ3 4.44Å; F648-W651 PolarHBondContact O-N 2.86Å; V649-W651 VanDerWaalsContact C-N 3.31Å; V649-W651 PolarHBondContact O-N 2.9Å; W651-N653 VanDerWaalsContact C-N 3.32Å; W651-N653 PolarHBondContact O-N 2.95Å; W651-H654 WeakPolarHBondContact O-CB 3.07Å; W651-H654 PolarHBondContact O-N 3.46Å; W651-C655 VanDerWaalsContact CZ2-SG 3.51Å; W651-C655 PolarHBondContact O-N 3.38Å; W651-C756 HydrophobicContact CH2-CB 4.01Å
652	A	58.1	Low	69.1	Low	36 Å²	36	95.9 Å²	95.9	30%	0.298	47%	0.469	S	S	.	.	H	α-helix	trans	-60.1	-44.6	176.7	0	0	0	0	0	111.1	F648 V649 H654 C655 E656	F648-A652 WeakPolarHBondContact O-CB 3.32Å; F648-A652 PolarHBondContact O-N 3.2Å; V649-A652 PolarHBondContact O-N 3.46Å; A652-H654 VanDerWaalsContact C-N 3.32Å; A652-H654 PolarHBondContact O-N 3.46Å; A652-C655 PolarHBondContact O-N 2.97Å; A652-E656 PolarHBondContact O-N 3Å
653	N	74.1	Confident	70.1	Confident	87 Å²	87	93.4 Å²	93.4	47%	0.465	46%	0.463	S	S	.	.	H	α-helix	trans	-60.2	-41.9	174.9	-67.5	-22.6	0	0	0	111.5	V649 W651 E656 E657	V649-N653 WeakPolarHBondContact O-CB 3.34Å; V649-N653 PolarHBondContact O-N 3.42Å; V649-N653 PolarHBondContact O-ND2 3.23Å; W651-N653 VanDerWaalsContact C-N 3.32Å; W651-N653 PolarHBondContact O-N 2.95Å; N653-E656 PolarHBondContact O-N 2.77Å; N653-E657 WeakPolarHBondContact O-CB 3.44Å; N653-E657 PolarHBondContact O-N 2.82Å
654	H	76	Confident	70.9	Confident	109 Å²	109	93.5 Å²	93.5	51%	0.505	46%	0.463	S	S	.	.	H	α-helix	trans	-63.8	-41.8	175.7	179.8	63.7	0	0	0	112.6	D650 W651 A652 E657 T658	D650-H654 PolarHBondContact O-N 2.98Å; D650-H654 VanDerWaalsContact O-N 3.08Å; W651-H654 WeakPolarHBondContact O-CB 3.07Å; W651-H654 PolarHBondContact O-N 3.46Å; A652-H654 VanDerWaalsContact C-N 3.32Å; A652-H654 PolarHBondContact O-N 3.46Å; H654-E657 PolarHBondContact O-N 2.89Å; H654-T658 WeakPolarHBondContact O-CB 3.42Å; H654-T658 PolarHBondContact O-N 3.15Å; H654-T658 PolarHBondContact O-OG1 3.03Å
655	C	61.1	Low	72.3	Confident	50 Å²	50	92.8 Å²	92.8	34%	0.338	45%	0.454	S	S	.	.	H	α-helix	trans	-64.7	-40.7	176.5	-76.1	0	0	0	0	112.4	W651 A652 T658 Y659	W651-C655 VanDerWaalsContact CZ2-SG 3.51Å; W651-C655 PolarHBondContact O-N 3.38Å; A652-C655 PolarHBondContact O-N 2.97Å; C655-T658 PolarHBondContact O-N 3.01Å; C655-Y659 WeakPolarHBondContact O-CB 2.86Å; C655-Y659 PolarHBondContact O-N 3.47Å
656	E	72.7	Confident	73.4	Confident	131 Å²	131	90.1 Å²	90.1	61%	0.612	44%	0.443	S	S	*	.	H	α-helix	trans	-62.9	-45	175.5	-172.3	171.8	-165.7	0	0	111.3	A652 N653 T658 Y659 E660	A652-E656 PolarHBondContact O-N 3Å; N653-E656 PolarHBondContact O-N 2.77Å; E656-T658 VanDerWaalsContact C-N 3.34Å; E656-T658 PolarHBondContact O-N 3.12Å; E656-Y659 PolarHBondContact O-N 3.33Å; E656-E660 PolarHBondContact O-N 3.4Å
657	E	80.2	Confident	74	Confident	123 Å²	123	93.9 Å²	93.9	58%	0.575	45%	0.451	S	S	*	.	H	α-helix	trans	-61.1	-42.2	175.3	-171	179.2	-170.3	0	0	111.9	N653 H654 N661	N653-E657 WeakPolarHBondContact O-CB 3.44Å; N653-E657 PolarHBondContact O-N 2.82Å; H654-E657 PolarHBondContact O-N 2.89Å; E657-N661 WeakPolarHBondContact O-CB 3.15Å; E657-N661 PolarHBondContact O-N 3.44Å; E657-N661 PolarHBondContact O-ND2 3.05Å; E657-N661 VanDerWaalsContact O-ND2 3.12Å
658	T	74.4	Confident	74.8	Confident	58 Å²	58	92.7 Å²	92.7	36%	0.356	45%	0.447	S	S	.	.	H	α-helix	trans	-66.1	-42.1	178.3	-46	0	0	0	0	111.4	H654 C655 E656 N661 D662	H654-T658 WeakPolarHBondContact O-CB 3.42Å; H654-T658 PolarHBondContact O-N 3.15Å; H654-T658 PolarHBondContact O-OG1 3.03Å; C655-T658 PolarHBondContact O-N 3.01Å; E656-T658 VanDerWaalsContact C-N 3.34Å; E656-T658 PolarHBondContact O-N 3.12Å; T658-N661 PolarHBondContact O-N 3.01Å; T658-D662 PolarHBondContact O-N 3.09Å
659	Y	78.3	Confident	76.5	Confident	130 Å²	130	96.4 Å²	96.4	51%	0.51	46%	0.459	S	S	.	.	H	α-helix	trans	-63.4	-45.5	177.8	174.5	-98.2	0	0	0	112.1	C655 E656 N661 D662 K663	C655-Y659 WeakPolarHBondContact O-CB 2.86Å; C655-Y659 PolarHBondContact O-N 3.47Å; E656-Y659 PolarHBondContact O-N 3.33Å; Y659-N661 VanDerWaalsContact C-N 3.31Å; Y659-N661 PolarHBondContact O-N 2.88Å; Y659-D662 PolarHBondContact O-N 2.9Å; Y659-K663 HydrophobicContact CE1-CD 4.1Å; Y659-K663 VanDerWaalsContact O-CB 3.29Å; Y659-K663 WeakPolarHBondContact O-CB 3.05Å; Y659-K663 PolarHBondContact O-N 3.47Å
660	E	84	Confident	77	Confident	72 Å²	72	95.9 Å²	95.9	34%	0.336	46%	0.456	S	S	.	.	H	α-helix	trans	-66	-34.8	176.9	-78.6	-62.7	144.4	0	0	111.8	E656 K663 Q664	E656-E660 PolarHBondContact O-N 3.4Å; E660-K663 PolarHBondContact O-N 2.94Å; E660-K663 IonicContact OE1-NZ 3.57Å; E660-K663 PolarHBondContact OE1-NZ 3.34Å; E660-K663 IonicContact OE2-NZ 2.67Å; E660-Q664 WeakPolarHBondContact O-CG 3.43Å; E660-Q664 PolarHBondContact O-N 2.89Å
661	N	85.3	Confident	77	Confident	88 Å²	88	92.9 Å²	92.9	47%	0.471	44%	0.441	S	S	.	.	H	α-helix	trans	-63.5	-46.8	172.4	-76	-30.2	0	0	0	112.4	E657 T658 Y659 K663 Q664 E665	E657-N661 WeakPolarHBondContact O-CB 3.15Å; E657-N661 PolarHBondContact O-N 3.44Å; E657-N661 PolarHBondContact O-ND2 3.05Å; E657-N661 VanDerWaalsContact O-ND2 3.12Å; T658-N661 PolarHBondContact O-N 3.01Å; Y659-N661 VanDerWaalsContact C-N 3.31Å; Y659-N661 PolarHBondContact O-N 2.88Å; N661-K663 VanDerWaalsContact C-N 3.34Å; N661-K663 PolarHBondContact O-N 3.24Å; N661-Q664 PolarHBondContact O-N 3.29Å; N661-E665 WeakPolarHBondContact O-CB 3.01Å; N661-E665 PolarHBondContact O-N 3.39Å
662	D	79.8	Confident	77.4	Confident	95 Å²	95	92.5 Å²	92.5	51%	0.508	45%	0.447	S	S	.	.	H	α-helix	trans	-64.5	-38.5	177.7	-86.6	-6.3	0	0	0	112.3	T658 Y659 E665 N666	T658-D662 PolarHBondContact O-N 3.09Å; Y659-D662 PolarHBondContact O-N 2.9Å; D662-E665 PolarHBondContact O-N 3.12Å; D662-N666 WeakPolarHBondContact O-CB 3.03Å; D662-N666 PolarHBondContact O-N 3.06Å; D662-N666 PolarHBondContact O-ND2 3.42Å
663	K	82.6	Confident	78.3	Confident	103 Å²	103	95.8 Å²	95.8	45%	0.448	46%	0.459	S	S	.	.	H	α-helix	trans	-63.1	-41.8	174.1	-178.1	177.6	169	-168	0	111.3	Y659 E660 N661 K667	Y659-K663 HydrophobicContact CE1-CD 4.1Å; Y659-K663 VanDerWaalsContact O-CB 3.29Å; Y659-K663 WeakPolarHBondContact O-CB 3.05Å; Y659-K663 PolarHBondContact O-N 3.47Å; E660-K663 PolarHBondContact O-N 2.94Å; E660-K663 IonicContact OE1-NZ 3.57Å; E660-K663 PolarHBondContact OE1-NZ 3.34Å; E660-K663 IonicContact OE2-NZ 2.67Å; N661-K663 VanDerWaalsContact C-N 3.34Å; N661-K663 PolarHBondContact O-N 3.24Å; K663-K667 WeakPolarHBondContact O-CB 3.19Å; K663-K667 PolarHBondContact O-N 2.97Å
664	Q	85.2	Confident	78.2	Confident	93 Å²	93	92.3 Å²	92.3	44%	0.435	44%	0.44	S	S	.	.	H	α-helix	trans	-67	-42.9	174.4	-74.1	-167.1	25.2	0	0	112.6	E660 N661 K667 R668	E660-Q664 WeakPolarHBondContact O-CG 3.43Å; E660-Q664 PolarHBondContact O-N 2.89Å; N661-Q664 PolarHBondContact O-N 3.29Å; Q664-K667 PolarHBondContact O-N 2.89Å; Q664-R668 WeakPolarHBondContact O-CG 3.14Å; Q664-R668 PolarHBondContact O-N 2.99Å
665	E	86.2	Confident	78.2	Confident	76 Å²	76	93 Å²	93	36%	0.355	44%	0.441	S	S	.	.	H	α-helix	trans	-59	-48.3	175.6	178.3	77.2	-166.6	0	0	110.9	N661 D662 K667 R668 R669	N661-E665 WeakPolarHBondContact O-CB 3.01Å; N661-E665 PolarHBondContact O-N 3.39Å; D662-E665 PolarHBondContact O-N 3.12Å; E665-K667 PolarHBondContact O-N 2.86Å; E665-R668 WeakPolarHBondContact O-CB 3.42Å; E665-R668 PolarHBondContact O-N 3.31Å; E665-R669 WeakPolarHBondContact O-CG 3.35Å; E665-R669 PolarHBondContact O-N 3.42Å; E665-R669 IonicContact OE1-CZ 3.97Å; E665-R669 IonicContact OE1-NE 3.15Å; E665-R669 PolarHBondContact OE1-NE 3.33Å; E665-R669 IonicContact OE1-NH2 3.87Å; E665-R669 PolarHBondContact OE1-NH2 3.04Å
666	N	77.4	Confident	78.9	Confident	70 Å²	70	94.8 Å²	94.8	37%	0.374	46%	0.46	S	S	.	.	H	α-helix	trans	-63.7	-42	177.5	-77.7	-30.8	0	0	0	112	D662 R668 R669 V670	D662-N666 WeakPolarHBondContact O-CB 3.03Å; D662-N666 PolarHBondContact O-N 3.06Å; D662-N666 PolarHBondContact O-ND2 3.42Å; N666-R668 VanDerWaalsContact C-N 3.31Å; N666-R668 PolarHBondContact O-N 3.49Å; N666-R669 PolarHBondContact O-N 3.36Å; N666-V670 WeakPolarHBondContact O-CG2 3.12Å; N666-V670 PolarHBondContact O-N 3Å
667	K	79.8	Confident	78.9	Confident	143 Å²	143	93.1 Å²	93.1	62%	0.622	46%	0.458	S	S	*	.	H	α-helix	trans	-59.9	-41.5	174.1	-171.9	179	179.4	-175	0	111.5	K663 Q664 E665 T671	K663-K667 WeakPolarHBondContact O-CB 3.19Å; K663-K667 PolarHBondContact O-N 2.97Å; Q664-K667 PolarHBondContact O-N 2.89Å; E665-K667 PolarHBondContact O-N 2.86Å; K667-T671 WeakPolarHBondContact O-CB 3.48Å; K667-T671 PolarHBondContact O-N 3.49Å; K667-T671 PolarHBondContact O-OG1 2.9Å
668	R	82.5	Confident	78.7	Confident	142 Å²	142	90.8 Å²	90.8	54%	0.536	45%	0.446	S	S	.	.	H	α-helix	trans	-63.8	-44.5	174.5	-71.4	174.7	-165.5	163.9	6.7	111.4	Q664 E665 N666 T671 N672	Q664-R668 WeakPolarHBondContact O-CG 3.14Å; Q664-R668 PolarHBondContact O-N 2.99Å; E665-R668 WeakPolarHBondContact O-CB 3.42Å; E665-R668 PolarHBondContact O-N 3.31Å; N666-R668 VanDerWaalsContact C-N 3.31Å; N666-R668 PolarHBondContact O-N 3.49Å; R668-T671 PolarHBondContact O-N 3.05Å; R668-N672 WeakPolarHBondContact O-CB 3.5Å; R668-N672 PolarHBondContact O-N 2.94Å; R668-N672 PolarHBondContact O-ND2 2.92Å
669	R	81.6	Confident	78.1	Confident	141 Å²	141	90.6 Å²	90.6	53%	0.532	46%	0.456	S	S	.	.	H	α-helix	trans	-60.7	-49.2	177.4	-74	179.4	-175.8	-169.7	3.2	112.3	E665 N666 T671 N672 I673	E665-R669 WeakPolarHBondContact O-CG 3.35Å; E665-R669 PolarHBondContact O-N 3.42Å; E665-R669 IonicContact OE1-CZ 3.97Å; E665-R669 IonicContact OE1-NE 3.15Å; E665-R669 PolarHBondContact OE1-NE 3.33Å; E665-R669 IonicContact OE1-NH2 3.87Å; E665-R669 PolarHBondContact OE1-NH2 3.04Å; N666-R669 PolarHBondContact O-N 3.36Å; R669-T671 VanDerWaalsContact C-N 3.32Å; R669-T671 PolarHBondContact O-N 3.04Å; R669-N672 PolarHBondContact O-N 3.4Å; R669-I673 VanDerWaalsContact O-CG1 3.32Å; R669-I673 WeakPolarHBondContact O-CG1 3.39Å; R669-I673 PolarHBondContact O-N 3.02Å
670	V	71.9	Confident	77.3	Confident	59 Å²	59	92 Å²	92	36%	0.358	47%	0.473	S	S	.	.	H	α-helix	trans	-60.9	-44.1	177.5	173.3	0	0	0	0	110.5	N666 N672 I673 I674 V695	N666-V670 WeakPolarHBondContact O-CG2 3.12Å; N666-V670 PolarHBondContact O-N 3Å; V670-N672 VanDerWaalsContact C-N 3.32Å; V670-N672 PolarHBondContact O-N 3.32Å; V670-I673 PolarHBondContact O-N 3.23Å; V670-I674 HydrophobicContact CG1-CD1 3.82Å; V670-I674 HydrophobicContact CG1-CG1 4.42Å; V670-I674 VanDerWaalsContact O-CG1 3.3Å; V670-I674 WeakPolarHBondContact O-CG1 3.38Å; V670-I674 PolarHBondContact O-N 3Å; V670-V695 HydrophobicContact CG1-CG1 4.37Å
671	T	72.7	Confident	76.2	Confident	38 Å²	38	99.5 Å²	99.5	23%	0.233	50%	0.497	C	S	.	.	H	α-helix	trans	-61.3	-40.9	176.8	-53.7	0	0	0	0	111.7	K667 R668 R669 I674 K675	K667-T671 WeakPolarHBondContact O-CB 3.48Å; K667-T671 PolarHBondContact O-N 3.49Å; K667-T671 PolarHBondContact O-OG1 2.9Å; R668-T671 PolarHBondContact O-N 3.05Å; R669-T671 VanDerWaalsContact C-N 3.32Å; R669-T671 PolarHBondContact O-N 3.04Å; T671-I674 PolarHBondContact O-N 3.31Å; T671-K675 HydrophobicContact CG2-CD 4.43Å; T671-K675 WeakPolarHBondContact O-CB 3.34Å; T671-K675 WeakPolarHBondContact O-CG 3.19Å; T671-K675 PolarHBondContact O-N 3.4Å
672	N	80.7	Confident	74.9	Confident	99 Å²	99	97.6 Å²	97.6	53%	0.529	49%	0.491	S	S	.	.	H	α-helix	trans	-68.3	-38.9	177.6	-71.9	-15.1	0	0	0	112.3	R668 R669 V670 K675 A676	R668-N672 WeakPolarHBondContact O-CB 3.5Å; R668-N672 PolarHBondContact O-N 2.94Å; R668-N672 PolarHBondContact O-ND2 2.92Å; R669-N672 PolarHBondContact O-N 3.4Å; V670-N672 VanDerWaalsContact C-N 3.32Å; V670-N672 PolarHBondContact O-N 3.32Å; N672-K675 PolarHBondContact O-N 3.42Å; N672-A676 VanDerWaalsContact O-CB 3.32Å; N672-A676 WeakPolarHBondContact O-CB 3.28Å; N672-A676 PolarHBondContact O-N 2.96Å
673	I	78.2	Confident	74.2	Confident	105 Å²	105	101 Å²	101	54%	0.538	51%	0.509	S	S	.	.	H	α-helix	trans	-63.9	-46.3	174.5	-68.3	165.8	0	0	0	110	R669 V670 K675 A676 V677	R669-I673 VanDerWaalsContact O-CG1 3.32Å; R669-I673 WeakPolarHBondContact O-CG1 3.39Å; R669-I673 PolarHBondContact O-N 3.02Å; V670-I673 PolarHBondContact O-N 3.23Å; I673-K675 VanDerWaalsContact C-N 3.34Å; I673-K675 PolarHBondContact O-N 3.45Å; I673-A676 PolarHBondContact O-N 3.01Å; I673-A676 VanDerWaalsContact O-N 3.15Å; I673-V677 HydrophobicContact CG2-CG2 4.2Å; I673-V677 WeakPolarHBondContact O-CB 3.42Å; I673-V677 VanDerWaalsContact O-CG2 3.27Å; I673-V677 WeakPolarHBondContact O-CG2 3.4Å; I673-V677 PolarHBondContact O-N 3.46Å
674	I	72	Confident	73.8	Confident	13 Å²	13	97.2 Å²	97.2	7%	0.067	50%	0.499	C	S	.	.	H	α-helix	trans	-59.8	-45.9	176.7	-68.2	169.9	0	0	0	110.1	V670 T671 A676 V677 F678 L688 L692 V695	V670-I674 HydrophobicContact CG1-CD1 3.82Å; V670-I674 HydrophobicContact CG1-CG1 4.42Å; V670-I674 VanDerWaalsContact O-CG1 3.3Å; V670-I674 WeakPolarHBondContact O-CG1 3.38Å; V670-I674 PolarHBondContact O-N 3Å; T671-I674 PolarHBondContact O-N 3.31Å; I674-A676 VanDerWaalsContact C-N 3.34Å; I674-A676 PolarHBondContact O-N 3.14Å; I674-V677 PolarHBondContact O-N 2.99Å; I674-F678 HydrophobicContact CG2-CD2 3.98Å; I674-F678 WeakPolarHBondContact O-CB 3.31Å; I674-F678 WeakPolarHBondContact O-CD2 3.49Å; I674-F678 PolarHBondContact O-N 2.92Å; I674-L688 HydrophobicContact CG2-CD1 4.01Å; I674-L692 HydrophobicContact CD1-CD2 3.77Å; I674-L692 HydrophobicContact CD1-CG 4.2Å; I674-V695 HydrophobicContact CD1-CG1 4.33Å
675	K	75.8	Confident	73.2	Confident	124 Å²	124	100.9 Å²	100.9	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-61.4	-39.3	175	-75.2	178.9	178.4	-176.9	0	112.5	T671 N672 I673 G679	T671-K675 HydrophobicContact CG2-CD 4.43Å; T671-K675 WeakPolarHBondContact O-CB 3.34Å; T671-K675 WeakPolarHBondContact O-CG 3.19Å; T671-K675 PolarHBondContact O-N 3.4Å; N672-K675 PolarHBondContact O-N 3.42Å; I673-K675 VanDerWaalsContact C-N 3.34Å; I673-K675 PolarHBondContact O-N 3.45Å; K675-G679 WeakPolarHBondContact O-CA 3.44Å; K675-G679 PolarHBondContact O-N 3.06Å
676	A	75.8	Confident	72.8	Confident	87 Å²	87	103.4 Å²	103.4	72%	0.719	53%	0.528	S	S	*	.	H	α-helix	trans	-68.9	-38.4	178.7	0	0	0	0	0	112.5	N672 I673 I674	N672-A676 VanDerWaalsContact O-CB 3.32Å; N672-A676 WeakPolarHBondContact O-CB 3.28Å; N672-A676 PolarHBondContact O-N 2.96Å; I673-A676 PolarHBondContact O-N 3.01Å; I673-A676 VanDerWaalsContact O-N 3.15Å; I674-A676 VanDerWaalsContact C-N 3.34Å; I674-A676 PolarHBondContact O-N 3.14Å
677	V	72.8	Confident	72.6	Confident	96 Å²	96	104.7 Å²	104.7	58%	0.582	54%	0.535	S	S	*	.	H	α-helix	trans	-76.9	-39.7	-178.8	175.2	0	0	0	0	111.4	I673 I674	I673-V677 HydrophobicContact CG2-CG2 4.2Å; I673-V677 WeakPolarHBondContact O-CB 3.42Å; I673-V677 VanDerWaalsContact O-CG2 3.27Å; I673-V677 WeakPolarHBondContact O-CG2 3.4Å; I673-V677 PolarHBondContact O-N 3.46Å; I674-V677 PolarHBondContact O-N 2.99Å
678	F	75.7	Confident	72.2	Confident	75 Å²	75	99.9 Å²	99.9	33%	0.329	52%	0.516	S	S	.	.	H	α-helix	trans	-111.5	-13.2	-169.2	-63.2	-76.6	0	0	0	115	I674 N680 R681 C682 L688 L691	I674-F678 HydrophobicContact CG2-CD2 3.98Å; I674-F678 WeakPolarHBondContact O-CB 3.31Å; I674-F678 WeakPolarHBondContact O-CD2 3.49Å; I674-F678 PolarHBondContact O-N 2.92Å; F678-N680 PolarHBondContact O-N 3.31Å; F678-R681 PolarHBondContact O-N 3.41Å; F678-C682 PolarHBondContact O-N 3.38Å; F678-L688 HydrophobicContact CB-CD1 4.35Å; F678-L691 HydrophobicContact CD1-CD2 4.29Å; F678-L691 HydrophobicContact CD2-CD2 3.84Å; F678-L691 HydrophobicContact CE1-CD2 4.11Å; F678-L691 HydrophobicContact CE2-CD2 3.64Å; F678-L691 HydrophobicContact CG-CD2 4.17Å; F678-L691 HydrophobicContact CZ-CD2 3.79Å
679	G	61.3	Low	71.9	Confident	54 Å²	54	96.5 Å²	96.5	56%	0.557	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-12.6	-165.2	0	0	0	0	0	117	K675	K675-G679 WeakPolarHBondContact O-CA 3.44Å; K675-G679 PolarHBondContact O-N 3.06Å
680	N	61.4	Low	71.7	Confident	160 Å²	160	95.3 Å²	95.3	86%	0.856	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	-4	173.6	-80	-6.7	0	0	0	114.7	F678	F678-N680 PolarHBondContact O-N 3.31Å
681	R	61.4	Low	71.8	Confident	228 Å²	228	95.1 Å²	95.1	86%	0.86	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.5	-17.3	-176.5	-69	-167.8	-169	-170.9	5	114.8	F678 N683	F678-R681 PolarHBondContact O-N 3.41Å; R681-N683 PolarHBondContact O-N 3.05Å
682	C	59	Low	72	Confident	48 Å²	48	95.8 Å²	95.8	32%	0.324	51%	0.508	S	S	.	.			trans	-92.9	93.1	177.3	-65.5	0	0	0	0	110.2	F678 G684	F678-C682 PolarHBondContact O-N 3.38Å; C682-G684 PolarHBondContact O-N 3.29Å
683	N	63.8	Low	71.9	Confident	168 Å²	168	95.8 Å²	95.8	90%	0.898	51%	0.508	S	S	*	.			trans	-77.8	3	178.5	-72	-18.6	0	0	0	113.9	R681	R681-N683 PolarHBondContact O-N 3.05Å
684	G	74.7	Confident	71.9	Confident	23 Å²	23	97.7 Å²	97.7	24%	0.237	51%	0.51	C	S	.	.			trans	-121.1	118.8	174.7	0	0	0	0	0	111.2	C682 E686 D687 L688	C682-G684 PolarHBondContact O-N 3.29Å; G684-E686 PolarHBondContact O-N 3.21Å; G684-D687 PolarHBondContact O-N 3.34Å; G684-D687 VanDerWaalsContact O-N 3.08Å; G684-L688 PolarHBondContact O-N 2.94Å
685	E	72.5	Confident	72	Confident	170 Å²	170	99.6 Å²	99.6	79%	0.794	52%	0.522	S	S	*	.	H	α-helix	trans	-56.4	-29.4	172.4	-165.6	171.7	-161.2	0	0	111.5	T689	E685-T689 WeakPolarHBondContact O-CB 3.38Å; E685-T689 PolarHBondContact O-N 3.39Å; E685-T689 PolarHBondContact O-OG1 2.98Å
686	E	76.9	Confident	72.1	Confident	128 Å²	128	99.3 Å²	99.3	60%	0.598	52%	0.52	S	S	*	.	H	α-helix	trans	-66.5	-40.9	176.2	-153.2	-171.6	146.2	0	0	112.8	G684 T689 K690	G684-E686 PolarHBondContact O-N 3.21Å; E686-T689 PolarHBondContact O-N 3.36Å; E686-K690 WeakPolarHBondContact O-CG 3.46Å; E686-K690 PolarHBondContact O-N 3.46Å; E686-K690 WeakPolarHBondContact OE1-CE 3.12Å; E686-K690 IonicContact OE1-NZ 2.67Å; E686-K690 PolarHBondContact OE1-NZ 3.2Å
687	D	73.9	Confident	72.3	Confident	97 Å²	97	101.8 Å²	101.8	52%	0.519	52%	0.515	S	S	.	.	H	α-helix	trans	-70.3	-38.4	179.4	-71.7	-25.1	0	0	0	111.3	G684 T689 K690 L691	G684-D687 PolarHBondContact O-N 3.34Å; G684-D687 VanDerWaalsContact O-N 3.08Å; D687-T689 VanDerWaalsContact C-N 3.3Å; D687-T689 PolarHBondContact O-N 3.49Å; D687-K690 PolarHBondContact O-N 3.48Å; D687-L691 WeakPolarHBondContact O-CB 3.34Å; D687-L691 PolarHBondContact O-N 3.16Å
688	L	71.8	Confident	72.3	Confident	43 Å²	43	101.3 Å²	101.3	23%	0.225	51%	0.506	C	S	.	.	H	α-helix	trans	-63.3	-40.6	174.4	-167.2	74.2	0	0	0	110.8	I674 F678 G684 L691 L692	I674-L688 HydrophobicContact CG2-CD1 4.01Å; F678-L688 HydrophobicContact CB-CD1 4.35Å; G684-L688 PolarHBondContact O-N 2.94Å; L688-L691 PolarHBondContact O-N 3.17Å; L688-L692 HydrophobicContact CD2-CD1 4.5Å; L688-L692 HydrophobicContact CG-CD1 4.11Å; L688-L692 WeakPolarHBondContact O-CB 3.44Å; L688-L692 PolarHBondContact O-N 3.34Å
689	T	76.5	Confident	72	Confident	70 Å²	70	103.8 Å²	103.8	43%	0.429	51%	0.514	S	S	.	.	H	α-helix	trans	-66.7	-41.7	178.1	-55.6	0	0	0	0	111.6	E685 E686 D687 L692 N693	E685-T689 WeakPolarHBondContact O-CB 3.38Å; E685-T689 PolarHBondContact O-N 3.39Å; E685-T689 PolarHBondContact O-OG1 2.98Å; E686-T689 PolarHBondContact O-N 3.36Å; D687-T689 VanDerWaalsContact C-N 3.3Å; D687-T689 PolarHBondContact O-N 3.49Å; T689-L692 PolarHBondContact O-N 3.18Å; T689-N693 WeakPolarHBondContact O-CB 3.23Å; T689-N693 VanDerWaalsContact O-CG 3.32Å; T689-N693 PolarHBondContact O-N 3.15Å; T689-N693 PolarHBondContact O-ND2 2.97Å
690	K	76.9	Confident	72.7	Confident	116 Å²	116	104.8 Å²	104.8	50%	0.504	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-44	174.4	-75.4	171.7	-173.3	158.6	0	111.7	E686 D687 N693 Y694	E686-K690 WeakPolarHBondContact O-CG 3.46Å; E686-K690 PolarHBondContact O-N 3.46Å; E686-K690 WeakPolarHBondContact OE1-CE 3.12Å; E686-K690 IonicContact OE1-NZ 2.67Å; E686-K690 PolarHBondContact OE1-NZ 3.2Å; D687-K690 PolarHBondContact O-N 3.48Å; K690-N693 PolarHBondContact O-N 3.39Å; K690-Y694 WeakPolarHBondContact O-CB 3.42Å; K690-Y694 PolarHBondContact O-N 3.49Å
691	L	74.6	Confident	73.3	Confident	55 Å²	55	100 Å²	100	29%	0.288	48%	0.482	S	S	.	.	H	α-helix	trans	-64.7	-44.7	177	-171.6	71.1	0	0	0	111.8	F678 D687 L688 N693 Y694 V695	F678-L691 HydrophobicContact CD1-CD2 4.29Å; F678-L691 HydrophobicContact CD2-CD2 3.84Å; F678-L691 HydrophobicContact CE1-CD2 4.11Å; F678-L691 HydrophobicContact CE2-CD2 3.64Å; F678-L691 HydrophobicContact CG-CD2 4.17Å; F678-L691 HydrophobicContact CZ-CD2 3.79Å; D687-L691 WeakPolarHBondContact O-CB 3.34Å; D687-L691 PolarHBondContact O-N 3.16Å; L688-L691 PolarHBondContact O-N 3.17Å; L691-N693 VanDerWaalsContact C-N 3.34Å; L691-N693 PolarHBondContact O-N 3.25Å; L691-Y694 PolarHBondContact O-N 3.17Å; L691-V695 WeakPolarHBondContact O-CG2 3.3Å; L691-V695 PolarHBondContact O-N 3.43Å
692	L	75.9	Confident	73.4	Confident	53 Å²	53	93.4 Å²	93.4	28%	0.277	46%	0.46	S	S	.	.	H	α-helix	trans	-59.5	-43.2	175.8	-94.3	153.3	0	0	0	112	I674 L688 T689 Y694 V695 K696	I674-L692 HydrophobicContact CD1-CD2 3.77Å; I674-L692 HydrophobicContact CD1-CG 4.2Å; L688-L692 HydrophobicContact CD2-CD1 4.5Å; L688-L692 HydrophobicContact CG-CD1 4.11Å; L688-L692 WeakPolarHBondContact O-CB 3.44Å; L688-L692 PolarHBondContact O-N 3.34Å; T689-L692 PolarHBondContact O-N 3.18Å; L692-Y694 VanDerWaalsContact C-N 3.35Å; L692-V695 PolarHBondContact O-N 3.41Å; L692-K696 WeakPolarHBondContact O-CB 3.34Å; L692-K696 PolarHBondContact O-N 3.02Å
693	N	80	Confident	73.6	Confident	99 Å²	99	93.7 Å²	93.7	53%	0.529	46%	0.459	S	S	.	.	H	α-helix	trans	-66.2	-37.6	176.9	-75.2	-22.9	0	0	0	112.2	T689 K690 L691 K697	T689-N693 WeakPolarHBondContact O-CB 3.23Å; T689-N693 VanDerWaalsContact O-CG 3.32Å; T689-N693 PolarHBondContact O-N 3.15Å; T689-N693 PolarHBondContact O-ND2 2.97Å; K690-N693 PolarHBondContact O-N 3.39Å; L691-N693 VanDerWaalsContact C-N 3.34Å; L691-N693 PolarHBondContact O-N 3.25Å; N693-K697 WeakPolarHBondContact O-CB 3.29Å; N693-K697 PolarHBondContact O-N 3.45Å
694	Y	77.8	Confident	73.7	Confident	145 Å²	145	91.7 Å²	91.7	57%	0.569	44%	0.444	S	S	*	.	H	α-helix	trans	-64.7	-49.9	174.7	-177.7	-93.3	0	0	0	111.9	K690 L691 L692 K696 K697 E698	K690-Y694 WeakPolarHBondContact O-CB 3.42Å; K690-Y694 PolarHBondContact O-N 3.49Å; L691-Y694 PolarHBondContact O-N 3.17Å; L692-Y694 VanDerWaalsContact C-N 3.35Å; Y694-K696 VanDerWaalsContact C-N 3.31Å; Y694-K696 PolarHBondContact O-N 3.36Å; Y694-K697 PolarHBondContact O-N 3.5Å; Y694-E698 HydrophobicContact CE1-CG 4Å; Y694-E698 PolarHBondContact O-N 3.01Å
695	V	73.9	Confident	73.4	Confident	53 Å²	53	96 Å²	96	32%	0.321	46%	0.456	S	S	.	.	H	α-helix	trans	-62.3	-40.4	178.5	173.8	0	0	0	0	111	V670 I674 L691 L692 E698 Y699	V670-V695 HydrophobicContact CG1-CG1 4.37Å; I674-V695 HydrophobicContact CD1-CG1 4.33Å; L691-V695 WeakPolarHBondContact O-CG2 3.3Å; L691-V695 PolarHBondContact O-N 3.43Å; L692-V695 PolarHBondContact O-N 3.41Å; V695-E698 PolarHBondContact O-N 3.36Å; V695-Y699 WeakPolarHBondContact O-CB 3.36Å; V695-Y699 PolarHBondContact O-N 3.26Å
696	K	78	Confident	72.5	Confident	118 Å²	118	93.1 Å²	93.1	51%	0.513	44%	0.443	S	S	.	.	H	α-helix	trans	-61.1	-45.5	174.9	-173.3	-176.9	175.9	-165	0	111.4	L692 Y694 Y699 D700	L692-K696 WeakPolarHBondContact O-CB 3.34Å; L692-K696 PolarHBondContact O-N 3.02Å; Y694-K696 VanDerWaalsContact C-N 3.31Å; Y694-K696 PolarHBondContact O-N 3.36Å; K696-Y699 PolarHBondContact O-N 3.07Å; K696-D700 WeakPolarHBondContact O-CB 3.44Å; K696-D700 VanDerWaalsContact O-CG 3.25Å; K696-D700 PolarHBondContact O-N 3.16Å
697	K	79.7	Confident	71.5	Confident	138 Å²	138	92.4 Å²	92.4	60%	0.6	44%	0.442	S	S	*	.	H	α-helix	trans	-62.5	-42.7	178.3	-172.5	-178.8	179.5	-176.3	0	112.4	N693 Y694 D700 N701	N693-K697 WeakPolarHBondContact O-CB 3.29Å; N693-K697 PolarHBondContact O-N 3.45Å; Y694-K697 PolarHBondContact O-N 3.5Å; K697-D700 PolarHBondContact O-N 2.68Å; K697-N701 WeakPolarHBondContact O-CB 3.35Å; K697-N701 VanDerWaalsContact O-CG 3.22Å; K697-N701 PolarHBondContact O-N 3.38Å
698	E	73.2	Confident	70.8	Confident	86 Å²	86	92.5 Å²	92.5	40%	0.402	44%	0.442	S	S	.	.	H	α-helix	trans	-64.7	-41.1	175.1	-85	-63.4	133.2	0	0	112.1	Y694 V695 N701 E702	Y694-E698 HydrophobicContact CE1-CG 4Å; Y694-E698 PolarHBondContact O-N 3.01Å; V695-E698 PolarHBondContact O-N 3.36Å; E698-N701 PolarHBondContact O-N 3.13Å; E698-E702 WeakPolarHBondContact O-CB 3.48Å; E698-E702 PolarHBondContact O-N 2.96Å
699	Y	69.3	Low	69.8	Low	127 Å²	127	95.1 Å²	95.1	50%	0.498	46%	0.46	S	S	.	.	H	α-helix	trans	-63.1	-45.6	175.7	-175.1	-94.4	0	0	0	112.1	V695 K696 N701 E702 L703	V695-Y699 WeakPolarHBondContact O-CB 3.36Å; V695-Y699 PolarHBondContact O-N 3.26Å; K696-Y699 PolarHBondContact O-N 3.07Å; Y699-N701 PolarHBondContact O-N 3.4Å; Y699-E702 PolarHBondContact O-N 2.99Å; Y699-L703 WeakPolarHBondContact O-CB 3.27Å; Y699-L703 PolarHBondContact O-N 3.38Å
700	D	74.8	Confident	68.4	Low	76 Å²	76	95.9 Å²	95.9	41%	0.406	46%	0.461	S	S	.	.	H	α-helix	trans	-63.2	-41.1	177.7	-68	-21.4	0	0	0	111	K696 K697 E702 L703 E704	K696-D700 WeakPolarHBondContact O-CB 3.44Å; K696-D700 VanDerWaalsContact O-CG 3.25Å; K696-D700 PolarHBondContact O-N 3.16Å; K697-D700 PolarHBondContact O-N 2.68Å; D700-E702 PolarHBondContact O-N 3.36Å; D700-L703 PolarHBondContact O-N 3.44Å; D700-E704 WeakPolarHBondContact O-CB 3.24Å; D700-E704 PolarHBondContact O-N 2.92Å
701	N	74.4	Confident	67	Low	60 Å²	60	92.9 Å²	92.9	32%	0.321	46%	0.455	S	S	.	.	H	α-helix	trans	-61.5	-42.5	174	-77.2	-12.9	0	0	0	112.4	K697 E698 Y699 E704 K705	K697-N701 WeakPolarHBondContact O-CB 3.35Å; K697-N701 VanDerWaalsContact O-CG 3.22Å; K697-N701 PolarHBondContact O-N 3.38Å; E698-N701 PolarHBondContact O-N 3.13Å; Y699-N701 PolarHBondContact O-N 3.4Å; N701-E704 PolarHBondContact O-N 3.34Å; N701-K705 WeakPolarHBondContact O-CG 3.44Å; N701-K705 PolarHBondContact O-N 3.34Å
702	E	64.2	Low	65.6	Low	88 Å²	88	98.5 Å²	98.5	41%	0.411	47%	0.472	S	S	.	.	H	α-helix	trans	-70.9	-35.2	179.5	-162	59.8	-155.1	0	0	111.5	E698 Y699 D700 K705 Q706	E698-E702 WeakPolarHBondContact O-CB 3.48Å; E698-E702 PolarHBondContact O-N 2.96Å; Y699-E702 PolarHBondContact O-N 2.99Å; D700-E702 PolarHBondContact O-N 3.36Å; E702-K705 PolarHBondContact O-N 3.39Å; E702-K705 WeakPolarHBondContact OE2-CD 3.49Å; E702-K705 IonicContact OE2-NZ 3.94Å; E702-K705 PolarHBondContact OE2-NZ 3Å; E702-Q706 WeakPolarHBondContact O-CG 3.47Å; E702-Q706 PolarHBondContact O-N 2.95Å
703	L	62.5	Low	63.9	Low	55 Å²	55	103.2 Å²	103.2	29%	0.288	49%	0.487	S	S	.	.	H	α-helix	trans	-63.5	-40.9	172.3	-162.8	76.6	0	0	0	111.4	Y699 D700 Q706 L707	Y699-L703 WeakPolarHBondContact O-CB 3.27Å; Y699-L703 PolarHBondContact O-N 3.38Å; D700-L703 PolarHBondContact O-N 3.44Å; L703-Q706 PolarHBondContact O-N 3.36Å; L703-L707 PolarHBondContact O-N 3.01Å
704	E	66.9	Low	62	Low	126 Å²	126	103 Å²	103	59%	0.589	49%	0.486	S	S	*	.	H	α-helix	trans	-64.6	-40.5	175.3	-168.9	174.5	-168.2	0	0	111.8	D700 N701 Q706 L707 L708	D700-E704 WeakPolarHBondContact O-CB 3.24Å; D700-E704 PolarHBondContact O-N 2.92Å; N701-E704 PolarHBondContact O-N 3.34Å; E704-Q706 VanDerWaalsContact C-N 3.34Å; E704-Q706 PolarHBondContact O-N 3.46Å; E704-L707 WeakPolarHBondContact O-CB 3.34Å; E704-L707 PolarHBondContact O-N 3.26Å; E704-L708 WeakPolarHBondContact O-CB 3.12Å; E704-L708 PolarHBondContact O-N 3.28Å
705	K	68.6	Low	60.4	Low	114 Å²	114	100.5 Å²	100.5	50%	0.496	48%	0.482	S	S	.	.	H	α-helix	trans	-61.1	-42.6	171.8	-69.9	179.2	-153.4	155.1	0	111.8	N701 E702 L708 V709	N701-K705 WeakPolarHBondContact O-CG 3.44Å; N701-K705 PolarHBondContact O-N 3.34Å; E702-K705 PolarHBondContact O-N 3.39Å; E702-K705 WeakPolarHBondContact OE2-CD 3.49Å; E702-K705 IonicContact OE2-NZ 3.94Å; E702-K705 PolarHBondContact OE2-NZ 3Å; K705-L708 WeakPolarHBondContact O-CB 3.48Å; K705-L708 PolarHBondContact O-N 3.03Å; K705-V709 WeakPolarHBondContact O-CG2 3.28Å; K705-V709 PolarHBondContact O-N 3.47Å
706	Q	51.9	Low	58.9	Low	109 Å²	109	101.6 Å²	101.6	51%	0.509	49%	0.491	S	S	.	.	H	α-helix	trans	-64.7	-40.4	176.4	-74.1	-171.5	2.8	0	0	112.1	E702 L703 E704 L708 V709 N710	E702-Q706 WeakPolarHBondContact O-CG 3.47Å; E702-Q706 PolarHBondContact O-N 2.95Å; L703-Q706 PolarHBondContact O-N 3.36Å; E704-Q706 VanDerWaalsContact C-N 3.34Å; E704-Q706 PolarHBondContact O-N 3.46Å; Q706-L708 VanDerWaalsContact C-N 3.26Å; Q706-L708 PolarHBondContact O-N 3.32Å; Q706-V709 PolarHBondContact O-N 3.04Å; Q706-N710 WeakPolarHBondContact O-CB 3.35Å; Q706-N710 VanDerWaalsContact O-CG 3.26Å; Q706-N710 PolarHBondContact O-N 3.02Å; Q706-N710 PolarHBondContact O-ND2 3.36Å
707	L	57.3	Low	57	Low	113 Å²	113	99.6 Å²	99.6	59%	0.592	49%	0.486	S	S	*	.	H	α-helix	trans	-57.9	-39.5	171.8	-86.2	162.2	0	0	0	111.7	L703 E704 N710 S711	L703-L707 PolarHBondContact O-N 3.01Å; E704-L707 WeakPolarHBondContact O-CB 3.34Å; E704-L707 PolarHBondContact O-N 3.26Å; L707-N710 PolarHBondContact O-N 2.92Å; L707-S711 WeakPolarHBondContact O-CB 3.3Å; L707-S711 PolarHBondContact O-N 3.49Å
708	L	59	Low	55.2	Low	99 Å²	99	95 Å²	95	52%	0.518	47%	0.467	S	S	.	.	H	α-helix	trans	-72	-33.5	179.2	-149.7	138.6	0	0	0	112.8	E704 K705 Q706 S711 R712	E704-L708 WeakPolarHBondContact O-CB 3.12Å; E704-L708 PolarHBondContact O-N 3.28Å; K705-L708 WeakPolarHBondContact O-CB 3.48Å; K705-L708 PolarHBondContact O-N 3.03Å; Q706-L708 VanDerWaalsContact C-N 3.26Å; Q706-L708 PolarHBondContact O-N 3.32Å; L708-S711 PolarHBondContact O-OG 2.98Å; L708-R712 PolarHBondContact O-N 3.46Å
709	V	49.8	Very low	53.9	Low	97 Å²	97	97.5 Å²	97.5	59%	0.588	48%	0.479	S	S	*	.	H	α-helix	trans	-70.2	-43	170.9	173.3	0	0	0	0	110.6	K705 Q706 S711 R712 Y713	K705-V709 WeakPolarHBondContact O-CG2 3.28Å; K705-V709 PolarHBondContact O-N 3.47Å; Q706-V709 PolarHBondContact O-N 3.04Å; V709-S711 VanDerWaalsContact C-N 3.33Å; V709-S711 PolarHBondContact O-N 2.86Å; V709-R712 WeakPolarHBondContact O-CB 3.46Å; V709-R712 PolarHBondContact O-N 3.42Å; V709-Y713 PolarHBondContact O-N 3.1Å
710	N	48.2	Very low	52.4	Low	86 Å²	86	99.5 Å²	99.5	46%	0.46	49%	0.486	S	S	.	.	H	α-helix	trans	-65.2	-36.3	177.2	-73.8	-16.9	0	0	0	111.6	Q706 L707 R712 Y713 L714	Q706-N710 WeakPolarHBondContact O-CB 3.35Å; Q706-N710 VanDerWaalsContact O-CG 3.26Å; Q706-N710 PolarHBondContact O-N 3.02Å; Q706-N710 PolarHBondContact O-ND2 3.36Å; L707-N710 PolarHBondContact O-N 2.92Å; N710-R712 VanDerWaalsContact C-N 3.34Å; N710-R712 PolarHBondContact O-N 3.38Å; N710-Y713 PolarHBondContact O-N 3.38Å; N710-L714 WeakPolarHBondContact O-CB 3.23Å; N710-L714 PolarHBondContact O-N 3.47Å
711	S	47.4	Very low	50.6	Low	53 Å²	53	99.2 Å²	99.2	37%	0.371	48%	0.482	S	S	.	.	H	α-helix	trans	-65.2	-37.1	175.2	78.7	0	0	0	0	111.9	L707 L708 V709 L714 N715	L707-S711 WeakPolarHBondContact O-CB 3.3Å; L707-S711 PolarHBondContact O-N 3.49Å; L708-S711 PolarHBondContact O-OG 2.98Å; V709-S711 VanDerWaalsContact C-N 3.33Å; V709-S711 PolarHBondContact O-N 2.86Å; S711-L714 PolarHBondContact O-N 2.94Å; S711-N715 PolarHBondContact O-N 3.33Å; S711-N715 PolarHBondContact O-ND2 3.46Å
712	R	45.7	Very low	49.3	Very low	174 Å²	174	100.7 Å²	100.7	66%	0.657	49%	0.493	S	S	*	.	H	α-helix	trans	-64.8	-42.6	170.8	-75	-175.8	-177.9	179.8	2	112.2	L708 V709 N710 L714 N715 C716	L708-R712 PolarHBondContact O-N 3.46Å; V709-R712 WeakPolarHBondContact O-CB 3.46Å; V709-R712 PolarHBondContact O-N 3.42Å; N710-R712 VanDerWaalsContact C-N 3.34Å; N710-R712 PolarHBondContact O-N 3.38Å; R712-L714 VanDerWaalsContact C-N 3.33Å; R712-N715 PolarHBondContact O-N 3.41Å; R712-C716 PolarHBondContact O-N 3.43Å
713	Y	39.4	Very low	48.3	Very low	151 Å²	151	100.2 Å²	100.2	59%	0.592	49%	0.493	S	S	*	.	H	α-helix	trans	-63.7	-40.3	176.1	-169.2	-101.6	0	0	0	111.7	V709 N710 C716 L717	V709-Y713 PolarHBondContact O-N 3.1Å; N710-Y713 PolarHBondContact O-N 3.38Å; Y713-C716 PolarHBondContact O-N 3.31Å; Y713-L717 HydrophobicContact CD1-CD1 3.79Å; Y713-L717 HydrophobicContact CD1-CG 4.25Å; Y713-L717 HydrophobicContact CE1-CD1 3.6Å; Y713-L717 HydrophobicContact CE1-CD2 4.48Å; Y713-L717 HydrophobicContact CE1-CG 4.05Å; Y713-L717 WeakPolarHBondContact O-CG 3.42Å; Y713-L717 PolarHBondContact O-N 3.24Å
714	L	39.9	Very low	47.1	Very low	95 Å²	95	101.5 Å²	101.5	50%	0.497	50%	0.5	S	S	.	.	H	α-helix	trans	-61.1	-43.3	172.1	-97.8	143.2	0	0	0	111.8	N710 S711 R712 C716 L717 L718	N710-L714 WeakPolarHBondContact O-CB 3.23Å; N710-L714 PolarHBondContact O-N 3.47Å; S711-L714 PolarHBondContact O-N 2.94Å; R712-L714 VanDerWaalsContact C-N 3.33Å; L714-C716 VanDerWaalsContact C-N 3.33Å; L714-C716 PolarHBondContact O-N 3.18Å; L714-L717 CarbonylContact O-C 3.54Å; L714-L717 PolarHBondContact O-N 3.15Å; L714-L717 VanDerWaalsContact O-N 3.16Å; L714-L718 WeakPolarHBondContact O-CB 3.45Å; L714-L718 PolarHBondContact O-N 2.98Å
715	N	44.6	Very low	45.9	Very low	93 Å²	93	100.2 Å²	100.2	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-60.1	-41.1	173.8	-78	-30.2	0	0	0	112.1	S711 R712 L718 E719	S711-N715 PolarHBondContact O-N 3.33Å; S711-N715 PolarHBondContact O-ND2 3.46Å; R712-N715 PolarHBondContact O-N 3.41Å; N715-L718 WeakPolarHBondContact O-CB 3.34Å; N715-L718 PolarHBondContact O-N 3.23Å; N715-E719 PolarHBondContact O-N 3.1Å
716	C	41.4	Very low	44.9	Very low	76 Å²	76	100.7 Å²	100.7	51%	0.514	51%	0.505	S	S	.	.	H	α-helix	trans	-66.9	-35.3	174.3	-73.4	0	0	0	0	113.1	R712 Y713 L714 L718 R720	R712-C716 PolarHBondContact O-N 3.43Å; Y713-C716 PolarHBondContact O-N 3.31Å; L714-C716 VanDerWaalsContact C-N 3.33Å; L714-C716 PolarHBondContact O-N 3.18Å; C716-L718 VanDerWaalsContact C-N 3.31Å; C716-R720 PolarHBondContact O-N 2.96Å
717	L	39.3	Very low	44.3	Very low	76 Å²	76	99.3 Å²	99.3	40%	0.398	50%	0.501	S	S	.	.	H	α-helix	trans	-67.1	-34.7	171.4	-73.6	173.8	0	0	0	111.5	Y713 L714 R720 E721	Y713-L717 HydrophobicContact CD1-CD1 3.79Å; Y713-L717 HydrophobicContact CD1-CG 4.25Å; Y713-L717 HydrophobicContact CE1-CD1 3.6Å; Y713-L717 HydrophobicContact CE1-CD2 4.48Å; Y713-L717 HydrophobicContact CE1-CG 4.05Å; Y713-L717 WeakPolarHBondContact O-CG 3.42Å; Y713-L717 PolarHBondContact O-N 3.24Å; L714-L717 CarbonylContact O-C 3.54Å; L714-L717 PolarHBondContact O-N 3.15Å; L714-L717 VanDerWaalsContact O-N 3.16Å; L717-R720 CarbonylContact O-C 3.5Å; L717-R720 WeakPolarHBondContact O-CA 3.46Å; L717-R720 VanDerWaalsContact O-CB 3.32Å; L717-R720 WeakPolarHBondContact O-CB 3.46Å; L717-R720 PolarHBondContact O-N 3.24Å; L717-E721 PolarHBondContact O-N 2.9Å
718	L	42.3	Very low	43.7	Very low	40 Å²	40	97 Å²	97	21%	0.209	49%	0.491	C	S	.	.	H	α-helix	trans	-68.4	-39.9	177.6	-146.9	85.2	0	0	0	112.4	L714 N715 C716 R720 E721 V722	L714-L718 WeakPolarHBondContact O-CB 3.45Å; L714-L718 PolarHBondContact O-N 2.98Å; N715-L718 WeakPolarHBondContact O-CB 3.34Å; N715-L718 PolarHBondContact O-N 3.23Å; C716-L718 VanDerWaalsContact C-N 3.31Å; L718-R720 PolarHBondContact O-N 2.92Å; L718-E721 WeakPolarHBondContact O-CB 3.39Å; L718-E721 PolarHBondContact O-N 3.24Å; L718-E721 VanDerWaalsContact O-N 3.07Å; L718-V722 PolarHBondContact O-N 2.93Å
719	E	45.7	Very low	43.1	Very low	140 Å²	140	95.2 Å²	95.2	65%	0.654	50%	0.496	S	S	*	.	H	α-helix	trans	-60.8	-36.4	170.7	-76.1	-175.2	165.9	0	0	111.4	N715 L723	N715-E719 PolarHBondContact O-N 3.1Å; E719-L723 WeakPolarHBondContact O-CG 3.41Å
720	R	38.1	Very low	43.1	Very low	169 Å²	169	94.7 Å²	94.7	64%	0.638	50%	0.497	S	S	*	.	H	α-helix	trans	-70.3	-31.3	171.7	-81.7	178.5	161.4	177.5	-1.7	112.9	C716 L717 L718 L723 L724	C716-R720 PolarHBondContact O-N 2.96Å; L717-R720 CarbonylContact O-C 3.5Å; L717-R720 WeakPolarHBondContact O-CA 3.46Å; L717-R720 VanDerWaalsContact O-CB 3.32Å; L717-R720 WeakPolarHBondContact O-CB 3.46Å; L717-R720 PolarHBondContact O-N 3.24Å; L718-R720 PolarHBondContact O-N 2.92Å; R720-L723 CarbonylContact O-C 3.5Å; R720-L723 WeakPolarHBondContact O-CB 3.46Å; R720-L723 PolarHBondContact O-N 2.92Å; R720-L724 WeakPolarHBondContact O-CB 3.47Å; R720-L724 PolarHBondContact O-N 3.39Å
721	E	36.7	Very low	42.9	Very low	69 Å²	69	96.3 Å²	96.3	32%	0.322	50%	0.497	S	S	.	.	H	α-helix	trans	-71.5	-43	178.6	-167.1	-178.7	-175.2	0	0	112.3	L717 L718 L723 L724 D725	L717-E721 PolarHBondContact O-N 2.9Å; L718-E721 WeakPolarHBondContact O-CB 3.39Å; L718-E721 PolarHBondContact O-N 3.24Å; L718-E721 VanDerWaalsContact O-N 3.07Å; E721-L723 PolarHBondContact O-N 3.06Å; E721-L723 VanDerWaalsContact O-N 3.1Å; E721-L724 CarbonylContact O-C 3.58Å; E721-L724 WeakPolarHBondContact O-CA 3.37Å; E721-L724 PolarHBondContact O-N 3.28Å; E721-D725 PolarHBondContact O-N 2.98Å
722	V	46.1	Very low	42.7	Very low	91 Å²	91	99.4 Å²	99.4	55%	0.552	51%	0.509	S	S	*	.	H	α-helix	trans	-55.9	-30	171	173.5	0	0	0	0	111.2	L718 N726	L718-V722 PolarHBondContact O-N 2.93Å; V722-N726 PolarHBondContact O-ND2 3.43Å
723	L	43.6	Very low	43	Very low	79 Å²	79	97.8 Å²	97.8	41%	0.414	50%	0.504	S	S	.	.	H	α-helix	trans	-82	-34.9	174.6	-65.3	171.7	0	0	0	112.7	W235 E719 R720 E721 L727	W235-L723 HydrophobicContact CH2-CD2 4.21Å; W235-L723 HydrophobicContact CZ2-CD2 3.89Å; E719-L723 WeakPolarHBondContact O-CG 3.41Å; R720-L723 CarbonylContact O-C 3.5Å; R720-L723 WeakPolarHBondContact O-CB 3.46Å; R720-L723 PolarHBondContact O-N 2.92Å; E721-L723 PolarHBondContact O-N 3.06Å; E721-L723 VanDerWaalsContact O-N 3.1Å; L723-L727 PolarHBondContact O-N 3.35Å
724	L	37.9	Very low	43.4	Very low	81 Å²	81	97.3 Å²	97.3	42%	0.424	51%	0.505	S	S	.	.	H	α-helix	trans	-71.4	-37.1	177	-87.2	153.5	0	0	0	112.8	R720 E721 N726 L727 V728	R720-L724 WeakPolarHBondContact O-CB 3.47Å; R720-L724 PolarHBondContact O-N 3.39Å; E721-L724 CarbonylContact O-C 3.58Å; E721-L724 WeakPolarHBondContact O-CA 3.37Å; E721-L724 PolarHBondContact O-N 3.28Å; L724-N726 VanDerWaalsContact C-N 3.28Å; L724-N726 PolarHBondContact O-N 3.5Å; L724-L727 CarbonylContact O-C 3.43Å; L724-L727 VanDerWaalsContact O-CA 3.23Å; L724-L727 WeakPolarHBondContact O-CA 3.45Å; L724-L727 WeakPolarHBondContact O-CB 3.3Å; L724-L727 PolarHBondContact O-N 3.11Å; L724-V728 WeakPolarHBondContact O-CG2 3.33Å; L724-V728 PolarHBondContact O-N 2.96Å
725	D	41.9	Very low	43.6	Very low	100 Å²	100	95.1 Å²	95.1	54%	0.535	49%	0.492	S	S	.	.	H	α-helix	trans	-61.7	-38.2	175.5	-98.4	-5.9	0	0	0	111.7	E721 L727 V728	E721-D725 PolarHBondContact O-N 2.98Å; D725-L727 PolarHBondContact O-N 3.42Å; D725-V728 PolarHBondContact O-N 3.19Å
726	N	46.6	Very low	44.1	Very low	124 Å²	124	96 Å²	96	66%	0.663	51%	0.505	S	S	*	.	H	α-helix	trans	-66.2	-24.7	170.7	-73	-48.7	0	0	0	112.4	V722 L724	V722-N726 PolarHBondContact O-ND2 3.43Å; L724-N726 VanDerWaalsContact C-N 3.28Å; L724-N726 PolarHBondContact O-N 3.5Å
727	L	40.4	Very low	44.7	Very low	80 Å²	80	96.6 Å²	96.6	42%	0.419	51%	0.51	S	S	.	.	H	α-helix	trans	-84	-39.2	176.9	-130	96.7	0	0	0	112.6	L723 L724 D725 G729 S730 Y731	L723-L727 PolarHBondContact O-N 3.35Å; L724-L727 CarbonylContact O-C 3.43Å; L724-L727 VanDerWaalsContact O-CA 3.23Å; L724-L727 WeakPolarHBondContact O-CA 3.45Å; L724-L727 WeakPolarHBondContact O-CB 3.3Å; L724-L727 PolarHBondContact O-N 3.11Å; D725-L727 PolarHBondContact O-N 3.42Å; L727-G729 VanDerWaalsContact C-N 3.26Å; L727-G729 PolarHBondContact O-N 2.93Å; L727-S730 CarbonylContact O-C 3.47Å; L727-S730 WeakPolarHBondContact O-CA 3.47Å; L727-S730 WeakPolarHBondContact O-CB 3.34Å; L727-S730 PolarHBondContact O-N 3.45Å; L727-Y731 HydrophobicContact CB-CD2 4.44Å; L727-Y731 HydrophobicContact CD2-CD2 3.63Å; L727-Y731 HydrophobicContact CD2-CE2 3.29Å; L727-Y731 HydrophobicContact CG-CD2 3.91Å; L727-Y731 HydrophobicContact CG-CE2 3.83Å; L727-Y731 WeakPolarHBondContact O-CD2 3.33Å; L727-Y731 PolarHBondContact O-N 3.37Å
728	V	43.2	Very low	45.1	Very low	65 Å²	65	97.3 Å²	97.3	39%	0.394	51%	0.512	S	S	.	.	H	α-helix	trans	-61.9	-36.6	-177.6	171.6	0	0	0	0	110.6	L724 D725 S730 Y731 L732	L724-V728 WeakPolarHBondContact O-CG2 3.33Å; L724-V728 PolarHBondContact O-N 2.96Å; D725-V728 PolarHBondContact O-N 3.19Å; V728-S730 PolarHBondContact O-N 2.95Å; V728-Y731 PolarHBondContact O-N 3.42Å; V728-Y731 VanDerWaalsContact O-N 3.15Å; V728-L732 HydrophobicContact CG1-CD1 3.81Å; V728-L732 HydrophobicContact CG1-CG 4.01Å; V728-L732 PolarHBondContact O-N 3.17Å
729	G	46.6	Very low	46.4	Very low	61 Å²	61	99.4 Å²	99.4	63%	0.629	53%	0.531	S	S	*	.	H	α-helix	trans	-57.8	-29.5	170.3	0	0	0	0	0	114	L727	L727-G729 VanDerWaalsContact C-N 3.26Å; L727-G729 PolarHBondContact O-N 2.93Å
730	S	51.1	Low	47.6	Very low	86 Å²	86	97.7 Å²	97.7	60%	0.601	53%	0.53	S	S	*	.	H	α-helix	trans	-90.6	-26.9	174	-74.9	0	0	0	0	113.9	L727 V728	L727-S730 CarbonylContact O-C 3.47Å; L727-S730 WeakPolarHBondContact O-CA 3.47Å; L727-S730 WeakPolarHBondContact O-CB 3.34Å; L727-S730 PolarHBondContact O-N 3.45Å; V728-S730 PolarHBondContact O-N 2.95Å
731	Y	42.7	Very low	49.4	Very low	119 Å²	119	93 Å²	93	47%	0.467	53%	0.526	S	S	.	.	H	α-helix	trans	-86.9	-31.5	-175.9	-92	-92	0	0	0	114	L727 V728 Y733 K734 F735	L727-Y731 HydrophobicContact CB-CD2 4.44Å; L727-Y731 HydrophobicContact CD2-CD2 3.63Å; L727-Y731 HydrophobicContact CD2-CE2 3.29Å; L727-Y731 HydrophobicContact CG-CD2 3.91Å; L727-Y731 HydrophobicContact CG-CE2 3.83Å; L727-Y731 WeakPolarHBondContact O-CD2 3.33Å; L727-Y731 PolarHBondContact O-N 3.37Å; V728-Y731 PolarHBondContact O-N 3.42Å; V728-Y731 VanDerWaalsContact O-N 3.15Å; Y731-Y733 PolarHBondContact O-N 3.42Å; Y731-Y733 VanDerWaalsContact O-N 3.13Å; Y731-K734 WeakPolarHBondContact O-CA 3.43Å; Y731-K734 WeakPolarHBondContact O-CB 3.34Å; Y731-K734 PolarHBondContact O-N 3.24Å; Y731-F735 WeakPolarHBondContact O-CD2 3.49Å; Y731-F735 PolarHBondContact O-N 2.99Å
732	L	43.2	Very low	51	Low	119 Å²	119	91 Å²	91	62%	0.623	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-26	171.7	-75.2	172.5	0	0	0	112	V728 K734	V728-L732 HydrophobicContact CG1-CD1 3.81Å; V728-L732 HydrophobicContact CG1-CG 4.01Å; V728-L732 PolarHBondContact O-N 3.17Å; L732-K734 VanDerWaalsContact C-N 3.31Å; L732-K734 PolarHBondContact O-N 3.23Å
733	Y	51.8	Low	52.1	Low	140 Å²	140	88 Å²	88	55%	0.549	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-21.9	173.6	-164.4	-89.2	0	0	0	113.7	R361 Y731	R361-Y733 VanDerWaalsContact CZ-CE1 3.47Å; R361-Y733 PolarHBondContact NH1-OH 3.44Å; R361-Y733 VanDerWaalsContact NH1-OH 3.07Å; R361-Y733 PolarHBondContact NH2-OH 3.05Å; Y731-Y733 PolarHBondContact O-N 3.42Å; Y731-Y733 VanDerWaalsContact O-N 3.13Å
734	K	48.8	Very low	53.4	Low	141 Å²	141	91.8 Å²	91.8	61%	0.613	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-14.5	-176.2	-140.8	176.2	-173.9	-176.6	0	113.7	Y731 L732 S736 S737	Y731-K734 WeakPolarHBondContact O-CA 3.43Å; Y731-K734 WeakPolarHBondContact O-CB 3.34Å; Y731-K734 PolarHBondContact O-N 3.24Å; L732-K734 VanDerWaalsContact C-N 3.31Å; L732-K734 PolarHBondContact O-N 3.23Å; K734-S736 PolarHBondContact O-N 3.42Å; K734-S737 PolarHBondContact O-OG 3.48Å
735	F	44.6	Very low	54.9	Low	49 Å²	49	92.2 Å²	92.2	22%	0.215	52%	0.524	C	S	.	.	G	3₁₀ helix	trans	-74.8	-8.9	179.4	-80.5	-70	0	0	0	114.3	Y731 S737 M738 V743 V746	Y731-F735 WeakPolarHBondContact O-CD2 3.49Å; Y731-F735 PolarHBondContact O-N 2.99Å; F735-S737 PolarHBondContact O-N 2.89Å; F735-S737 VanDerWaalsContact O-N 3.09Å; F735-M738 HydrophobicContact CD1-SD 4.16Å; F735-M738 HydrophobicContact CE1-SD 4.12Å; F735-M738 PolarHBondContact O-N 3.02Å; F735-V743 HydrophobicContact CD1-CG1 4.43Å; F735-V743 HydrophobicContact CD1-CG2 4.15Å; F735-V746 HydrophobicContact CE1-CB 4.15Å; F735-V746 HydrophobicContact CE1-CG1 3.74Å; F735-V746 HydrophobicContact CZ-CB 4.5Å; F735-V746 HydrophobicContact CZ-CG1 3.62Å
736	S	53.7	Low	56	Low	112 Å²	112	89.6 Å²	89.6	78%	0.783	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-67.9	-6.8	176.8	73.2	0	0	0	0	114.2	K734	K734-S736 PolarHBondContact O-N 3.42Å
737	S	55	Low	56.8	Low	87 Å²	87	86.6 Å²	86.6	61%	0.608	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-116.3	7.7	-179	70.6	0	0	0	0	115.1	K734 F735	K734-S737 PolarHBondContact O-OG 3.48Å; F735-S737 PolarHBondContact O-N 2.89Å; F735-S737 VanDerWaalsContact O-N 3.09Å
738	M	48	Very low	58	Low	91 Å²	91	89.6 Å²	89.6	45%	0.448	51%	0.505	S	S	.	.	S	Bend	trans	-101.1	144.8	176.1	-68.8	-172	88	0	0	110.7	F735 A742 V743	F735-M738 HydrophobicContact CD1-SD 4.16Å; F735-M738 HydrophobicContact CE1-SD 4.12Å; F735-M738 PolarHBondContact O-N 3.02Å; M738-A742 HydrophobicContact CB-CB 4.36Å; M738-A742 HydrophobicContact CE-CB 3.83Å; M738-V743 HydrophobicContact CB-CG2 3.7Å
739	S	68.7	Low	59	Low	85 Å²	85	88.2 Å²	88.2	59%	0.594	50%	0.504	S	S	*	.			trans	-60.1	144.5	174.4	65.3	0	0	0	0	109.7	A741 A742 V743	S739-A741 PolarHBondContact O-N 3.48Å; S739-A742 WeakPolarHBondContact O-CA 3.35Å; S739-A742 WeakPolarHBondContact O-CB 3.4Å; S739-A742 PolarHBondContact O-N 3.42Å; S739-V743 PolarHBondContact O-N 3.38Å
740	V	71.9	Confident	59.7	Low	104 Å²	104	92 Å²	92	63%	0.63	50%	0.503	S	S	*	.	H	α-helix	trans	-50.6	-38.7	-175.2	175.9	0	0	0	0	111.7	V743 Y744	V740-V743 PolarHBondContact O-N 2.98Å; V740-Y744 HydrophobicContact CG1-CD2 3.56Å; V740-Y744 HydrophobicContact CG1-CE2 3.44Å; V740-Y744 VanDerWaalsContact CG1-CE2 3.44Å; V740-Y744 WeakPolarHBondContact O-CD2 3.35Å; V740-Y744 PolarHBondContact O-N 2.93Å
741	A	74.4	Confident	59.8	Low	69 Å²	69	93 Å²	93	57%	0.57	50%	0.501	S	S	*	.	H	α-helix	trans	-64	-40.1	175.7	0	0	0	0	0	113.6	S739 Y744 S745	S739-A741 PolarHBondContact O-N 3.48Å; A741-Y744 PolarHBondContact O-N 3.45Å; A741-S745 PolarHBondContact O-N 2.89Å; A741-S745 PolarHBondContact O-OG 3.36Å
742	A	71.1	Confident	60.1	Low	28 Å²	28	91.3 Å²	91.3	23%	0.231	50%	0.499	C	S	.	.	H	α-helix	trans	-70	-37.5	175.6	0	0	0	0	0	111.4	M738 S739 Y744 S745 V746	M738-A742 HydrophobicContact CB-CB 4.36Å; M738-A742 HydrophobicContact CE-CB 3.83Å; S739-A742 WeakPolarHBondContact O-CA 3.35Å; S739-A742 WeakPolarHBondContact O-CB 3.4Å; S739-A742 PolarHBondContact O-N 3.42Å; A742-Y744 VanDerWaalsContact C-N 3.35Å; A742-S745 PolarHBondContact O-N 2.9Å; A742-V746 VanDerWaalsContact O-CB 3.3Å; A742-V746 WeakPolarHBondContact O-CB 3.38Å; A742-V746 WeakPolarHBondContact O-CG2 3.46Å; A742-V746 PolarHBondContact O-N 2.87Å
743	V	68.5	Low	60.1	Low	29 Å²	29	92.3 Å²	92.3	18%	0.176	51%	0.505	C	S	.	.	H	α-helix	trans	-62	-45.1	173.1	178.5	0	0	0	0	109.8	F735 M738 S739 V740 L747	F735-V743 HydrophobicContact CD1-CG1 4.43Å; F735-V743 HydrophobicContact CD1-CG2 4.15Å; M738-V743 HydrophobicContact CB-CG2 3.7Å; S739-V743 PolarHBondContact O-N 3.38Å; V740-V743 PolarHBondContact O-N 2.98Å; V743-L747 HydrophobicContact CG1-CD1 3.5Å; V743-L747 HydrophobicContact CG1-CG 4.12Å; V743-L747 WeakPolarHBondContact O-CB 3.29Å; V743-L747 WeakPolarHBondContact O-CG 3.33Å; V743-L747 PolarHBondContact O-N 2.69Å
744	Y	71.7	Confident	59.8	Low	158 Å²	158	88.5 Å²	88.5	62%	0.62	50%	0.497	S	S	*	.	H	α-helix	trans	-63.7	-47.3	175.2	-85.7	-69.6	0	0	0	112.2	V740 A741 A742 V746 L747 F748	V740-Y744 HydrophobicContact CG1-CD2 3.56Å; V740-Y744 HydrophobicContact CG1-CE2 3.44Å; V740-Y744 VanDerWaalsContact CG1-CE2 3.44Å; V740-Y744 WeakPolarHBondContact O-CD2 3.35Å; V740-Y744 PolarHBondContact O-N 2.93Å; A741-Y744 PolarHBondContact O-N 3.45Å; A742-Y744 VanDerWaalsContact C-N 3.35Å; Y744-V746 VanDerWaalsContact C-N 3.35Å; Y744-V746 PolarHBondContact O-N 3.14Å; Y744-L747 PolarHBondContact O-N 2.71Å; Y744-F748 WeakPolarHBondContact O-CA 3.45Å; Y744-F748 WeakPolarHBondContact O-CB 3.48Å; Y744-F748 PolarHBondContact O-N 3Å
745	S	69.4	Low	59.5	Low	90 Å²	90	83.2 Å²	83.2	63%	0.629	48%	0.48	S	S	*	.	H	α-helix	trans	-65.2	-37.3	179.2	-69	0	0	0	0	113	A741 A742 G749	A741-S745 PolarHBondContact O-N 2.89Å; A741-S745 PolarHBondContact O-OG 3.36Å; A742-S745 PolarHBondContact O-N 2.9Å; S745-G749 PolarHBondContact O-N 3.27Å
746	V	64.6	Low	59.2	Low	44 Å²	44	84.2 Å²	84.2	27%	0.267	49%	0.492	S	S	.	.	H	α-helix	trans	-71.9	-43.8	176.3	175.9	0	0	0	0	110.3	F735 A742 Y744 G749 F750	F735-V746 HydrophobicContact CE1-CB 4.15Å; F735-V746 HydrophobicContact CE1-CG1 3.74Å; F735-V746 HydrophobicContact CZ-CB 4.5Å; F735-V746 HydrophobicContact CZ-CG1 3.62Å; A742-V746 VanDerWaalsContact O-CB 3.3Å; A742-V746 WeakPolarHBondContact O-CB 3.38Å; A742-V746 WeakPolarHBondContact O-CG2 3.46Å; A742-V746 PolarHBondContact O-N 2.87Å; Y744-V746 VanDerWaalsContact C-N 3.35Å; Y744-V746 PolarHBondContact O-N 3.14Å; V746-G749 PolarHBondContact O-N 2.94Å; V746-F750 HydrophobicContact CG1-CD2 3.66Å; V746-F750 HydrophobicContact CG1-CE2 4.1Å; V746-F750 VanDerWaalsContact O-CB 3.22Å; V746-F750 WeakPolarHBondContact O-CB 3.48Å; V746-F750 WeakPolarHBondContact O-CD2 3.38Å; V746-F750 PolarHBondContact O-N 3.12Å
747	L	64.1	Low	58.4	Low	61 Å²	61	82 Å²	82	32%	0.319	48%	0.481	S	S	.	.	H	α-helix	trans	-64.7	-39.1	174.2	-76.1	171.7	0	0	0	111.6	V743 Y744 L751	V743-L747 HydrophobicContact CG1-CD1 3.5Å; V743-L747 HydrophobicContact CG1-CG 4.12Å; V743-L747 WeakPolarHBondContact O-CB 3.29Å; V743-L747 WeakPolarHBondContact O-CG 3.33Å; V743-L747 PolarHBondContact O-N 2.69Å; Y744-L747 PolarHBondContact O-N 2.71Å; L747-L751 HydrophobicContact CB-CD1 4.13Å; L747-L751 HydrophobicContact CD2-CD1 4.11Å; L747-L751 HydrophobicContact CD2-CG 4.46Å; L747-L751 WeakPolarHBondContact O-CA 3.31Å; L747-L751 WeakPolarHBondContact O-CB 3.46Å; L747-L751 WeakPolarHBondContact O-CG 3.24Å; L747-L751 PolarHBondContact O-N 3.3Å
748	F	64.9	Low	57.6	Low	144 Å²	144	83 Å²	83	63%	0.632	47%	0.472	S	S	*	.	H	α-helix	trans	-67.6	-43.2	179	-150.7	-104.8	0	0	0	109.9	Y744 L752	Y744-F748 WeakPolarHBondContact O-CA 3.45Å; Y744-F748 WeakPolarHBondContact O-CB 3.48Å; Y744-F748 PolarHBondContact O-N 3Å; F748-L752 HydrophobicContact CD1-CD1 3.34Å; F748-L752 HydrophobicContact CD1-CG 4.48Å; F748-L752 HydrophobicContact CE1-CD1 3.3Å; F748-L752 HydrophobicContact CE1-CG 4.49Å; F748-L752 HydrophobicContact CG-CD1 4.06Å; F748-L752 HydrophobicContact CZ-CD1 3.98Å; F748-L752 WeakPolarHBondContact O-CB 3.5Å; F748-L752 WeakPolarHBondContact O-CD1 3.26Å; F748-L752 WeakPolarHBondContact O-CG 3.25Å; F748-L752 PolarHBondContact O-N 3.42Å
749	G	64.9	Low	56.9	Low	36 Å²	36	85.8 Å²	85.8	37%	0.371	49%	0.489	S	S	.	.	H	α-helix	trans	-68.3	-40.5	174.6	0	0	0	0	0	114.1	S745 V746 L753	S745-G749 PolarHBondContact O-N 3.27Å; V746-G749 PolarHBondContact O-N 2.94Å; G749-L753 VanDerWaalsContact O-CD1 3.32Å; G749-L753 WeakPolarHBondContact O-CD1 3.36Å
750	F	60	Low	55.4	Low	140 Å²	140	90.2 Å²	90.2	61%	0.614	49%	0.494	S	S	*	.	H	α-helix	trans	-84.3	-18.2	179.9	-90.5	-86.8	0	0	0	114.4	V746 P754	V746-F750 HydrophobicContact CG1-CD2 3.66Å; V746-F750 HydrophobicContact CG1-CE2 4.1Å; V746-F750 VanDerWaalsContact O-CB 3.22Å; V746-F750 WeakPolarHBondContact O-CB 3.48Å; V746-F750 WeakPolarHBondContact O-CD2 3.38Å; V746-F750 PolarHBondContact O-N 3.12Å; F750-P754 WeakPolarHBondContact O-CD 3.41Å; F750-P754 WeakPolarHBondContact O-CG 3.06Å
751	L	53.3	Low	53.9	Low	108 Å²	108	88.1 Å²	88.1	57%	0.565	49%	0.488	S	S	*	.	H	α-helix	trans	-93	-32.6	173.2	-65.9	170.9	0	0	0	110.6	L747 A755	L747-L751 HydrophobicContact CB-CD1 4.13Å; L747-L751 HydrophobicContact CD2-CD1 4.11Å; L747-L751 HydrophobicContact CD2-CG 4.46Å; L747-L751 WeakPolarHBondContact O-CA 3.31Å; L747-L751 WeakPolarHBondContact O-CB 3.46Å; L747-L751 WeakPolarHBondContact O-CG 3.24Å; L747-L751 PolarHBondContact O-N 3.3Å; L751-A755 WeakPolarHBondContact O-CA 3.37Å; L751-A755 WeakPolarHBondContact O-CB 3.32Å; L751-A755 PolarHBondContact O-N 3.36Å
752	L	48.4	Very low	52.4	Low	82 Å²	82	93.6 Å²	93.6	43%	0.429	50%	0.501	S	S	.	.	H	α-helix	trans	-65	-43	175.1	-83.7	162.3	0	0	0	112.2	F748 C756	F748-L752 HydrophobicContact CD1-CD1 3.34Å; F748-L752 HydrophobicContact CD1-CG 4.48Å; F748-L752 HydrophobicContact CE1-CD1 3.3Å; F748-L752 HydrophobicContact CE1-CG 4.49Å; F748-L752 HydrophobicContact CG-CD1 4.06Å; F748-L752 HydrophobicContact CZ-CD1 3.98Å; F748-L752 WeakPolarHBondContact O-CB 3.5Å; F748-L752 WeakPolarHBondContact O-CD1 3.26Å; F748-L752 WeakPolarHBondContact O-CG 3.25Å; F748-L752 PolarHBondContact O-N 3.42Å; L752-C756 WeakPolarHBondContact O-CB 3.32Å; L752-C756 PolarHBondContact O-N 3.31Å; L752-C756 VanDerWaalsContact O-N 3.09Å; L752-C756 PolarHBondContact O-SG 3Å
753	L	45.1	Very low	51.2	Low	141 Å²	141	94.7 Å²	94.7	74%	0.738	52%	0.515	S	S	*	.	H	α-helix	trans	-67.3	-38.6	-176.9	-91.4	92.7	0	0	0	114.8	G749	G749-L753 VanDerWaalsContact O-CD1 3.32Å; G749-L753 WeakPolarHBondContact O-CD1 3.36Å
754	P	44.6	Very low	50.5	Low	59 Å²	59	98.3 Å²	98.3	38%	0.383	53%	0.527	S	S	.	.	H	α-helix	trans	-81.5	-33.8	172.2	-16.5	32.5	0	0	0	113.3	F750 C756 A757 Y758	F750-P754 WeakPolarHBondContact O-CD 3.41Å; F750-P754 WeakPolarHBondContact O-CG 3.06Å; P754-C756 PolarHBondContact O-N 3.16Å; P754-A757 PolarHBondContact O-N 2.97Å; P754-Y758 VanDerWaalsContact O-CD2 3.24Å; P754-Y758 WeakPolarHBondContact O-CD2 3.39Å
755	A	41.7	Very low	49.4	Very low	31 Å²	31	93.7 Å²	93.7	26%	0.256	51%	0.512	S	S	.	.	H	α-helix	trans	-61.1	-34.4	176.8	0	0	0	0	0	111.3	F648 L751 A757 Y758	F648-A755 HydrophobicContact CE2-CB 4.25Å; F648-A755 VanDerWaalsContact CE2-O 3.25Å; F648-A755 WeakPolarHBondContact CE2-O 3.47Å; F648-A755 WeakPolarHBondContact CZ-O 3.39Å; L751-A755 WeakPolarHBondContact O-CA 3.37Å; L751-A755 WeakPolarHBondContact O-CB 3.32Å; L751-A755 PolarHBondContact O-N 3.36Å; A755-A757 PolarHBondContact O-N 3.49Å; A755-A757 VanDerWaalsContact O-N 3.09Å; A755-Y758 PolarHBondContact O-N 2.9Å
756	C	38.4	Very low	48.5	Very low	70 Å²	70	90.9 Å²	90.9	47%	0.473	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-8.5	174.2	-66.3	0	0	0	0	114.9	W651 L752 P754	W651-C756 HydrophobicContact CH2-CB 4.01Å; L752-C756 WeakPolarHBondContact O-CB 3.32Å; L752-C756 PolarHBondContact O-N 3.31Å; L752-C756 VanDerWaalsContact O-N 3.09Å; L752-C756 PolarHBondContact O-SG 3Å; P754-C756 PolarHBondContact O-N 3.16Å
757	A	37.9	Very low	48.2	Very low	66 Å²	66	93.2 Å²	93.2	55%	0.545	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	6.5	178	0	0	0	0	0	113.9	P754 A755 N759	P754-A757 PolarHBondContact O-N 2.97Å; A755-A757 PolarHBondContact O-N 3.49Å; A755-A757 VanDerWaalsContact O-N 3.09Å; A757-N759 VanDerWaalsContact C-N 3.3Å; A757-N759 PolarHBondContact O-N 3.43Å
758	Y	37.5	Very low	47.7	Very low	108 Å²	108	97.3 Å²	97.3	42%	0.424	51%	0.513	S	S	.	.			trans	-82.8	70.2	177.6	-88.4	-90.2	0	0	0	112	P754 A755 Y760	P754-Y758 VanDerWaalsContact O-CD2 3.24Å; P754-Y758 WeakPolarHBondContact O-CD2 3.39Å; A755-Y758 PolarHBondContact O-N 2.9Å; Y758-Y760 HydrophobicContact CD1-CD2 4.25Å; Y758-Y760 AromaticContact CD1-CE2 3.59Å; Y758-Y760 HydrophobicContact CD1-CE2 3.59Å; Y758-Y760 HydrophobicContact CE1-CE2 4.38Å; Y758-Y760 HydrophobicContact CG-CE2 4.39Å; Y758-Y760 PolarHBondContact O-N 2.94Å
759	N	33.3	Very low	47.3	Very low	149 Å²	149	91.3 Å²	91.3	80%	0.797	49%	0.488	S	S	*	.			trans	-79.1	97.3	161.9	-82	-24.1	0	0	0	108.8	A757 A761	A757-N759 VanDerWaalsContact C-N 3.3Å; A757-N759 PolarHBondContact O-N 3.43Å; N759-A761 PolarHBondContact O-N 3.21Å
760	Y	37.9	Very low	47.3	Very low	177 Å²	177	93.8 Å²	93.8	69%	0.694	49%	0.493	S	S	*	.			trans	-72.1	73.2	170.1	-86	-88	0	0	0	110.3	Y758 I765	Y758-Y760 HydrophobicContact CD1-CD2 4.25Å; Y758-Y760 AromaticContact CD1-CE2 3.59Å; Y758-Y760 HydrophobicContact CD1-CE2 3.59Å; Y758-Y760 HydrophobicContact CE1-CE2 4.38Å; Y758-Y760 HydrophobicContact CG-CE2 4.39Å; Y758-Y760 PolarHBondContact O-N 2.94Å; Y760-I765 HydrophobicContact CD1-CD1 4.37Å
761	A	39.3	Very low	47.7	Very low	61 Å²	61	92.5 Å²	92.5	50%	0.504	48%	0.484	S	S	.	.			trans	-85.9	129.5	165.6	0	0	0	0	0	109	N759 G763 Y764	N759-A761 PolarHBondContact O-N 3.21Å; A761-G763 PolarHBondContact O-N 3.5Å; A761-Y764 PolarHBondContact O-N 3.32Å
762	E	43.7	Very low	48.5	Very low	183 Å²	183	87.8 Å²	87.8	86%	0.855	46%	0.459	S	S	*	.	H	α-helix	trans	-46.7	-31.4	-177.1	-75.5	178.3	140.5	0	0	114.2	Y764 A766	E762-Y764 PolarHBondContact O-N 3.46Å; E762-A766 PolarHBondContact O-N 3.33Å
763	G	45.7	Very low	49.8	Very low	51 Å²	51	84 Å²	84	53%	0.526	44%	0.44	S	S	.	.	H	α-helix	trans	-64	-31.4	177.1	0	0	0	0	0	115.1	A761 A766 E767	A761-G763 PolarHBondContact O-N 3.5Å; G763-A766 PolarHBondContact O-N 3.02Å; G763-E767 WeakPolarHBondContact O-CB 3.47Å; G763-E767 PolarHBondContact O-N 3.43Å
764	Y	53.6	Low	51.3	Low	106 Å²	106	82.6 Å²	82.6	42%	0.416	43%	0.43	S	S	.	.	H	α-helix	trans	-72	-34.7	-177.7	-172.6	-105.6	0	0	0	112.3	A761 E762 R768	A761-Y764 PolarHBondContact O-N 3.32Å; E762-Y764 PolarHBondContact O-N 3.46Å; Y764-R768 VanDerWaalsContact O-CB 3.3Å; Y764-R768 WeakPolarHBondContact O-CB 3.33Å; Y764-R768 PolarHBondContact O-N 3.31Å
765	I	49.1	Very low	52.9	Low	61 Å²	61	86.4 Å²	86.4	31%	0.313	44%	0.436	S	S	.	.	H	α-helix	trans	-65.9	-48.7	174	-61.7	176.7	0	0	0	108.8	Y760 E767 R768 L769	Y760-I765 HydrophobicContact CD1-CD1 4.37Å; I765-E767 VanDerWaalsContact C-N 3.3Å; I765-E767 PolarHBondContact O-N 3.21Å; I765-R768 PolarHBondContact O-N 3.45Å; I765-L769 HydrophobicContact CG2-CD1 3.74Å; I765-L769 HydrophobicContact CG2-CG 4.1Å; I765-L769 WeakPolarHBondContact O-CB 3.31Å; I765-L769 WeakPolarHBondContact O-CG 3.45Å; I765-L769 PolarHBondContact O-N 3.43Å
766	A	50.9	Low	54.8	Low	31 Å²	31	84.9 Å²	84.9	26%	0.256	42%	0.424	S	S	.	.	H	α-helix	trans	-53.9	-48.5	177.7	0	0	0	0	0	111.8	E762 G763 L769 N770 F881	E762-A766 PolarHBondContact O-N 3.33Å; G763-A766 PolarHBondContact O-N 3.02Å; A766-L769 PolarHBondContact O-N 3.17Å; A766-N770 WeakPolarHBondContact O-CB 3.43Å; A766-N770 PolarHBondContact O-N 3.45Å; A766-F881 HydrophobicContact CB-CD1 4.25Å; A766-F881 HydrophobicContact CB-CE1 3.44Å; A766-F881 VanDerWaalsContact CB-CE1 3.44Å; A766-F881 HydrophobicContact CB-CZ 4.07Å
767	E	56.8	Low	57	Low	93 Å²	93	82.3 Å²	82.3	44%	0.435	41%	0.405	S	S	.	.	H	α-helix	trans	-65.3	-43.1	-179.8	-168.4	178.9	-178.8	0	0	112.4	G763 I765 L769 N770 R771	G763-E767 WeakPolarHBondContact O-CB 3.47Å; G763-E767 PolarHBondContact O-N 3.43Å; I765-E767 VanDerWaalsContact C-N 3.3Å; I765-E767 PolarHBondContact O-N 3.21Å; E767-L769 VanDerWaalsContact C-N 3.31Å; E767-L769 PolarHBondContact O-N 3.47Å; E767-N770 PolarHBondContact O-N 3.39Å; E767-R771 WeakPolarHBondContact O-CG 3.26Å; E767-R771 PolarHBondContact O-N 2.87Å; E767-R771 IonicContact OE1-CZ 3.76Å; E767-R771 IonicContact OE1-NE 3.26Å; E767-R771 PolarHBondContact OE1-NE 2.73Å; E767-R771 IonicContact OE1-NH2 2.73Å; E767-R771 PolarHBondContact OE1-NH2 2.82Å
768	R	54.1	Low	59.2	Low	147 Å²	147	85.1 Å²	85.1	56%	0.555	41%	0.407	S	S	*	.	H	α-helix	trans	-61.7	-40.2	176.7	-174.2	177.6	178.6	167	4.7	111.7	Y764 I765 S772	Y764-R768 VanDerWaalsContact O-CB 3.3Å; Y764-R768 WeakPolarHBondContact O-CB 3.33Å; Y764-R768 PolarHBondContact O-N 3.31Å; I765-R768 PolarHBondContact O-N 3.45Å; R768-S772 PolarHBondContact O-N 3.46Å; R768-S772 VanDerWaalsContact O-N 3.16Å; R768-S772 PolarHBondContact O-OG 3.49Å; R768-S772 VanDerWaalsContact O-OG 3.1Å
769	L	57.8	Low	61.5	Low	18 Å²	18	85 Å²	85	9%	0.094	41%	0.41	C	S	.	.	H	α-helix	trans	-72.4	-31.6	178.5	-65.1	-175.5	0	0	0	112.7	I765 A766 E767 S772 S773 D867 F881	I765-L769 HydrophobicContact CG2-CD1 3.74Å; I765-L769 HydrophobicContact CG2-CG 4.1Å; I765-L769 WeakPolarHBondContact O-CB 3.31Å; I765-L769 WeakPolarHBondContact O-CG 3.45Å; I765-L769 PolarHBondContact O-N 3.43Å; A766-L769 PolarHBondContact O-N 3.17Å; E767-L769 VanDerWaalsContact C-N 3.31Å; E767-L769 PolarHBondContact O-N 3.47Å; L769-S772 VanDerWaalsContact C-OG 3.29Å; L769-S772 VanDerWaalsContact CA-OG 3.31Å; L769-S772 WeakPolarHBondContact CA-OG 3.37Å; L769-S772 PolarHBondContact O-OG 3.05Å; L769-S773 WeakPolarHBondContact O-CB 3.43Å; L769-S773 PolarHBondContact O-N 3.31Å; L769-S773 VanDerWaalsContact O-N 3.09Å; L769-S773 PolarHBondContact O-OG 3.4Å; L769-D867 WeakPolarHBondContact CB-OD2 3.42Å; L769-D867 WeakPolarHBondContact CD1-OD2 3.47Å; L769-F881 HydrophobicContact CD1-CZ 4.09Å
770	N	64.8	Low	63.9	Low	88 Å²	88	77.9 Å²	77.9	47%	0.471	37%	0.372	S	S	.	.	H	α-helix	trans	-70.4	-46.7	174.4	-157	22.9	0	0	0	110.9	A766 E767 S772 S773 E774	A766-N770 WeakPolarHBondContact O-CB 3.43Å; A766-N770 PolarHBondContact O-N 3.45Å; E767-N770 PolarHBondContact O-N 3.39Å; N770-S772 PolarHBondContact O-N 3.19Å; N770-S773 WeakPolarHBondContact O-CB 3.3Å; N770-S773 PolarHBondContact O-N 2.94Å; N770-S773 VanDerWaalsContact O-N 3.12Å; N770-E774 WeakPolarHBondContact O-CG 3.34Å; N770-E774 PolarHBondContact O-N 3.49Å
771	R	67.7	Low	66.1	Low	113 Å²	113	70.2 Å²	70.2	43%	0.426	34%	0.344	S	S	.	.	H	α-helix	trans	-60	-34	177.1	-73.6	179.7	-173.4	-173.6	2.7	112.9	E767 R775	E767-R771 WeakPolarHBondContact O-CG 3.26Å; E767-R771 PolarHBondContact O-N 2.87Å; E767-R771 IonicContact OE1-CZ 3.76Å; E767-R771 IonicContact OE1-NE 3.26Å; E767-R771 PolarHBondContact OE1-NE 2.73Å; E767-R771 IonicContact OE1-NH2 2.73Å; E767-R771 PolarHBondContact OE1-NH2 2.82Å; R771-R775 WeakPolarHBondContact O-CG 3.33Å; R771-R775 PolarHBondContact O-N 3.44Å
772	S	71.1	Confident	68.2	Low	8 Å²	8	71.8 Å²	71.8	6%	0.056	34%	0.343	C	S	.	.	H	α-helix	trans	-74	-42.1	175	49.6	0	0	0	0	112.4	R768 L769 N770 E774 R775 I776 E865	R768-S772 PolarHBondContact O-N 3.46Å; R768-S772 VanDerWaalsContact O-N 3.16Å; R768-S772 PolarHBondContact O-OG 3.49Å; R768-S772 VanDerWaalsContact O-OG 3.1Å; L769-S772 VanDerWaalsContact C-OG 3.29Å; L769-S772 VanDerWaalsContact CA-OG 3.31Å; L769-S772 WeakPolarHBondContact CA-OG 3.37Å; L769-S772 PolarHBondContact O-OG 3.05Å; N770-S772 PolarHBondContact O-N 3.19Å; S772-E774 VanDerWaalsContact C-N 3.29Å; S772-E774 PolarHBondContact O-N 3.43Å; S772-R775 WeakPolarHBondContact O-CB 3.39Å; S772-R775 PolarHBondContact O-N 3.31Å; S772-I776 WeakPolarHBondContact O-CG1 3.45Å; S772-I776 PolarHBondContact O-N 2.96Å; S772-E865 WeakPolarHBondContact CB-OE2 3.49Å; S772-E865 VanDerWaalsContact OG-CA 3.27Å; S772-E865 WeakPolarHBondContact OG-CA 3.35Å; S772-E865 WeakPolarHBondContact OG-CB 3.4Å; S772-E865 WeakPolarHBondContact OG-CG 3.41Å
773	S	74	Confident	69.7	Low	4 Å²	4	69.4 Å²	69.4	3%	0.028	33%	0.326	C	S	.	.	H	α-helix	trans	-55.7	-44.5	174	-57.3	0	0	0	0	112	L769 N770 R775 I776 L777 E865 M866	L769-S773 WeakPolarHBondContact O-CB 3.43Å; L769-S773 PolarHBondContact O-N 3.31Å; L769-S773 VanDerWaalsContact O-N 3.09Å; L769-S773 PolarHBondContact O-OG 3.4Å; N770-S773 WeakPolarHBondContact O-CB 3.3Å; N770-S773 PolarHBondContact O-N 2.94Å; N770-S773 VanDerWaalsContact O-N 3.12Å; S773-R775 VanDerWaalsContact C-N 3.34Å; S773-R775 PolarHBondContact O-N 3.41Å; S773-I776 PolarHBondContact O-N 2.88Å; S773-L777 VanDerWaalsContact O-CB 3.28Å; S773-L777 WeakPolarHBondContact O-CB 3.45Å; S773-L777 PolarHBondContact O-N 2.92Å; S773-E865 WeakPolarHBondContact CA-O 3.24Å; S773-E865 PolarHBondContact OG-O 2.91Å; S773-M866 WeakPolarHBondContact OG-CA 3.49Å; S773-M866 PolarHBondContact OG-N 3.23Å
774	E	77.8	Confident	71.3	Confident	110 Å²	110	67 Å²	67	51%	0.514	30%	0.301	S	S	.	.	H	α-helix	trans	-59.2	-42.1	173.8	-73	178.6	168.1	0	0	112.3	N770 S772 L777 E778	N770-E774 WeakPolarHBondContact O-CG 3.34Å; N770-E774 PolarHBondContact O-N 3.49Å; S772-E774 VanDerWaalsContact C-N 3.29Å; S772-E774 PolarHBondContact O-N 3.43Å; E774-L777 WeakPolarHBondContact O-CB 3.44Å; E774-L777 PolarHBondContact O-N 3.47Å; E774-E778 WeakPolarHBondContact O-CB 3.48Å; E774-E778 PolarHBondContact O-N 2.98Å
775	R	78.9	Confident	72.4	Confident	139 Å²	139	64.6 Å²	64.6	53%	0.525	30%	0.297	S	S	.	.	H	α-helix	trans	-67.2	-40.9	177.6	-75.9	174.6	176.8	177.5	-0.5	113	R771 S772 S773 L777 E778 Q779	R771-R775 WeakPolarHBondContact O-CG 3.33Å; R771-R775 PolarHBondContact O-N 3.44Å; S772-R775 WeakPolarHBondContact O-CB 3.39Å; S772-R775 PolarHBondContact O-N 3.31Å; S773-R775 VanDerWaalsContact C-N 3.34Å; S773-R775 PolarHBondContact O-N 3.41Å; R775-L777 VanDerWaalsContact C-N 3.31Å; R775-E778 PolarHBondContact O-N 3.29Å; R775-Q779 WeakPolarHBondContact O-CB 3.43Å; R775-Q779 VanDerWaalsContact O-CG 3.31Å; R775-Q779 WeakPolarHBondContact O-CG 3.33Å; R775-Q779 PolarHBondContact O-N 2.95Å
776	I	80.1	Confident	73.6	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.3	-44.4	176	-55.4	-166.1	0	0	0	109.3	S772 S773 Q779 L780 F802 Y805 Y809 E865 M866	S772-I776 WeakPolarHBondContact O-CG1 3.45Å; S772-I776 PolarHBondContact O-N 2.96Å; S773-I776 PolarHBondContact O-N 2.88Å; I776-Q779 PolarHBondContact O-N 3.25Å; I776-L780 HydrophobicContact CG2-CD1 3.93Å; I776-L780 HydrophobicContact CG2-CG 4.36Å; I776-L780 WeakPolarHBondContact O-CB 3.44Å; I776-L780 WeakPolarHBondContact O-CG 3.3Å; I776-L780 PolarHBondContact O-N 2.9Å; I776-F802 HydrophobicContact CG2-CD2 4.32Å; I776-F802 HydrophobicContact CG2-CE2 4Å; I776-F802 HydrophobicContact CG2-CZ 4.15Å; I776-Y805 HydrophobicContact CD1-CD2 3.47Å; I776-Y805 VanDerWaalsContact CD1-CD2 3.47Å; I776-Y805 HydrophobicContact CD1-CE1 4.33Å; I776-Y805 HydrophobicContact CD1-CE2 3.21Å; I776-Y805 HydrophobicContact CD1-CG 4.16Å; I776-Y805 HydrophobicContact CG1-CD2 4.2Å; I776-Y805 HydrophobicContact CG1-CE2 3.48Å; I776-Y805 VanDerWaalsContact CG1-CE2 3.48Å; I776-Y809 HydrophobicContact CD1-CE1 4.16Å; I776-Y809 HydrophobicContact CD1-CE2 4.41Å; I776-Y809 VanDerWaalsContact CD1-OH 3.32Å; I776-Y809 WeakPolarHBondContact CD1-OH 3.49Å; I776-Y809 HydrophobicContact CG2-CD1 4.09Å; I776-Y809 HydrophobicContact CG2-CE1 4Å; I776-Y809 HydrophobicContact CG2-CE2 4.45Å; I776-Y809 HydrophobicContact CG2-CG 4.39Å; I776-E865 HydrophobicContact CD1-CB 3.83Å; I776-E865 WeakPolarHBondContact CD1-O 3.45Å; I776-M866 HydrophobicContact CB-CE 3.65Å; I776-M866 HydrophobicContact CG2-CE 3.56Å
777	L	84.4	Confident	74.6	Confident	15 Å²	15	67.4 Å²	67.4	8%	0.079	31%	0.314	C	S	.	.	H	α-helix	trans	-57.7	-50.2	176.8	178.1	65.1	0	0	0	111.1	S773 E774 R775 Q779 L780 L781 Y832 L834 P835 I851 M866	S773-L777 VanDerWaalsContact O-CB 3.28Å; S773-L777 WeakPolarHBondContact O-CB 3.45Å; S773-L777 PolarHBondContact O-N 2.92Å; E774-L777 WeakPolarHBondContact O-CB 3.44Å; E774-L777 PolarHBondContact O-N 3.47Å; R775-L777 VanDerWaalsContact C-N 3.31Å; L777-Q779 PolarHBondContact O-N 2.98Å; L777-L780 PolarHBondContact O-N 3.39Å; L777-L781 HydrophobicContact CD1-CD1 3.62Å; L777-L781 HydrophobicContact CD1-CG 3.96Å; L777-L781 HydrophobicContact CD2-CD1 4.49Å; L777-L781 HydrophobicContact CG-CD1 3.76Å; L777-L781 HydrophobicContact CG-CG 4.38Å; L777-L781 WeakPolarHBondContact O-CB 3.47Å; L777-L781 WeakPolarHBondContact O-CG 3.45Å; L777-L781 PolarHBondContact O-N 3.39Å; L777-Y832 HydrophobicContact CD2-CE1 4.48Å; L777-L834 HydrophobicContact CD1-CD2 3.34Å; L777-P835 HydrophobicContact CD2-CG 3.56Å; L777-I851 HydrophobicContact CD1-CD1 3.42Å; L777-I851 VanDerWaalsContact CD1-CD1 3.42Å; L777-M866 HydrophobicContact CB-CE 4.08Å
778	E	85.1	Confident	75.5	Confident	125 Å²	125	68.5 Å²	68.5	58%	0.584	33%	0.329	S	S	*	.	H	α-helix	trans	-57	-47.6	177.2	-173.7	-176.7	-169.9	0	0	111.4	E774 R775 L780 L781 L782	E774-E778 WeakPolarHBondContact O-CB 3.48Å; E774-E778 PolarHBondContact O-N 2.98Å; R775-E778 PolarHBondContact O-N 3.29Å; E778-L780 VanDerWaalsContact C-N 3.34Å; E778-L780 PolarHBondContact O-N 2.83Å; E778-L781 PolarHBondContact O-N 2.98Å; E778-L782 WeakPolarHBondContact O-CB 3.48Å; E778-L782 PolarHBondContact O-N 3.07Å
779	Q	84.8	Confident	76.2	Confident	105 Å²	105	66 Å²	66	49%	0.491	32%	0.322	S	S	.	.	H	α-helix	trans	-67.3	-32.8	-179.8	-71.2	-178.4	1.1	0	0	113.5	R775 I776 L777 F802	R775-Q779 WeakPolarHBondContact O-CB 3.43Å; R775-Q779 VanDerWaalsContact O-CG 3.31Å; R775-Q779 WeakPolarHBondContact O-CG 3.33Å; R775-Q779 PolarHBondContact O-N 2.95Å; I776-Q779 PolarHBondContact O-N 3.25Å; L777-Q779 PolarHBondContact O-N 2.98Å; Q779-F802 HydrophobicContact CB-CE1 3.6Å; Q779-F802 HydrophobicContact CB-CZ 3.94Å; Q779-F802 HydrophobicContact CG-CE1 4.46Å
780	L	85.3	Confident	77.2	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-67.6	-46.1	173	-82.9	171.4	0	0	0	111	I776 L777 E778 F784 Q800 F802 Y809 I811 I851 M866	I776-L780 HydrophobicContact CG2-CD1 3.93Å; I776-L780 HydrophobicContact CG2-CG 4.36Å; I776-L780 WeakPolarHBondContact O-CB 3.44Å; I776-L780 WeakPolarHBondContact O-CG 3.3Å; I776-L780 PolarHBondContact O-N 2.9Å; L777-L780 PolarHBondContact O-N 3.39Å; E778-L780 VanDerWaalsContact C-N 3.34Å; E778-L780 PolarHBondContact O-N 2.83Å; L780-F784 WeakPolarHBondContact O-CD2 3.23Å; L780-Q800 HydrophobicContact CD2-CB 3.73Å; L780-Q800 HydrophobicContact CD2-CG 4.35Å; L780-F802 HydrophobicContact CD1-CE2 4.26Å; L780-F802 HydrophobicContact CD2-CE2 3.54Å; L780-F802 HydrophobicContact CD2-CZ 3.88Å; L780-F802 HydrophobicContact CG-CE2 3.62Å; L780-F802 HydrophobicContact CG-CZ 3.68Å; L780-Y809 HydrophobicContact CD1-CD1 4.38Å; L780-Y809 HydrophobicContact CD1-CG 4.35Å; L780-I811 HydrophobicContact CB-CD1 4.11Å; L780-I811 HydrophobicContact CB-CG1 4.4Å; L780-I811 HydrophobicContact CD2-CD1 4.05Å; L780-I811 HydrophobicContact CD2-CG1 4.09Å; L780-I851 HydrophobicContact CD1-CD1 3.72Å; L780-I851 HydrophobicContact CD1-CG1 4.36Å; L780-I851 HydrophobicContact CD1-CG2 3.81Å; L780-M866 HydrophobicContact CD1-CE 4.07Å
781	L	84.1	Confident	78	Confident	17 Å²	17	69.2 Å²	69.2	9%	0.089	34%	0.336	C	S	.	.	H	α-helix	trans	-74.8	-26.4	-176.3	-66.1	178.1	0	0	0	113.3	L777 E778 R783 F784 T785 L834 V838 V840	L777-L781 HydrophobicContact CD1-CD1 3.62Å; L777-L781 HydrophobicContact CD1-CG 3.96Å; L777-L781 HydrophobicContact CD2-CD1 4.49Å; L777-L781 HydrophobicContact CG-CD1 3.76Å; L777-L781 HydrophobicContact CG-CG 4.38Å; L777-L781 WeakPolarHBondContact O-CB 3.47Å; L777-L781 WeakPolarHBondContact O-CG 3.45Å; L777-L781 PolarHBondContact O-N 3.39Å; E778-L781 PolarHBondContact O-N 2.98Å; L781-R783 PolarHBondContact O-N 3.19Å; L781-R783 VanDerWaalsContact O-N 3.07Å; L781-F784 CarbonylContact O-C 3.57Å; L781-F784 WeakPolarHBondContact O-CA 3.4Å; L781-F784 PolarHBondContact O-N 3Å; L781-T785 PolarHBondContact O-N 3.33Å; L781-T785 PolarHBondContact O-OG1 2.94Å; L781-L834 HydrophobicContact CD2-CD2 4.42Å; L781-V838 HydrophobicContact CD1-CB 4.22Å; L781-V838 HydrophobicContact CD1-CG1 3.54Å; L781-V838 HydrophobicContact CD1-CG2 3.56Å; L781-V838 HydrophobicContact CD2-CG1 3.49Å; L781-V838 VanDerWaalsContact CD2-CG1 3.49Å; L781-V838 HydrophobicContact CG-CG1 4.16Å; L781-V840 HydrophobicContact CD2-CG2 3.66Å
782	L	83.5	Confident	79	Confident	93 Å²	93	67.6 Å²	67.6	49%	0.487	33%	0.332	S	S	.	.	H	α-helix	trans	-54	-32.7	178.2	-158.8	100.4	0	0	0	112.5	E778 F784 T785 D786	E778-L782 WeakPolarHBondContact O-CB 3.48Å; E778-L782 PolarHBondContact O-N 3.07Å; L782-F784 PolarHBondContact O-N 3.3Å; L782-T785 VanDerWaalsContact CA-OG1 3.28Å; L782-T785 WeakPolarHBondContact CA-OG1 3.48Å; L782-T785 PolarHBondContact O-OG1 2.94Å; L782-D786 PolarHBondContact O-N 3.09Å
783	R	75	Confident	79.9	Confident	133 Å²	133	67.2 Å²	67.2	50%	0.502	33%	0.33	S	S	.	.	H	α-helix	trans	-68.9	-19.5	175.9	-80.1	-172.5	166	-163.1	-3.6	114.3	L781 G787	L781-R783 PolarHBondContact O-N 3.19Å; L781-R783 VanDerWaalsContact O-N 3.07Å; R783-G787 WeakPolarHBondContact O-CA 3.34Å; R783-G787 PolarHBondContact O-N 3.49Å
784	F	78.4	Confident	80.6	Confident	2 Å²	2	67 Å²	67	1%	0.009	33%	0.328	C	S	.	.	H	α-helix	trans	-105.8	-22	-179.4	-63.4	-88.8	0	0	0	111.8	L780 L781 L782 P790 W791 K792 V793 N797 I811 V840	L780-F784 WeakPolarHBondContact O-CD2 3.23Å; L781-F784 CarbonylContact O-C 3.57Å; L781-F784 WeakPolarHBondContact O-CA 3.4Å; L781-F784 PolarHBondContact O-N 3Å; L782-F784 PolarHBondContact O-N 3.3Å; F784-P790 CarbonylContact O-C 3.59Å; F784-P790 VanDerWaalsContact O-CA 3.22Å; F784-P790 WeakPolarHBondContact O-CA 3.47Å; F784-W791 PolarHBondContact O-N 3.35Å; F784-K792 WeakPolarHBondContact CE1-O 3.43Å; F784-V793 HydrophobicContact CD1-CG2 3.96Å; F784-V793 HydrophobicContact CE1-CB 4.19Å; F784-V793 HydrophobicContact CE1-CG2 3.34Å; F784-V793 HydrophobicContact CZ-CG2 3.75Å; F784-N797 WeakPolarHBondContact CE1-ND2 3.35Å; F784-N797 HydrophobicContact CZ-CB 4.43Å; F784-I811 HydrophobicContact CD2-CD1 3.71Å; F784-I811 HydrophobicContact CE2-CD1 3.06Å; F784-I811 HydrophobicContact CE2-CG1 4.45Å; F784-I811 HydrophobicContact CZ-CD1 3.77Å; F784-V840 HydrophobicContact CB-CG2 4.29Å; F784-V840 HydrophobicContact CD1-CG1 4.24Å; F784-V840 HydrophobicContact CG-CG1 4.42Å
785	T	77.3	Confident	81	Confident	54 Å²	54	67.6 Å²	67.6	33%	0.331	33%	0.331	S	S	.	.	H	α-helix	trans	-78.2	-48.6	170.7	54.9	0	0	0	0	111.1	L781 L782 W791	L781-T785 PolarHBondContact O-N 3.33Å; L781-T785 PolarHBondContact O-OG1 2.94Å; L782-T785 VanDerWaalsContact CA-OG1 3.28Å; L782-T785 WeakPolarHBondContact CA-OG1 3.48Å; L782-T785 PolarHBondContact O-OG1 2.94Å; T785-W791 HydrophobicContact CG2-CH2 3.39Å; T785-W791 HydrophobicContact CG2-CZ2 3.73Å; T785-W791 HydrophobicContact CG2-CZ3 4.01Å
786	D	74.7	Confident	81.3	Confident	130 Å²	130	67.4 Å²	67.4	70%	0.695	33%	0.331	S	S	*	.	S	Bend	trans	-116.1	1.6	-170.2	-60	-38.8	0	0	0	113.7	L782	L782-D786 PolarHBondContact O-N 3.09Å
787	G	71.5	Confident	81.5	Confident	21 Å²	21	68.4 Å²	68.4	22%	0.216	34%	0.336	C	S	.	.	S	Bend	trans	-87	174.6	-177.5	0	0	0	0	0	114.8	R783 F789	R783-G787 WeakPolarHBondContact O-CA 3.34Å; R783-G787 PolarHBondContact O-N 3.49Å; G787-F789 PolarHBondContact O-N 3.4Å; G787-F789 VanDerWaalsContact O-N 3.12Å
788	P	74.3	Confident	81.7	Confident	117 Å²	117	67.9 Å²	67.9	76%	0.76	33%	0.334	S	S	*	.	S	Bend	trans	-67.5	-12.6	-177.1	26.7	-34.3	0	0	0	114.3	P790	P788-P790 WeakPolarHBondContact O-CD 3.49Å
789	F	70.5	Confident	82	Confident	94 Å²	94	64.6 Å²	64.6	41%	0.412	32%	0.318	S	S	.	.	S	Bend	trans	-124	74.4	178.5	-59	-76.3	0	0	0	108.8	G787 W791 K792 Y796	G787-F789 PolarHBondContact O-N 3.4Å; G787-F789 VanDerWaalsContact O-N 3.12Å; F789-W791 PolarHBondContact O-N 3.01Å; F789-W791 VanDerWaalsContact O-N 3.16Å; F789-K792 PolarHBondContact O-N 2.91Å; F789-Y796 HydrophobicContact CD1-CE2 4.44Å; F789-Y796 VanDerWaalsContact CD1-OH 3.24Å; F789-Y796 WeakPolarHBondContact CD1-OH 3.49Å; F789-Y796 AromaticContact CD2-CE2 3.75Å; F789-Y796 HydrophobicContact CD2-CE2 3.75Å; F789-Y796 HydrophobicContact CE1-CE2 4.29Å; F789-Y796 VanDerWaalsContact CE1-OH 3.3Å; F789-Y796 WeakPolarHBondContact CE1-OH 2.98Å; F789-Y796 AromaticContact CE2-CE2 3.6Å; F789-Y796 HydrophobicContact CE2-CE2 3.6Å; F789-Y796 HydrophobicContact CG-CE2 4.18Å; F789-Y796 AromaticContact CZ-CE2 3.88Å; F789-Y796 HydrophobicContact CZ-CE2 3.88Å
790	P	77.8	Confident	82.2	Confident	74 Å²	74	61.1 Å²	61.1	48%	0.481	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	124.7	-174.4	24.1	-33	0	0	0	109.5	F784 P788 K792	F784-P790 CarbonylContact O-C 3.59Å; F784-P790 VanDerWaalsContact O-CA 3.22Å; F784-P790 WeakPolarHBondContact O-CA 3.47Å; P788-P790 WeakPolarHBondContact O-CD 3.49Å; P790-K792 PolarHBondContact O-N 3.38Å
791	W	80.9	Confident	82.3	Confident	99 Å²	99	64.9 Å²	64.9	38%	0.375	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	4.9	173.8	-48.1	103.3	0	0	0	117.4	F784 T785 F789 V840 S841	F784-W791 PolarHBondContact O-N 3.35Å; T785-W791 HydrophobicContact CG2-CH2 3.39Å; T785-W791 HydrophobicContact CG2-CZ2 3.73Å; T785-W791 HydrophobicContact CG2-CZ3 4.01Å; F789-W791 PolarHBondContact O-N 3.01Å; F789-W791 VanDerWaalsContact O-N 3.16Å; W791-V840 HydrophobicContact CE3-CG2 3.86Å; W791-V840 HydrophobicContact CZ3-CG2 4.19Å; W791-S841 PolarHBondContact O-N 2.95Å; W791-S841 VanDerWaalsContact O-O 3.11Å; W791-S841 PolarHBondContact O-OG 3.36Å
792	K	89.7	Confident	82.2	Confident	80 Å²	80	64.5 Å²	64.5	35%	0.348	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117.3	-179.7	-69.1	-156.4	170.7	-140.6	0	113.3	F784 F789 P790 N797 S841 E843 D845	F784-K792 WeakPolarHBondContact CE1-O 3.43Å; F789-K792 PolarHBondContact O-N 2.91Å; P790-K792 PolarHBondContact O-N 3.38Å; K792-N797 PolarHBondContact O-ND2 3.31Å; K792-S841 CarbonylContact C-O 3.58Å; K792-S841 WeakPolarHBondContact CA-O 3.41Å; K792-E843 PolarHBondContact NZ-O 3.43Å; K792-D845 WeakPolarHBondContact CE-OD1 3.49Å; K792-D845 IonicContact NZ-OD1 3.3Å; K792-D845 PolarHBondContact NZ-OD1 2.94Å
793	V	89.2	Confident	81.7	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	120.1	175.5	177.6	0	0	0	0	110.2	F784 I811 Y815 V840 S841 Y842 E843 V848	F784-V793 HydrophobicContact CD1-CG2 3.96Å; F784-V793 HydrophobicContact CE1-CB 4.19Å; F784-V793 HydrophobicContact CE1-CG2 3.34Å; F784-V793 HydrophobicContact CZ-CG2 3.75Å; V793-I811 WeakPolarHBondContact CG1-O 3.44Å; V793-I811 HydrophobicContact CG2-CB 4.37Å; V793-I811 HydrophobicContact CG2-CG2 3.65Å; V793-Y815 HydrophobicContact CG1-CD2 4.09Å; V793-Y815 HydrophobicContact CG1-CE2 4.24Å; V793-Y815 WeakPolarHBondContact O-CE2 3.28Å; V793-V840 HydrophobicContact CB-CG1 4.5Å; V793-V840 HydrophobicContact CG2-CG1 3.25Å; V793-S841 PolarHBondContact N-O 3.34Å; V793-Y842 HydrophobicContact CB-CD1 3.99Å; V793-Y842 HydrophobicContact CB-CE1 4.38Å; V793-Y842 HydrophobicContact CG1-CD1 3.92Å; V793-Y842 HydrophobicContact CG1-CE1 3.93Å; V793-Y842 CarbonylContact O-C 3.58Å; V793-Y842 WeakPolarHBondContact O-CA 3.37Å; V793-E843 PolarHBondContact O-N 3.42Å; V793-E843 VanDerWaalsContact O-N 3.16Å; V793-V848 HydrophobicContact CB-CG2 4.27Å; V793-V848 HydrophobicContact CG2-CG2 4.09Å
794	G	89	Confident	81.6	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.331	C	S	.	.			trans	-117.2	175.1	169.9	0	0	0	0	0	111.7	Y796 N797 T798 Y815 E843	G794-Y796 PolarHBondContact O-N 2.79Å; G794-Y796 VanDerWaalsContact O-N 3.17Å; G794-N797 PolarHBondContact N-OD1 2.89Å; G794-N797 PolarHBondContact O-N 3.5Å; G794-N797 PolarHBondContact O-OD1 3.43Å; G794-T798 PolarHBondContact O-N 3.05Å; G794-T798 VanDerWaalsContact O-N 3.12Å; G794-Y815 VanDerWaalsContact CA-CE2 3.48Å; G794-E843 WeakPolarHBondContact CA-OE1 3.48Å
795	Q	87.3	Confident	81.3	Confident	121 Å²	121	68.4 Å²	68.4	57%	0.565	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-27.1	179.5	-169.3	177.8	3.8	0	0	112.7	Y815	Q795-Y815 HydrophobicContact CB-CD1 3.59Å; Q795-Y815 HydrophobicContact CB-CE1 3.82Å; Q795-Y815 HydrophobicContact CB-CG 4.07Å; Q795-Y815 HydrophobicContact CG-CD1 3.95Å; Q795-Y815 HydrophobicContact CG-CG 4.41Å
796	Y	84.4	Confident	81.1	Confident	135 Å²	135	71.4 Å²	71.4	53%	0.529	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-16.5	-175.2	58.5	-94.3	0	0	0	114.2	F789 G794 E843	F789-Y796 HydrophobicContact CD1-CE2 4.44Å; F789-Y796 VanDerWaalsContact CD1-OH 3.24Å; F789-Y796 WeakPolarHBondContact CD1-OH 3.49Å; F789-Y796 AromaticContact CD2-CE2 3.75Å; F789-Y796 HydrophobicContact CD2-CE2 3.75Å; F789-Y796 HydrophobicContact CE1-CE2 4.29Å; F789-Y796 VanDerWaalsContact CE1-OH 3.3Å; F789-Y796 WeakPolarHBondContact CE1-OH 2.98Å; F789-Y796 AromaticContact CE2-CE2 3.6Å; F789-Y796 HydrophobicContact CE2-CE2 3.6Å; F789-Y796 HydrophobicContact CG-CE2 4.18Å; F789-Y796 AromaticContact CZ-CE2 3.88Å; F789-Y796 HydrophobicContact CZ-CE2 3.88Å; G794-Y796 PolarHBondContact O-N 2.79Å; G794-Y796 VanDerWaalsContact O-N 3.17Å; Y796-E843 VanDerWaalsContact CE1-OE1 3.26Å; Y796-E843 WeakPolarHBondContact CE1-OE1 3.31Å
797	N	84.2	Confident	81.4	Confident	21 Å²	21	68.7 Å²	68.7	11%	0.112	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-1.6	-177.9	68.7	-5.9	0	0	0	114.1	F784 K792 G794 K799	F784-N797 WeakPolarHBondContact CE1-ND2 3.35Å; F784-N797 HydrophobicContact CZ-CB 4.43Å; K792-N797 PolarHBondContact O-ND2 3.31Å; G794-N797 PolarHBondContact N-OD1 2.89Å; G794-N797 PolarHBondContact O-N 3.5Å; G794-N797 PolarHBondContact O-OD1 3.43Å; N797-K799 VanDerWaalsContact C-N 3.28Å; N797-K799 PolarHBondContact O-N 2.86Å
798	T	88.8	Confident	82.2	Confident	5 Å²	5	71.4 Å²	71.4	3%	0.031	34%	0.335	C	S	.	.	S	Bend	trans	-60.7	-32.6	178.3	-178.6	0	0	0	0	113.4	G794 W810 I811 Y815	G794-T798 PolarHBondContact O-N 3.05Å; G794-T798 VanDerWaalsContact O-N 3.12Å; T798-W810 CarbonylContact O-C 3.58Å; T798-W810 VanDerWaalsContact O-CA 3.25Å; T798-W810 WeakPolarHBondContact O-CA 3.48Å; T798-I811 PolarHBondContact O-N 3.33Å; T798-I811 PolarHBondContact OG1-O 2.94Å; T798-Y815 HydrophobicContact CG2-CD2 4.49Å; T798-Y815 HydrophobicContact CG2-CG 4.39Å
799	K	90.9	Very high	82.9	Confident	55 Å²	55	65.9 Å²	65.9	24%	0.239	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	133.8	-168.2	-173.4	-167.8	-156.4	159.5	0	112.1	N797 Y808 Y809 W810 D819 D821	N797-K799 VanDerWaalsContact C-N 3.28Å; N797-K799 PolarHBondContact O-N 2.86Å; K799-Y808 HydrophobicContact CD-CD1 3.87Å; K799-Y808 HydrophobicContact CD-CE1 4.18Å; K799-Y808 HydrophobicContact CD-CG 4.45Å; K799-Y808 VanDerWaalsContact CE-CG 3.44Å; K799-Y808 HydrophobicContact CG-CD1 3.87Å; K799-Y808 HydrophobicContact CG-CG 4.44Å; K799-Y809 CarbonylContact C-O 3.58Å; K799-Y809 WeakPolarHBondContact CA-O 3.47Å; K799-W810 HydrophobicContact CD-CZ2 4.44Å; K799-W810 HydrophobicContact CG-CD2 4.47Å; K799-W810 HydrophobicContact CG-CZ2 4.42Å; K799-D819 WeakPolarHBondContact CD-OD2 3.5Å; K799-D819 WeakPolarHBondContact CE-OD2 3.42Å; K799-D819 IonicContact NZ-OD1 3.77Å; K799-D819 PolarHBondContact NZ-OD1 3.5Å; K799-D819 IonicContact NZ-OD2 2.71Å; K799-D819 PolarHBondContact NZ-OD2 2.8Å; K799-D821 IonicContact NZ-OD2 2.89Å; K799-D821 PolarHBondContact NZ-OD2 3.37Å
800	Q	88.9	Confident	84	Confident	33 Å²	33	61.4 Å²	61.4	15%	0.154	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	134.4	171.7	-174.3	161.2	-10.9	0	0	111.4	L780 F802 Y808 Y809	L780-Q800 HydrophobicContact CD2-CB 3.73Å; L780-Q800 HydrophobicContact CD2-CG 4.35Å; Q800-F802 HydrophobicContact CB-CE2 4.08Å; Q800-F802 HydrophobicContact CG-CD2 4.26Å; Q800-F802 HydrophobicContact CG-CE2 3.73Å; Q800-F802 HydrophobicContact CG-CZ 3.93Å; Q800-Y808 WeakPolarHBondContact O-CA 3.39Å; Q800-Y809 PolarHBondContact N-O 3.46Å; Q800-Y809 PolarHBondContact O-N 3.39Å
801	F	87.4	Confident	84.6	Confident	79 Å²	79	58 Å²	58	35%	0.346	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	132.4	171.8	-173.7	-112.3	0	0	0	109.8	P803 N806 R807 Y808	F801-P803 HydrophobicContact CD1-CG 3.98Å; F801-P803 HydrophobicContact CE1-CB 4.13Å; F801-P803 HydrophobicContact CE1-CG 4.01Å; F801-N806 WeakPolarHBondContact CZ-OD1 3.34Å; F801-R807 WeakPolarHBondContact CD2-O 3.34Å; F801-Y808 HydrophobicContact CB-CD1 3.67Å; F801-Y808 HydrophobicContact CB-CE1 3.54Å; F801-Y808 AromaticContact CD2-CD1 3.73Å; F801-Y808 HydrophobicContact CD2-CD1 3.73Å; F801-Y808 HydrophobicContact CD2-CD2 4.16Å; F801-Y808 AromaticContact CD2-CE1 3.64Å; F801-Y808 HydrophobicContact CD2-CE1 3.64Å; F801-Y808 HydrophobicContact CD2-CE2 4.05Å; F801-Y808 HydrophobicContact CD2-CG 4.02Å; F801-Y808 AromaticContact CD2-CZ 3.78Å; F801-Y808 HydrophobicContact CE2-CE2 4.45Å; F801-Y808 HydrophobicContact CG-CD1 4.17Å; F801-Y808 AromaticContact CG-CE1 3.92Å; F801-Y808 HydrophobicContact CG-CE1 3.92Å
802	F	82.6	Confident	85	Confident	8 Å²	8	53.2 Å²	53.2	4%	0.035	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	106.7	170.6	-73	-87.5	0	0	0	109.5	I776 Q779 L780 Q800 R804 Y805 N806 R807 Y809	I776-F802 HydrophobicContact CG2-CD2 4.32Å; I776-F802 HydrophobicContact CG2-CE2 4Å; I776-F802 HydrophobicContact CG2-CZ 4.15Å; Q779-F802 HydrophobicContact CB-CE1 3.6Å; Q779-F802 HydrophobicContact CB-CZ 3.94Å; Q779-F802 HydrophobicContact CG-CE1 4.46Å; L780-F802 HydrophobicContact CD1-CE2 4.26Å; L780-F802 HydrophobicContact CD2-CE2 3.54Å; L780-F802 HydrophobicContact CD2-CZ 3.88Å; L780-F802 HydrophobicContact CG-CE2 3.62Å; L780-F802 HydrophobicContact CG-CZ 3.68Å; Q800-F802 HydrophobicContact CB-CE2 4.08Å; Q800-F802 HydrophobicContact CG-CD2 4.26Å; Q800-F802 HydrophobicContact CG-CE2 3.73Å; Q800-F802 HydrophobicContact CG-CZ 3.93Å; F802-R804 VanDerWaalsContact C-N 3.25Å; F802-R804 PolarHBondContact O-N 3.39Å; F802-Y805 HydrophobicContact CB-CD2 3.44Å; F802-Y805 VanDerWaalsContact CB-CD2 3.44Å; F802-Y805 HydrophobicContact CB-CE2 4.11Å; F802-Y805 HydrophobicContact CB-CG 4.39Å; F802-Y805 HydrophobicContact CD1-CE2 4.46Å; F802-Y805 HydrophobicContact CG-CD2 4.1Å; F802-Y805 HydrophobicContact CG-CE2 4.42Å; F802-Y805 CarbonylContact O-C 3.6Å; F802-Y805 PolarHBondContact O-N 3.07Å; F802-N806 PolarHBondContact O-N 3.43Å; F802-R807 PolarHBondContact N-O 3.22Å; F802-R807 PolarHBondContact O-N 3.28Å; F802-Y809 HydrophobicContact CB-CD2 4.47Å; F802-Y809 HydrophobicContact CB-CE2 4.26Å; F802-Y809 AromaticContact CD2-CD2 3.4Å; F802-Y809 HydrophobicContact CD2-CD2 3.4Å; F802-Y809 VanDerWaalsContact CD2-CD2 3.4Å; F802-Y809 AromaticContact CD2-CE2 3.88Å; F802-Y809 HydrophobicContact CD2-CE2 3.88Å; F802-Y809 HydrophobicContact CD2-CG 4.09Å; F802-Y809 HydrophobicContact CE2-CD2 4.03Å; F802-Y809 HydrophobicContact CE2-CG 4.27Å; F802-Y809 HydrophobicContact CG-CD2 4.32Å; F802-Y809 HydrophobicContact CG-CE2 4.4Å
803	P	73.8	Confident	85.1	Confident	101 Å²	101	53 Å²	53	66%	0.656	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-58.3	-37.1	-177.5	-25.3	33.6	0	0	0	113.2	F801 Y805 N806	F801-P803 HydrophobicContact CD1-CG 3.98Å; F801-P803 HydrophobicContact CE1-CB 4.13Å; F801-P803 HydrophobicContact CE1-CG 4.01Å; P803-Y805 PolarHBondContact O-N 3.26Å; P803-N806 PolarHBondContact O-N 3.03Å; P803-N806 VanDerWaalsContact O-N 3.09Å
804	R	71.5	Confident	85.1	Confident	176 Å²	176	56.9 Å²	56.9	66%	0.664	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-55.3	-34.9	177.1	-176	176.5	173.2	161.7	2.2	112.3	F802	F802-R804 VanDerWaalsContact C-N 3.25Å; F802-R804 PolarHBondContact O-N 3.39Å
805	Y	72	Confident	85.3	Confident	33 Å²	33	58.2 Å²	58.2	13%	0.129	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-103	-6.5	-178.6	-49.1	-54.3	0	0	0	112.9	I776 F802 P803 R807 Y809 E865	I776-Y805 HydrophobicContact CD1-CD2 3.47Å; I776-Y805 VanDerWaalsContact CD1-CD2 3.47Å; I776-Y805 HydrophobicContact CD1-CE1 4.33Å; I776-Y805 HydrophobicContact CD1-CE2 3.21Å; I776-Y805 HydrophobicContact CD1-CG 4.16Å; I776-Y805 HydrophobicContact CG1-CD2 4.2Å; I776-Y805 HydrophobicContact CG1-CE2 3.48Å; I776-Y805 VanDerWaalsContact CG1-CE2 3.48Å; F802-Y805 HydrophobicContact CB-CD2 3.44Å; F802-Y805 VanDerWaalsContact CB-CD2 3.44Å; F802-Y805 HydrophobicContact CB-CE2 4.11Å; F802-Y805 HydrophobicContact CB-CG 4.39Å; F802-Y805 HydrophobicContact CD1-CE2 4.46Å; F802-Y805 HydrophobicContact CG-CD2 4.1Å; F802-Y805 HydrophobicContact CG-CE2 4.42Å; F802-Y805 CarbonylContact O-C 3.6Å; F802-Y805 PolarHBondContact O-N 3.07Å; P803-Y805 PolarHBondContact O-N 3.26Å; Y805-R807 VanDerWaalsContact O-CG 3.28Å; Y805-R807 WeakPolarHBondContact O-CG 3.3Å; Y805-R807 PolarHBondContact O-N 3.37Å; Y805-Y809 HydrophobicContact CD2-CE2 4.22Å; Y805-E865 HydrophobicContact CE1-CB 4.3Å; Y805-E865 HydrophobicContact CE1-CG 4.2Å; Y805-E865 WeakPolarHBondContact CE1-OE2 3.36Å; Y805-E865 PolarHBondContact OH-OE2 3.49Å
806	N	74.4	Confident	85.4	Confident	117 Å²	117	53.3 Å²	53.3	63%	0.626	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.1	41.3	-172.9	-167.6	22	0	0	0	112.5	F801 F802 P803	F801-N806 WeakPolarHBondContact CZ-OD1 3.34Å; F802-N806 PolarHBondContact O-N 3.43Å; P803-N806 PolarHBondContact O-N 3.03Å; P803-N806 VanDerWaalsContact O-N 3.09Å
807	R	80.7	Confident	85.6	Confident	74 Å²	74	52.5 Å²	52.5	28%	0.279	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	151.5	-172.8	-77	172.5	-160.9	168.3	2.1	111.5	F801 F802 Y805 Y809 C862	F801-R807 WeakPolarHBondContact CD2-O 3.34Å; F802-R807 PolarHBondContact N-O 3.22Å; F802-R807 PolarHBondContact O-N 3.28Å; Y805-R807 VanDerWaalsContact O-CG 3.28Å; Y805-R807 WeakPolarHBondContact O-CG 3.3Å; Y805-R807 PolarHBondContact O-N 3.37Å; R807-Y809 HydrophobicContact CB-CD2 4.49Å; R807-Y809 HydrophobicContact CB-CE2 3.92Å; R807-C862 PolarHBondContact NH1-SG 3.42Å
808	Y	87.6	Confident	85.9	Confident	77 Å²	77	57.9 Å²	57.9	30%	0.302	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	140.1	169.6	-67.2	-75.9	0	0	0	109.8	K799 Q800 F801 W810 D821 F853	K799-Y808 HydrophobicContact CD-CD1 3.87Å; K799-Y808 HydrophobicContact CD-CE1 4.18Å; K799-Y808 HydrophobicContact CD-CG 4.45Å; K799-Y808 VanDerWaalsContact CE-CG 3.44Å; K799-Y808 HydrophobicContact CG-CD1 3.87Å; K799-Y808 HydrophobicContact CG-CG 4.44Å; Q800-Y808 WeakPolarHBondContact O-CA 3.39Å; F801-Y808 HydrophobicContact CB-CD1 3.67Å; F801-Y808 HydrophobicContact CB-CE1 3.54Å; F801-Y808 AromaticContact CD2-CD1 3.73Å; F801-Y808 HydrophobicContact CD2-CD1 3.73Å; F801-Y808 HydrophobicContact CD2-CD2 4.16Å; F801-Y808 AromaticContact CD2-CE1 3.64Å; F801-Y808 HydrophobicContact CD2-CE1 3.64Å; F801-Y808 HydrophobicContact CD2-CE2 4.05Å; F801-Y808 HydrophobicContact CD2-CG 4.02Å; F801-Y808 AromaticContact CD2-CZ 3.78Å; F801-Y808 HydrophobicContact CE2-CE2 4.45Å; F801-Y808 HydrophobicContact CG-CD1 4.17Å; F801-Y808 AromaticContact CG-CE1 3.92Å; F801-Y808 HydrophobicContact CG-CE1 3.92Å; Y808-W810 HydrophobicContact CG-CH2 4.33Å; Y808-W810 HydrophobicContact CG-CZ2 4.46Å; Y808-W810 WeakPolarHBondContact O-CZ3 3.42Å; Y808-D821 WeakPolarHBondContact CE2-OD2 3.47Å; Y808-F853 WeakPolarHBondContact O-CB 3.44Å
809	Y	90	Very high	85.9	Confident	1 Å²	1	58.7 Å²	58.7	0%	0.004	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	138.4	173	-66.9	-103.6	0	0	0	107.3	I776 L780 K799 Q800 F802 Y805 R807 I851 V852 F853	I776-Y809 HydrophobicContact CD1-CE1 4.16Å; I776-Y809 HydrophobicContact CD1-CE2 4.41Å; I776-Y809 VanDerWaalsContact CD1-OH 3.32Å; I776-Y809 WeakPolarHBondContact CD1-OH 3.49Å; I776-Y809 HydrophobicContact CG2-CD1 4.09Å; I776-Y809 HydrophobicContact CG2-CE1 4Å; I776-Y809 HydrophobicContact CG2-CE2 4.45Å; I776-Y809 HydrophobicContact CG2-CG 4.39Å; L780-Y809 HydrophobicContact CD1-CD1 4.38Å; L780-Y809 HydrophobicContact CD1-CG 4.35Å; K799-Y809 CarbonylContact C-O 3.58Å; K799-Y809 WeakPolarHBondContact CA-O 3.47Å; Q800-Y809 PolarHBondContact N-O 3.46Å; Q800-Y809 PolarHBondContact O-N 3.39Å; F802-Y809 HydrophobicContact CB-CD2 4.47Å; F802-Y809 HydrophobicContact CB-CE2 4.26Å; F802-Y809 AromaticContact CD2-CD2 3.4Å; F802-Y809 HydrophobicContact CD2-CD2 3.4Å; F802-Y809 VanDerWaalsContact CD2-CD2 3.4Å; F802-Y809 AromaticContact CD2-CE2 3.88Å; F802-Y809 HydrophobicContact CD2-CE2 3.88Å; F802-Y809 HydrophobicContact CD2-CG 4.09Å; F802-Y809 HydrophobicContact CE2-CD2 4.03Å; F802-Y809 HydrophobicContact CE2-CG 4.27Å; F802-Y809 HydrophobicContact CG-CD2 4.32Å; F802-Y809 HydrophobicContact CG-CE2 4.4Å; Y805-Y809 HydrophobicContact CD2-CE2 4.22Å; R807-Y809 HydrophobicContact CB-CD2 4.49Å; R807-Y809 HydrophobicContact CB-CE2 3.92Å; Y809-I851 HydrophobicContact CD1-CG2 4.11Å; Y809-V852 CarbonylContact C-O 3.58Å; Y809-V852 WeakPolarHBondContact CA-O 3.41Å; Y809-F853 HydrophobicContact CD1-CB 3.62Å; Y809-F853 HydrophobicContact CD1-CD1 4.2Å; Y809-F853 HydrophobicContact CD1-CG 4.03Å; Y809-F853 HydrophobicContact CE1-CB 3.84Å; Y809-F853 HydrophobicContact CE1-CD1 4.16Å; Y809-F853 HydrophobicContact CE1-CD2 4.37Å; Y809-F853 AromaticContact CE1-CG 3.86Å; Y809-F853 HydrophobicContact CE1-CG 3.86Å; Y809-F853 HydrophobicContact CG-CB 4.1Å
810	W	92	Very high	85.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127.4	180	-66.9	-99.1	0	0	0	108.5	T798 K799 Y808 G812 Y816 D819 D821 I851 V852 Q854	T798-W810 CarbonylContact O-C 3.58Å; T798-W810 VanDerWaalsContact O-CA 3.25Å; T798-W810 WeakPolarHBondContact O-CA 3.48Å; K799-W810 HydrophobicContact CD-CZ2 4.44Å; K799-W810 HydrophobicContact CG-CD2 4.47Å; K799-W810 HydrophobicContact CG-CZ2 4.42Å; Y808-W810 HydrophobicContact CG-CH2 4.33Å; Y808-W810 HydrophobicContact CG-CZ2 4.46Å; Y808-W810 WeakPolarHBondContact O-CZ3 3.42Å; W810-G812 PolarHBondContact O-N 3.19Å; W810-Y816 HydrophobicContact CB-CD2 4.36Å; W810-Y816 AromaticContact CD2-CD2 3.57Å; W810-Y816 HydrophobicContact CD2-CD2 3.57Å; W810-Y816 HydrophobicContact CD2-CE2 4.11Å; W810-Y816 AromaticContact CE2-CD2 3.88Å; W810-Y816 AromaticContact CE3-CD2 3.74Å; W810-Y816 HydrophobicContact CE3-CD2 3.74Å; W810-Y816 AromaticContact CE3-CE2 3.87Å; W810-Y816 HydrophobicContact CE3-CE2 3.87Å; W810-Y816 AromaticContact CG-CD2 3.86Å; W810-Y816 HydrophobicContact CG-CD2 3.86Å; W810-Y816 HydrophobicContact CH2-CD2 4.44Å; W810-Y816 HydrophobicContact CH2-CE2 4.06Å; W810-Y816 HydrophobicContact CZ2-CD2 4.31Å; W810-Y816 HydrophobicContact CZ2-CE2 4.31Å; W810-Y816 HydrophobicContact CZ3-CD2 4.18Å; W810-Y816 AromaticContact CZ3-CE2 3.86Å; W810-Y816 HydrophobicContact CZ3-CE2 3.86Å; W810-D819 HydrophobicContact CZ2-CB 4.49Å; W810-D819 PolarHBondContact NE1-OD2 2.87Å; W810-D821 HydrophobicContact CZ2-CB 4.17Å; W810-I851 CarbonylContact O-C 3.16Å; W810-I851 WeakPolarHBondContact O-CA 3.48Å; W810-V852 HydrophobicContact CB-CB 4.33Å; W810-V852 PolarHBondContact N-O 2.83Å; W810-V852 PolarHBondContact O-N 3.36Å; W810-Q854 HydrophobicContact CH2-CG 4.27Å; W810-Q854 HydrophobicContact CZ3-CB 4.41Å; W810-Q854 HydrophobicContact CZ3-CG 4.11Å
811	I	90.7	Very high	85.5	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	105.5	173	-63.7	163.5	0	0	0	106.3	L780 F784 V793 T798 V840 V848	L780-I811 HydrophobicContact CB-CD1 4.11Å; L780-I811 HydrophobicContact CB-CG1 4.4Å; L780-I811 HydrophobicContact CD2-CD1 4.05Å; L780-I811 HydrophobicContact CD2-CG1 4.09Å; F784-I811 HydrophobicContact CD2-CD1 3.71Å; F784-I811 HydrophobicContact CE2-CD1 3.06Å; F784-I811 HydrophobicContact CE2-CG1 4.45Å; F784-I811 HydrophobicContact CZ-CD1 3.77Å; V793-I811 WeakPolarHBondContact CG1-O 3.44Å; V793-I811 HydrophobicContact CG2-CB 4.37Å; V793-I811 HydrophobicContact CG2-CG2 3.65Å; T798-I811 PolarHBondContact O-N 3.33Å; T798-I811 PolarHBondContact OG1-O 2.94Å; I811-V840 HydrophobicContact CG2-CG1 4.18Å; I811-V848 HydrophobicContact CG2-CG1 3.94Å
812	G	90.4	Very high	85.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.276	C	S	.	.	S	Bend	trans	82.9	148.2	-179.4	0	0	0	0	0	115.6	W810 Y842 V848 E850	W810-G812 PolarHBondContact O-N 3.19Å; G812-Y842 WeakPolarHBondContact CA-OH 3.31Å; G812-V848 VanDerWaalsContact CA-CG1 3.43Å; G812-E850 WeakPolarHBondContact CA-O 3.34Å; G812-E850 PolarHBondContact N-O 2.93Å
813	K	90.5	Very high	85.4	Confident	75 Å²	75	64.6 Å²	64.6	33%	0.326	31%	0.308	S	S	.	.	H	α-helix	trans	-78.9	-22.3	-175.9	-173.7	168.3	180	168.2	0	115.4	Y815 Y816 E831 Y842 E850 V852	K813-Y815 PolarHBondContact O-N 2.66Å; K813-Y816 WeakPolarHBondContact O-CB 3.39Å; K813-Y816 PolarHBondContact O-N 3.46Å; K813-E831 VanDerWaalsContact CE-OE1 3.32Å; K813-E831 WeakPolarHBondContact CE-OE1 3.36Å; K813-E831 IonicContact NZ-OE1 3.45Å; K813-E831 PolarHBondContact NZ-OE1 3.08Å; K813-E831 IonicContact NZ-OE2 3.82Å; K813-Y842 PolarHBondContact N-OH 3.48Å; K813-Y842 VanDerWaalsContact N-OH 3.1Å; K813-E850 WeakPolarHBondContact CB-OE1 3.25Å; K813-E850 WeakPolarHBondContact CD-OE1 3.44Å; K813-V852 HydrophobicContact CB-CG2 3.86Å; K813-V852 HydrophobicContact CG-CG2 4.39Å
814	R	90.7	Very high	85.8	Confident	81 Å²	81	62.8 Å²	62.8	31%	0.306	29%	0.292	S	S	.	.	H	α-helix	trans	-56.4	-48.7	-175.5	-176.2	-177.7	-91.6	-169.4	-8.6	112.8	F818 Y842 D844 E846	R814-F818 WeakPolarHBondContact O-CD2 3.43Å; R814-F818 WeakPolarHBondContact O-CE2 3.15Å; R814-Y842 HydrophobicContact CB-CD1 4.45Å; R814-Y842 HydrophobicContact CB-CE1 3.74Å; R814-Y842 HydrophobicContact CB-CE2 4.09Å; R814-Y842 WeakPolarHBondContact CB-OH 3.49Å; R814-Y842 PolarHBondContact N-OH 3.45Å; R814-Y842 VanDerWaalsContact N-OH 3.12Å; R814-D844 IonicContact CZ-OD1 3.84Å; R814-D844 IonicContact CZ-OD2 3.88Å; R814-D844 VanDerWaalsContact CZ-OD2 3.25Å; R814-D844 IonicContact NH1-OD1 3.42Å; R814-D844 PolarHBondContact NH1-OD1 3.26Å; R814-D844 IonicContact NH1-OD2 2.88Å; R814-D844 PolarHBondContact NH1-OD2 3.23Å; R814-D844 IonicContact NH2-OD1 3.11Å; R814-D844 IonicContact NH2-OD2 3.61Å; R814-D844 PolarHBondContact NH2-OD2 2.9Å; R814-E846 IonicContact CZ-OE2 2.68Å; R814-E846 IonicContact NE-OE2 3.98Å; R814-E846 IonicContact NH2-OE2 3.69Å; R814-E846 PolarHBondContact NH2-OE2 3.49Å
815	Y	91.6	Very high	86.3	Confident	28 Å²	28	58.3 Å²	58.3	11%	0.11	29%	0.293	C	S	.	.	H	α-helix	trans	-90.4	-17.6	-177.6	-61.3	-59.8	0	0	0	113.7	V793 G794 Q795 T798 K813 Q817 F818 D819 Y842	V793-Y815 HydrophobicContact CG1-CD2 4.09Å; V793-Y815 HydrophobicContact CG1-CE2 4.24Å; V793-Y815 WeakPolarHBondContact O-CE2 3.28Å; G794-Y815 VanDerWaalsContact CA-CE2 3.48Å; Q795-Y815 HydrophobicContact CB-CD1 3.59Å; Q795-Y815 HydrophobicContact CB-CE1 3.82Å; Q795-Y815 HydrophobicContact CB-CG 4.07Å; Q795-Y815 HydrophobicContact CG-CD1 3.95Å; Q795-Y815 HydrophobicContact CG-CG 4.41Å; T798-Y815 HydrophobicContact CG2-CD2 4.49Å; T798-Y815 HydrophobicContact CG2-CG 4.39Å; K813-Y815 PolarHBondContact O-N 2.66Å; Y815-Q817 VanDerWaalsContact C-N 3.29Å; Y815-Q817 PolarHBondContact O-N 3.41Å; Y815-F818 HydrophobicContact CD1-CD2 4.35Å; Y815-F818 PolarHBondContact O-N 2.92Å; Y815-F818 VanDerWaalsContact O-N 3.15Å; Y815-D819 PolarHBondContact O-N 2.87Å; Y815-Y842 HydrophobicContact CD2-CD1 4.1Å; Y815-Y842 AromaticContact CD2-CE1 3.96Å; Y815-Y842 HydrophobicContact CD2-CE1 3.96Å; Y815-Y842 AromaticContact CE2-CD1 3.63Å; Y815-Y842 HydrophobicContact CE2-CD1 3.63Å; Y815-Y842 AromaticContact CE2-CE1 3.97Å; Y815-Y842 HydrophobicContact CE2-CE1 3.97Å
816	Y	90.9	Very high	86.7	Confident	18 Å²	18	60.1 Å²	60.1	7%	0.071	31%	0.305	C	S	.	.	H	α-helix	trans	-52	-47.9	172.3	171.4	-105.8	0	0	0	111.4	W810 K813 F818 D819 S822 P829 V852 Q854	W810-Y816 HydrophobicContact CB-CD2 4.36Å; W810-Y816 AromaticContact CD2-CD2 3.57Å; W810-Y816 HydrophobicContact CD2-CD2 3.57Å; W810-Y816 HydrophobicContact CD2-CE2 4.11Å; W810-Y816 AromaticContact CE2-CD2 3.88Å; W810-Y816 AromaticContact CE3-CD2 3.74Å; W810-Y816 HydrophobicContact CE3-CD2 3.74Å; W810-Y816 AromaticContact CE3-CE2 3.87Å; W810-Y816 HydrophobicContact CE3-CE2 3.87Å; W810-Y816 AromaticContact CG-CD2 3.86Å; W810-Y816 HydrophobicContact CG-CD2 3.86Å; W810-Y816 HydrophobicContact CH2-CD2 4.44Å; W810-Y816 HydrophobicContact CH2-CE2 4.06Å; W810-Y816 HydrophobicContact CZ2-CD2 4.31Å; W810-Y816 HydrophobicContact CZ2-CE2 4.31Å; W810-Y816 HydrophobicContact CZ3-CD2 4.18Å; W810-Y816 AromaticContact CZ3-CE2 3.86Å; W810-Y816 HydrophobicContact CZ3-CE2 3.86Å; K813-Y816 WeakPolarHBondContact O-CB 3.39Å; K813-Y816 PolarHBondContact O-N 3.46Å; Y816-F818 PolarHBondContact O-N 3.35Å; Y816-F818 VanDerWaalsContact O-N 3.09Å; Y816-D819 WeakPolarHBondContact O-CB 3.45Å; Y816-D819 PolarHBondContact O-N 3.46Å; Y816-S822 WeakPolarHBondContact O-CB 3.36Å; Y816-S822 PolarHBondContact O-OG 3.25Å; Y816-S822 VanDerWaalsContact O-OG 3.04Å; Y816-P829 HydrophobicContact CE1-CB 4.04Å; Y816-V852 HydrophobicContact CD1-CG1 3.87Å; Y816-V852 HydrophobicContact CD2-CB 4.29Å; Y816-V852 HydrophobicContact CD2-CG1 3.74Å; Y816-V852 HydrophobicContact CE1-CG1 3.98Å; Y816-V852 HydrophobicContact CE2-CG1 3.85Å; Y816-V852 HydrophobicContact CG-CB 4.24Å; Y816-V852 HydrophobicContact CG-CG1 3.75Å; Y816-Q854 HydrophobicContact CE2-CG 4.06Å; Y816-Q854 VanDerWaalsContact OH-CG 3.28Å; Y816-Q854 WeakPolarHBondContact OH-CG 3.39Å; Y816-Q854 PolarHBondContact OH-NE2 3.01Å; Y816-Q854 VanDerWaalsContact OH-NE2 3.13Å
817	Q	88.6	Confident	86.9	Confident	119 Å²	119	57.1 Å²	57.1	56%	0.556	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.4	-177.3	-61.7	179.9	7.5	0	0	114.5	Y815	Y815-Q817 VanDerWaalsContact C-N 3.29Å; Y815-Q817 PolarHBondContact O-N 3.41Å
818	F	89	Confident	86.9	Confident	133 Å²	133	57 Å²	57	58%	0.583	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-6.4	178.8	-59.1	-62.8	0	0	0	112.8	R814 Y815 Y816	R814-F818 WeakPolarHBondContact O-CD2 3.43Å; R814-F818 WeakPolarHBondContact O-CE2 3.15Å; Y815-F818 HydrophobicContact CD1-CD2 4.35Å; Y815-F818 PolarHBondContact O-N 2.92Å; Y815-F818 VanDerWaalsContact O-N 3.15Å; Y816-F818 PolarHBondContact O-N 3.35Å; Y816-F818 VanDerWaalsContact O-N 3.09Å
819	D	88.8	Confident	86.8	Confident	22 Å²	22	56.6 Å²	56.6	12%	0.118	30%	0.296	C	S	.	.	S	Bend	trans	-79.2	127.6	177.6	-164.2	-45.6	0	0	0	110.1	K799 W810 Y815 Y816 D821 S822	K799-D819 WeakPolarHBondContact CD-OD2 3.5Å; K799-D819 WeakPolarHBondContact CE-OD2 3.42Å; K799-D819 IonicContact NZ-OD1 3.77Å; K799-D819 PolarHBondContact NZ-OD1 3.5Å; K799-D819 IonicContact NZ-OD2 2.71Å; K799-D819 PolarHBondContact NZ-OD2 2.8Å; W810-D819 HydrophobicContact CZ2-CB 4.49Å; W810-D819 PolarHBondContact NE1-OD2 2.87Å; Y815-D819 PolarHBondContact O-N 2.87Å; Y816-D819 WeakPolarHBondContact O-CB 3.45Å; Y816-D819 PolarHBondContact O-N 3.46Å; D819-D821 PolarHBondContact O-N 3.28Å; D819-D821 WeakPolarHBondContact OD1-CB 3.43Å; D819-D821 PolarHBondContact OD1-N 2.91Å; D819-S822 VanDerWaalsContact O-CB 3.23Å; D819-S822 WeakPolarHBondContact O-CB 3.47Å; D819-S822 PolarHBondContact O-N 2.07Å; D819-S822 PolarHBondContact O-OG 2.94Å
820	P	86.5	Confident	86.5	Confident	100 Å²	100	57.6 Å²	57.6	65%	0.649	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-55	-33.3	175.2	-25.9	34.6	0	0	0	113.7	S822 L823	P820-S822 PolarHBondContact O-N 3.22Å; P820-L823 PolarHBondContact O-N 3.3Å
821	D	85.6	Confident	86.2	Confident	46 Å²	46	62.1 Å²	62.1	25%	0.246	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-69.8	-21.5	178.7	-69	-20.7	0	0	0	111.8	K799 Y808 W810 D819 L823 L824 Q854	K799-D821 IonicContact NZ-OD2 2.89Å; K799-D821 PolarHBondContact NZ-OD2 3.37Å; Y808-D821 WeakPolarHBondContact CE2-OD2 3.47Å; W810-D821 HydrophobicContact CZ2-CB 4.17Å; D819-D821 PolarHBondContact O-N 3.28Å; D819-D821 WeakPolarHBondContact OD1-CB 3.43Å; D819-D821 PolarHBondContact OD1-N 2.91Å; D821-L823 PolarHBondContact O-N 2.95Å; D821-L824 HydrophobicContact CB-CD1 4.43Å; D821-L824 WeakPolarHBondContact O-CD1 3.49Å; D821-L824 VanDerWaalsContact O-CG 3.3Å; D821-L824 WeakPolarHBondContact O-CG 3.41Å; D821-L824 PolarHBondContact O-N 2.99Å; D821-Q854 PolarHBondContact O-NE2 3.32Å; D821-Q854 PolarHBondContact O-OE1 3.46Å
822	S	84.3	Confident	85.9	Confident	17 Å²	17	64.5 Å²	64.5	12%	0.119	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-64.6	-24.1	174.7	76.2	0	0	0	0	113	Y816 D819 P820 L824 Q854	Y816-S822 WeakPolarHBondContact O-CB 3.36Å; Y816-S822 PolarHBondContact O-OG 3.25Å; Y816-S822 VanDerWaalsContact O-OG 3.04Å; D819-S822 VanDerWaalsContact O-CB 3.23Å; D819-S822 WeakPolarHBondContact O-CB 3.47Å; D819-S822 PolarHBondContact O-N 2.07Å; D819-S822 PolarHBondContact O-OG 2.94Å; P820-S822 PolarHBondContact O-N 3.22Å; S822-L824 VanDerWaalsContact C-N 3.33Å; S822-L824 PolarHBondContact O-N 3.49Å; S822-Q854 VanDerWaalsContact C-NE2 3.34Å; S822-Q854 PolarHBondContact O-NE2 3.44Å; S822-Q854 VanDerWaalsContact O-NE2 3.1Å
823	L	84.4	Confident	85.6	Confident	137 Å²	137	68 Å²	68	72%	0.717	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-89.6	6.9	-173.7	-58.4	175.4	0	0	0	113.7	P820 D821 A825	P820-L823 PolarHBondContact O-N 3.3Å; D821-L823 PolarHBondContact O-N 2.95Å; L823-A825 PolarHBondContact O-N 2.95Å
824	L	82.1	Confident	85.3	Confident	62 Å²	62	65.3 Å²	65.3	33%	0.325	35%	0.352	S	S	.	.			trans	-68.5	112.4	-179.8	-68.4	174.7	0	0	0	111.2	D821 S822 D826 R827	D821-L824 HydrophobicContact CB-CD1 4.43Å; D821-L824 WeakPolarHBondContact O-CD1 3.49Å; D821-L824 VanDerWaalsContact O-CG 3.3Å; D821-L824 WeakPolarHBondContact O-CG 3.41Å; D821-L824 PolarHBondContact O-N 2.99Å; S822-L824 VanDerWaalsContact C-N 3.33Å; S822-L824 PolarHBondContact O-N 3.49Å; L824-D826 PolarHBondContact O-N 3.15Å; L824-R827 HydrophobicContact CB-CB 4.36Å; L824-R827 HydrophobicContact CB-CG 4.12Å; L824-R827 PolarHBondContact O-N 3.44Å
825	A	80.7	Confident	84.9	Confident	82 Å²	82	64.1 Å²	64.1	68%	0.678	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-23	-172.3	0	0	0	0	0	114.5	L823 R827 K857	L823-A825 PolarHBondContact O-N 2.95Å; A825-R827 PolarHBondContact O-N 2.94Å; A825-K857 WeakPolarHBondContact O-CE 3.47Å; A825-K857 PolarHBondContact O-NZ 3.08Å
826	D	80.5	Confident	84.2	Confident	71 Å²	71	69.7 Å²	69.7	38%	0.38	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-2	176.8	67.3	-43.6	0	0	0	112.9	L824 K857	L824-D826 PolarHBondContact O-N 3.15Å; D826-K857 PolarHBondContact O-N 3Å
827	R	79.8	Confident	83.7	Confident	54 Å²	54	76.1 Å²	76.1	20%	0.204	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	152.6	-176.6	-59.6	-174.1	-176.3	-164.4	0.3	112.8	L824 A825 Q854 C855 R856 K857	L824-R827 HydrophobicContact CB-CB 4.36Å; L824-R827 HydrophobicContact CB-CG 4.12Å; L824-R827 PolarHBondContact O-N 3.44Å; A825-R827 PolarHBondContact O-N 2.94Å; R827-Q854 HydrophobicContact CB-CB 4.1Å; R827-Q854 HydrophobicContact CB-CG 4.24Å; R827-C855 CarbonylContact C-O 3.42Å; R827-C855 WeakPolarHBondContact CA-O 3.4Å; R827-C855 WeakPolarHBondContact CB-O 3.45Å; R827-R856 HydrophobicContact CG-CG 4.4Å; R827-K857 WeakPolarHBondContact O-CE 3.48Å
828	L	81.2	Confident	83.3	Confident	72 Å²	72	71.9 Å²	71.9	38%	0.377	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	132	173.2	-73.2	167.3	0	0	0	108.8	Q854 C855 K857	L828-Q854 CarbonylContact O-C 3.52Å; L828-Q854 WeakPolarHBondContact O-CA 3.33Å; L828-C855 PolarHBondContact N-O 3.09Å; L828-C855 PolarHBondContact O-N 3.35Å; L828-K857 HydrophobicContact CD1-CG 3.78Å; L828-K857 HydrophobicContact CD2-CG 4.28Å; L828-K857 HydrophobicContact CG-CD 4.32Å; L828-K857 HydrophobicContact CG-CG 3.57Å
829	P	83.8	Confident	83.1	Confident	69 Å²	69	70.3 Å²	70.3	45%	0.448	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	138.3	168.9	28.3	-31.2	0	0	0	109.7	Y816 V852 F853	Y816-P829 HydrophobicContact CE1-CB 4.04Å; P829-V852 HydrophobicContact CB-CG1 4.37Å; P829-F853 CarbonylContact C-O 3.38Å; P829-F853 WeakPolarHBondContact CA-O 3.27Å
830	C	83.7	Confident	83.1	Confident	21 Å²	21	69.4 Å²	69.4	14%	0.142	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	150.4	166.6	-71.7	0	0	0	0	109.2	V852 F853 C855 C868	C830-V852 CarbonylContact O-C 3.56Å; C830-V852 VanDerWaalsContact O-CA 3.32Å; C830-V852 WeakPolarHBondContact O-CA 3.32Å; C830-F853 HydrophobicContact CB-CD1 4.3Å; C830-F853 HydrophobicContact CB-CD2 4Å; C830-F853 HydrophobicContact CB-CE1 3.7Å; C830-F853 HydrophobicContact CB-CE2 3.39Å; C830-F853 HydrophobicContact CB-CG 4.4Å; C830-F853 HydrophobicContact CB-CZ 3.16Å; C830-F853 PolarHBondContact N-O 3.32Å; C830-F853 PolarHBondContact O-N 2.81Å; C830-C855 PolarHBondContact SG-SG 3Å; C830-C868 HydrophobicContact CB-CB 4.45Å; C830-C868 WeakPolarHBondContact CB-SG 3.39Å; C830-C868 WeakPolarHBondContact SG-CB 3.36Å; C830-C868 CovalentContact SG-SG 2.03Å; C830-C868 PolarHBondContact SG-SG 2.88Å
831	E	85.5	Confident	83.4	Confident	96 Å²	96	65.9 Å²	65.9	45%	0.449	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	129.4	-172.7	-65.1	171.5	-178.3	0	0	108.1	K813 I851 V852	K813-E831 VanDerWaalsContact CE-OE1 3.32Å; K813-E831 WeakPolarHBondContact CE-OE1 3.36Å; K813-E831 IonicContact NZ-OE1 3.45Å; K813-E831 PolarHBondContact NZ-OE1 3.08Å; K813-E831 IonicContact NZ-OE2 3.82Å; E831-I851 CarbonylContact C-O 3.53Å; E831-I851 WeakPolarHBondContact CA-O 3.34Å; E831-V852 HydrophobicContact CG-CG2 4.36Å
832	Y	85	Confident	83.7	Confident	52 Å²	52	64.3 Å²	64.3	20%	0.204	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.7	173.6	178.1	-92.6	0	0	0	108.6	L777 L834 E850 I851 M866	L777-Y832 HydrophobicContact CD2-CE1 4.48Å; Y832-L834 PolarHBondContact O-N 3.14Å; Y832-E850 CarbonylContact O-C 3.58Å; Y832-E850 WeakPolarHBondContact O-CA 3.44Å; Y832-I851 PolarHBondContact N-O 3.4Å; Y832-I851 PolarHBondContact O-N 3.44Å; Y832-M866 WeakPolarHBondContact CB-SD 3.27Å; Y832-M866 HydrophobicContact CD1-CE 4.36Å; Y832-M866 HydrophobicContact CD1-CG 4.03Å; Y832-M866 HydrophobicContact CD1-SD 3.27Å; Y832-M866 WeakPolarHBondContact CD1-SD 3.48Å; Y832-M866 HydrophobicContact CD2-CB 4Å; Y832-M866 HydrophobicContact CD2-CG 3.65Å; Y832-M866 HydrophobicContact CD2-SD 3.94Å; Y832-M866 HydrophobicContact CE1-CG 4.34Å; Y832-M866 HydrophobicContact CE1-SD 3.92Å; Y832-M866 HydrophobicContact CE2-CG 4Å; Y832-M866 HydrophobicContact CG-CB 4.17Å; Y832-M866 HydrophobicContact CG-CG 3.66Å; Y832-M866 HydrophobicContact CG-SD 3.27Å
833	A	84.1	Confident	84	Confident	74 Å²	74	67.9 Å²	67.9	61%	0.612	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	129.3	-179.6	0	0	0	0	0	110.5
834	L	84.8	Confident	84.3	Confident	18 Å²	18	65.5 Å²	65.5	9%	0.094	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-67.5	138.1	172.5	-76.9	170.5	0	0	0	109.4	L777 L781 Y832 V838 V848 K849 I851	L777-L834 HydrophobicContact CD1-CD2 3.34Å; L781-L834 HydrophobicContact CD2-CD2 4.42Å; Y832-L834 PolarHBondContact O-N 3.14Å; L834-V838 HydrophobicContact CD2-CG1 4.34Å; L834-V848 HydrophobicContact CD1-CB 4.2Å; L834-V848 HydrophobicContact CD1-CG1 3.83Å; L834-V848 WeakPolarHBondContact CD1-O 3.48Å; L834-K849 PolarHBondContact N-O 3.45Å; L834-I851 HydrophobicContact CD2-CD1 3.53Å; L834-I851 HydrophobicContact CD2-CG1 3.72Å; L834-I851 HydrophobicContact CG-CD1 4.42Å; L834-I851 HydrophobicContact CG-CG1 4.11Å
835	P	81.8	Confident	84.6	Confident	55 Å²	55	67.7 Å²	67.7	36%	0.357	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-58.6	146.4	172.8	-22.3	32.4	0	0	0	111.2	L777 N837 V838	L777-P835 HydrophobicContact CD2-CG 3.56Å; P835-N837 PolarHBondContact O-N 3.41Å; P835-V838 HydrophobicContact CB-CG2 4.35Å; P835-V838 HydrophobicContact CG-CG2 4.45Å; P835-V838 WeakPolarHBondContact O-CB 3.48Å; P835-V838 PolarHBondContact O-N 3.09Å
836	V	77.9	Confident	85.1	Confident	145 Å²	145	68.2 Å²	68.2	88%	0.879	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.3	-176.5	-173.7	0	0	0	0	113	V838	V836-V838 VanDerWaalsContact C-N 3.27Å; V836-V838 PolarHBondContact O-N 3.46Å
837	N	80	Confident	85.6	Confident	154 Å²	154	68.5 Å²	68.5	82%	0.824	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-7.4	-178.1	-58.6	-5.4	0	0	0	113.5	P835	P835-N837 PolarHBondContact O-N 3.41Å
838	V	79.9	Confident	86.2	Confident	30 Å²	30	66.2 Å²	66.2	18%	0.182	38%	0.375	C	S	.	.			trans	-96.1	112.9	-175.6	178	0	0	0	0	110.1	L781 L834 P835 V836 V840	L781-V838 HydrophobicContact CD1-CB 4.22Å; L781-V838 HydrophobicContact CD1-CG1 3.54Å; L781-V838 HydrophobicContact CD1-CG2 3.56Å; L781-V838 HydrophobicContact CD2-CG1 3.49Å; L781-V838 VanDerWaalsContact CD2-CG1 3.49Å; L781-V838 HydrophobicContact CG-CG1 4.16Å; L834-V838 HydrophobicContact CD2-CG1 4.34Å; P835-V838 HydrophobicContact CB-CG2 4.35Å; P835-V838 HydrophobicContact CG-CG2 4.45Å; P835-V838 WeakPolarHBondContact O-CB 3.48Å; P835-V838 PolarHBondContact O-N 3.09Å; V836-V838 VanDerWaalsContact C-N 3.27Å; V836-V838 PolarHBondContact O-N 3.46Å; V838-V840 HydrophobicContact CG1-CG2 3.78Å; V838-V840 PolarHBondContact O-N 3.41Å
839	T	84	Confident	86.6	Confident	99 Å²	99	70 Å²	70	61%	0.607	39%	0.388	S	S	*	.			trans	-100.1	68.3	-177.9	56	0	0	0	0	111.9
840	V	89	Confident	86.9	Confident	3 Å²	3	69 Å²	69	2%	0.018	38%	0.378	C	S	.	.			trans	-101.9	131.5	172.8	-179.4	0	0	0	0	108.9	L781 F784 W791 V793 I811 V838 V848	L781-V840 HydrophobicContact CD2-CG2 3.66Å; F784-V840 HydrophobicContact CB-CG2 4.29Å; F784-V840 HydrophobicContact CD1-CG1 4.24Å; F784-V840 HydrophobicContact CG-CG1 4.42Å; W791-V840 HydrophobicContact CE3-CG2 3.86Å; W791-V840 HydrophobicContact CZ3-CG2 4.19Å; V793-V840 HydrophobicContact CB-CG1 4.5Å; V793-V840 HydrophobicContact CG2-CG1 3.25Å; I811-V840 HydrophobicContact CG2-CG1 4.18Å; V838-V840 HydrophobicContact CG1-CG2 3.78Å; V838-V840 PolarHBondContact O-N 3.41Å; V840-V848 HydrophobicContact CB-CB 4.47Å; V840-V848 HydrophobicContact CG1-CB 4.38Å; V840-V848 HydrophobicContact CG1-CG2 4.08Å; V840-V848 WeakPolarHBondContact O-CB 3.49Å; V840-V848 PolarHBondContact O-N 2.87Å
841	S	92.4	Very high	87.2	Confident	26 Å²	26	68 Å²	68	18%	0.182	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	157.7	178.6	63.5	0	0	0	0	111.5	W791 K792 V793 E846	W791-S841 PolarHBondContact O-N 2.95Å; W791-S841 VanDerWaalsContact O-O 3.11Å; W791-S841 PolarHBondContact O-OG 3.36Å; K792-S841 CarbonylContact C-O 3.58Å; K792-S841 WeakPolarHBondContact CA-O 3.41Å; V793-S841 PolarHBondContact N-O 3.34Å; S841-E846 CarbonylContact C-O 3.52Å; S841-E846 VanDerWaalsContact CA-O 3.26Å; S841-E846 WeakPolarHBondContact CA-O 3.36Å; S841-E846 WeakPolarHBondContact CB-O 3.32Å
842	Y	93.6	Very high	87.4	Confident	14 Å²	14	63.5 Å²	63.5	6%	0.055	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	171.8	168.1	-67.9	-64.2	0	0	0	111.4	V793 G812 K813 R814 Y815 D844 D845 E846 V848	V793-Y842 HydrophobicContact CB-CD1 3.99Å; V793-Y842 HydrophobicContact CB-CE1 4.38Å; V793-Y842 HydrophobicContact CG1-CD1 3.92Å; V793-Y842 HydrophobicContact CG1-CE1 3.93Å; V793-Y842 CarbonylContact O-C 3.58Å; V793-Y842 WeakPolarHBondContact O-CA 3.37Å; G812-Y842 WeakPolarHBondContact CA-OH 3.31Å; K813-Y842 PolarHBondContact N-OH 3.48Å; K813-Y842 VanDerWaalsContact N-OH 3.1Å; R814-Y842 HydrophobicContact CB-CD1 4.45Å; R814-Y842 HydrophobicContact CB-CE1 3.74Å; R814-Y842 HydrophobicContact CB-CE2 4.09Å; R814-Y842 WeakPolarHBondContact CB-OH 3.49Å; R814-Y842 PolarHBondContact N-OH 3.45Å; R814-Y842 VanDerWaalsContact N-OH 3.12Å; Y815-Y842 HydrophobicContact CD2-CD1 4.1Å; Y815-Y842 AromaticContact CD2-CE1 3.96Å; Y815-Y842 HydrophobicContact CD2-CE1 3.96Å; Y815-Y842 AromaticContact CE2-CD1 3.63Å; Y815-Y842 HydrophobicContact CE2-CD1 3.63Å; Y815-Y842 AromaticContact CE2-CE1 3.97Å; Y815-Y842 HydrophobicContact CE2-CE1 3.97Å; Y842-D844 WeakPolarHBondContact CB-OD1 3.46Å; Y842-D844 PolarHBondContact O-N 2.99Å; Y842-D845 PolarHBondContact O-N 3.28Å; Y842-E846 HydrophobicContact CD2-CB 4.11Å; Y842-E846 HydrophobicContact CD2-CG 4.4Å; Y842-E846 WeakPolarHBondContact CD2-O 3.39Å; Y842-E846 PolarHBondContact N-O 3.45Å; Y842-V848 HydrophobicContact CD1-CG2 4.05Å; Y842-V848 HydrophobicContact CD2-CG2 4Å; Y842-V848 HydrophobicContact CE1-CG2 3.92Å; Y842-V848 HydrophobicContact CE2-CG2 3.88Å; Y842-V848 HydrophobicContact CG-CG2 4.1Å
843	E	89.4	Confident	87.5	Confident	92 Å²	92	61.1 Å²	61.1	43%	0.43	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-31.2	179	-71.4	177.5	175.2	0	0	113.8	K792 V793 G794 Y796 D845	K792-E843 PolarHBondContact NZ-O 3.43Å; V793-E843 PolarHBondContact O-N 3.42Å; V793-E843 VanDerWaalsContact O-N 3.16Å; G794-E843 WeakPolarHBondContact CA-OE1 3.48Å; Y796-E843 VanDerWaalsContact CE1-OE1 3.26Å; Y796-E843 WeakPolarHBondContact CE1-OE1 3.31Å; E843-D845 VanDerWaalsContact C-N 3.3Å
844	D	90.3	Very high	87.4	Confident	86 Å²	86	57.8 Å²	57.8	46%	0.46	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	17.1	176.3	64.3	-26.6	0	0	0	113.8	R814 Y842 E846	R814-D844 IonicContact CZ-OD1 3.84Å; R814-D844 IonicContact CZ-OD2 3.88Å; R814-D844 VanDerWaalsContact CZ-OD2 3.25Å; R814-D844 IonicContact NH1-OD1 3.42Å; R814-D844 PolarHBondContact NH1-OD1 3.26Å; R814-D844 IonicContact NH1-OD2 2.88Å; R814-D844 PolarHBondContact NH1-OD2 3.23Å; R814-D844 IonicContact NH2-OD1 3.11Å; R814-D844 IonicContact NH2-OD2 3.61Å; R814-D844 PolarHBondContact NH2-OD2 2.9Å; Y842-D844 WeakPolarHBondContact CB-OD1 3.46Å; Y842-D844 PolarHBondContact O-N 2.99Å; D844-E846 PolarHBondContact O-N 2.93Å
845	D	89.2	Confident	87	Confident	108 Å²	108	57 Å²	57	58%	0.578	31%	0.308	S	S	*	.	S	Bend	trans	65.4	13.6	176.4	-49.5	-47.8	0	0	0	114.6	K792 Y842 E843	K792-D845 WeakPolarHBondContact CE-OD1 3.49Å; K792-D845 IonicContact NZ-OD1 3.3Å; K792-D845 PolarHBondContact NZ-OD1 2.94Å; Y842-D845 PolarHBondContact O-N 3.28Å; E843-D845 VanDerWaalsContact C-N 3.3Å
846	E	91.4	Very high	86.6	Confident	93 Å²	93	60 Å²	60	44%	0.435	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-72.8	129.8	169.3	-174.1	-178.6	-170	0	0	110	R814 S841 Y842 D844	R814-E846 IonicContact CZ-OE2 2.68Å; R814-E846 IonicContact NE-OE2 3.98Å; R814-E846 IonicContact NH2-OE2 3.69Å; R814-E846 PolarHBondContact NH2-OE2 3.49Å; S841-E846 CarbonylContact C-O 3.52Å; S841-E846 VanDerWaalsContact CA-O 3.26Å; S841-E846 WeakPolarHBondContact CA-O 3.36Å; S841-E846 WeakPolarHBondContact CB-O 3.32Å; Y842-E846 HydrophobicContact CD2-CB 4.11Å; Y842-E846 HydrophobicContact CD2-CG 4.4Å; Y842-E846 WeakPolarHBondContact CD2-O 3.39Å; Y842-E846 PolarHBondContact N-O 3.45Å; D844-E846 PolarHBondContact O-N 2.93Å
847	P	91.3	Very high	86.1	Confident	77 Å²	77	57.6 Å²	57.6	50%	0.5	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-68.4	136.9	-176.7	27.5	-35	0	0	0	111.9
848	V	91.4	Very high	85	Confident	7 Å²	7	59.3 Å²	59.3	4%	0.042	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-80.6	124.3	170.9	-174.4	0	0	0	0	108.7	V793 I811 G812 L834 V840 Y842	V793-V848 HydrophobicContact CB-CG2 4.27Å; V793-V848 HydrophobicContact CG2-CG2 4.09Å; I811-V848 HydrophobicContact CG2-CG1 3.94Å; G812-V848 VanDerWaalsContact CA-CG1 3.43Å; L834-V848 HydrophobicContact CD1-CB 4.2Å; L834-V848 HydrophobicContact CD1-CG1 3.83Å; L834-V848 WeakPolarHBondContact CD1-O 3.48Å; V840-V848 HydrophobicContact CB-CB 4.47Å; V840-V848 HydrophobicContact CG1-CB 4.38Å; V840-V848 HydrophobicContact CG1-CG2 4.08Å; V840-V848 WeakPolarHBondContact O-CB 3.49Å; V840-V848 PolarHBondContact O-N 2.87Å; Y842-V848 HydrophobicContact CD1-CG2 4.05Å; Y842-V848 HydrophobicContact CD2-CG2 4Å; Y842-V848 HydrophobicContact CE1-CG2 3.92Å; Y842-V848 HydrophobicContact CE2-CG2 3.88Å; Y842-V848 HydrophobicContact CG-CG2 4.1Å
849	K	90.7	Very high	83.9	Confident	151 Å²	151	63.8 Å²	63.8	66%	0.657	31%	0.31	S	S	*	.			trans	-101.7	-19.1	-175.1	-61.8	-177.9	-177.7	177.3	0	114.2	L834	L834-K849 PolarHBondContact N-O 3.45Å
850	E	89.6	Confident	82.1	Confident	48 Å²	48	66.9 Å²	66.9	22%	0.224	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	154.1	-167.3	64.9	-156.7	-174.2	0	0	112.2	G812 K813 Y832 V852	G812-E850 WeakPolarHBondContact CA-O 3.34Å; G812-E850 PolarHBondContact N-O 2.93Å; K813-E850 WeakPolarHBondContact CB-OE1 3.25Å; K813-E850 WeakPolarHBondContact CD-OE1 3.44Å; Y832-E850 CarbonylContact O-C 3.58Å; Y832-E850 WeakPolarHBondContact O-CA 3.44Å; E850-V852 HydrophobicContact CG-CG2 4.39Å
851	I	89.1	Confident	80.2	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	128.6	167.3	-65.4	167.9	0	0	0	107	L777 L780 Y809 W810 E831 Y832 L834 M866	L777-I851 HydrophobicContact CD1-CD1 3.42Å; L777-I851 VanDerWaalsContact CD1-CD1 3.42Å; L780-I851 HydrophobicContact CD1-CD1 3.72Å; L780-I851 HydrophobicContact CD1-CG1 4.36Å; L780-I851 HydrophobicContact CD1-CG2 3.81Å; Y809-I851 HydrophobicContact CD1-CG2 4.11Å; W810-I851 CarbonylContact O-C 3.16Å; W810-I851 WeakPolarHBondContact O-CA 3.48Å; E831-I851 CarbonylContact C-O 3.53Å; E831-I851 WeakPolarHBondContact CA-O 3.34Å; Y832-I851 PolarHBondContact N-O 3.4Å; Y832-I851 PolarHBondContact O-N 3.44Å; L834-I851 HydrophobicContact CD2-CD1 3.53Å; L834-I851 HydrophobicContact CD2-CG1 3.72Å; L834-I851 HydrophobicContact CG-CD1 4.42Å; L834-I851 HydrophobicContact CG-CG1 4.11Å; I851-M866 HydrophobicContact CB-SD 4.29Å; I851-M866 HydrophobicContact CD1-CE 3.78Å; I851-M866 HydrophobicContact CD1-SD 4.13Å; I851-M866 HydrophobicContact CG2-CE 4.46Å; I851-M866 HydrophobicContact CG2-SD 4.18Å
852	V	89.7	Confident	78.3	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.006	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	141	176.6	-172.3	0	0	0	0	108.9	Y809 W810 K813 Y816 P829 C830 E831 E850	Y809-V852 CarbonylContact C-O 3.58Å; Y809-V852 WeakPolarHBondContact CA-O 3.41Å; W810-V852 HydrophobicContact CB-CB 4.33Å; W810-V852 PolarHBondContact N-O 2.83Å; W810-V852 PolarHBondContact O-N 3.36Å; K813-V852 HydrophobicContact CB-CG2 3.86Å; K813-V852 HydrophobicContact CG-CG2 4.39Å; Y816-V852 HydrophobicContact CD1-CG1 3.87Å; Y816-V852 HydrophobicContact CD2-CB 4.29Å; Y816-V852 HydrophobicContact CD2-CG1 3.74Å; Y816-V852 HydrophobicContact CE1-CG1 3.98Å; Y816-V852 HydrophobicContact CE2-CG1 3.85Å; Y816-V852 HydrophobicContact CG-CB 4.24Å; Y816-V852 HydrophobicContact CG-CG1 3.75Å; P829-V852 HydrophobicContact CB-CG1 4.37Å; C830-V852 CarbonylContact O-C 3.56Å; C830-V852 VanDerWaalsContact O-CA 3.32Å; C830-V852 WeakPolarHBondContact O-CA 3.32Å; E831-V852 HydrophobicContact CG-CG2 4.36Å; E850-V852 HydrophobicContact CG-CG2 4.39Å
853	F	87.5	Confident	75.9	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.009	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	169.7	171.9	58.3	-79.3	0	0	0	109.5	Y808 Y809 P829 C830 C862 M866 C868	Y808-F853 WeakPolarHBondContact O-CB 3.44Å; Y809-F853 HydrophobicContact CD1-CB 3.62Å; Y809-F853 HydrophobicContact CD1-CD1 4.2Å; Y809-F853 HydrophobicContact CD1-CG 4.03Å; Y809-F853 HydrophobicContact CE1-CB 3.84Å; Y809-F853 HydrophobicContact CE1-CD1 4.16Å; Y809-F853 HydrophobicContact CE1-CD2 4.37Å; Y809-F853 AromaticContact CE1-CG 3.86Å; Y809-F853 HydrophobicContact CE1-CG 3.86Å; Y809-F853 HydrophobicContact CG-CB 4.1Å; P829-F853 CarbonylContact C-O 3.38Å; P829-F853 WeakPolarHBondContact CA-O 3.27Å; C830-F853 HydrophobicContact CB-CD1 4.3Å; C830-F853 HydrophobicContact CB-CD2 4Å; C830-F853 HydrophobicContact CB-CE1 3.7Å; C830-F853 HydrophobicContact CB-CE2 3.39Å; C830-F853 HydrophobicContact CB-CG 4.4Å; C830-F853 HydrophobicContact CB-CZ 3.16Å; C830-F853 PolarHBondContact N-O 3.32Å; C830-F853 PolarHBondContact O-N 2.81Å; F853-C862 HydrophobicContact CE2-CB 4.21Å; F853-M866 HydrophobicContact CE1-CB 4.06Å; F853-M866 VanDerWaalsContact CE2-O 3.23Å; F853-M866 WeakPolarHBondContact CE2-O 3.43Å; F853-M866 HydrophobicContact CZ-CB 4.26Å; F853-M866 WeakPolarHBondContact CZ-O 3.37Å; F853-C868 WeakPolarHBondContact CE2-SG 3.33Å; F853-C868 WeakPolarHBondContact CZ-SG 3.39Å
854	Q	83.1	Confident	73.8	Confident	5 Å²	5	63.8 Å²	63.8	2%	0.023	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	132.3	-176.7	-80.6	-176.9	-28.8	0	0	112.7	W810 Y816 D821 S822 R827 L828	W810-Q854 HydrophobicContact CH2-CG 4.27Å; W810-Q854 HydrophobicContact CZ3-CB 4.41Å; W810-Q854 HydrophobicContact CZ3-CG 4.11Å; Y816-Q854 HydrophobicContact CE2-CG 4.06Å; Y816-Q854 VanDerWaalsContact OH-CG 3.28Å; Y816-Q854 WeakPolarHBondContact OH-CG 3.39Å; Y816-Q854 PolarHBondContact OH-NE2 3.01Å; Y816-Q854 VanDerWaalsContact OH-NE2 3.13Å; D821-Q854 PolarHBondContact O-NE2 3.32Å; D821-Q854 PolarHBondContact O-OE1 3.46Å; S822-Q854 VanDerWaalsContact C-NE2 3.34Å; S822-Q854 PolarHBondContact O-NE2 3.44Å; S822-Q854 VanDerWaalsContact O-NE2 3.1Å; R827-Q854 HydrophobicContact CB-CB 4.1Å; R827-Q854 HydrophobicContact CB-CG 4.24Å; L828-Q854 CarbonylContact O-C 3.52Å; L828-Q854 WeakPolarHBondContact O-CA 3.33Å
855	C	76.8	Confident	72.4	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.007	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	148	173.2	-58.9	0	0	0	0	110.6	R827 L828 C830 C862 C868	R827-C855 CarbonylContact C-O 3.42Å; R827-C855 WeakPolarHBondContact CA-O 3.4Å; R827-C855 WeakPolarHBondContact CB-O 3.45Å; L828-C855 PolarHBondContact N-O 3.09Å; L828-C855 PolarHBondContact O-N 3.35Å; C830-C855 PolarHBondContact SG-SG 3Å; C855-C862 VanDerWaalsContact CA-SG 3.58Å; C855-C862 HydrophobicContact CB-CB 4.29Å; C855-C862 WeakPolarHBondContact CB-SG 3.17Å; C855-C862 WeakPolarHBondContact SG-CB 3.25Å; C855-C862 CovalentContact SG-SG 2.01Å; C855-C862 PolarHBondContact SG-SG 3.49Å; C855-C868 PolarHBondContact SG-SG 3.37Å
856	R	73	Confident	70.7	Confident	117 Å²	117	56.3 Å²	56.3	44%	0.442	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	133.7	173.4	-77.1	175.9	171.2	-174.3	-1.1	110.3	R827 F858 Q859	R827-R856 HydrophobicContact CG-CG 4.4Å; R856-F858 VanDerWaalsContact C-N 3.27Å; R856-F858 PolarHBondContact O-N 3.2Å; R856-Q859 HydrophobicContact CB-CB 4Å; R856-Q859 PolarHBondContact O-N 3.45Å
857	K	67.1	Low	69	Low	95 Å²	95	54.3 Å²	54.3	41%	0.413	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-34.2	-176	-79	176.1	178.6	173.9	0	114.7	A825 D826 R827 L828	A825-K857 WeakPolarHBondContact O-CE 3.47Å; A825-K857 PolarHBondContact O-NZ 3.08Å; D826-K857 PolarHBondContact O-N 3Å; R827-K857 WeakPolarHBondContact O-CE 3.48Å; L828-K857 HydrophobicContact CD1-CG 3.78Å; L828-K857 HydrophobicContact CD2-CG 4.28Å; L828-K857 HydrophobicContact CG-CD 4.32Å; L828-K857 HydrophobicContact CG-CG 3.57Å
858	F	57.1	Low	67	Low	190 Å²	190	51.1 Å²	51.1	83%	0.833	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.4	4.1	-169.5	-55.7	-71.8	0	0	0	114.4	R856	R856-F858 VanDerWaalsContact C-N 3.27Å; R856-F858 PolarHBondContact O-N 3.2Å
859	Q	55.8	Low	65	Low	124 Å²	124	52.2 Å²	52.2	58%	0.579	25%	0.248	S	C	*	.	S	Bend	trans	-108.1	25.4	-170.5	-113.2	-177.9	-8.8	0	0	114.3	R856	R856-Q859 HydrophobicContact CB-CB 4Å; R856-Q859 PolarHBondContact O-N 3.45Å
860	Q	47.2	Very low	62.8	Low	164 Å²	164	48.9 Å²	48.9	77%	0.766	24%	0.237	S	C	*	.			trans	67.6	110	-164.2	-56	167.2	-24.1	0	0	109.7	C862	Q860-C862 PolarHBondContact O-N 3.29Å
861	A	49.3	Very low	60.7	Low	13 Å²	13	49.9 Å²	49.9	11%	0.107	25%	0.246	C	C	.	.			trans	-60.3	135.6	178.1	0	0	0	0	0	109.4	C863 C868 C869 V871	A861-C863 PolarHBondContact O-N 3.25Å; A861-C863 PolarHBondContact O-SG 3.24Å; A861-C868 HydrophobicContact CB-CB 4.29Å; A861-C869 WeakPolarHBondContact CB-O 3.32Å; A861-V871 HydrophobicContact CB-CG2 4.28Å
862	C	51.7	Low	58.7	Low	4 Å²	4	52.1 Å²	52.1	3%	0.027	26%	0.258	C	S	.	.			trans	-42.4	80.8	-158.1	-59.5	0	0	0	0	117.3	R807 F853 C855 Q860 G864 D867 C868	R807-C862 PolarHBondContact NH1-SG 3.42Å; F853-C862 HydrophobicContact CE2-CB 4.21Å; C855-C862 VanDerWaalsContact CA-SG 3.58Å; C855-C862 HydrophobicContact CB-CB 4.29Å; C855-C862 WeakPolarHBondContact CB-SG 3.17Å; C855-C862 WeakPolarHBondContact SG-CB 3.25Å; C855-C862 CovalentContact SG-SG 2.01Å; C855-C862 PolarHBondContact SG-SG 3.49Å; Q860-C862 PolarHBondContact O-N 3.29Å; C862-G864 PolarHBondContact O-N 2.88Å; C862-D867 CarbonylContact O-C 3.56Å; C862-D867 WeakPolarHBondContact O-CA 3.4Å; C862-C868 CarbonylContact C-O 3.6Å; C862-C868 HydrophobicContact CB-CB 3.8Å; C862-C868 WeakPolarHBondContact O-CA 2.87Å; C862-C868 PolarHBondContact O-N 3.37Å
863	C	43	Very low	56.7	Low	43 Å²	43	62 Å²	62	29%	0.291	30%	0.304	S	S	.	.			trans	-75	92.4	169.2	-68.3	0	0	0	0	109.5	A861 C868	A861-C863 PolarHBondContact O-N 3.25Å; A861-C863 PolarHBondContact O-SG 3.24Å; C863-C868 PolarHBondContact N-O 2.93Å
864	G	45.2	Very low	54.9	Low	11 Å²	11	66.9 Å²	66.9	11%	0.113	34%	0.335	C	S	.	.	S	Bend	trans	120.1	131.1	166.5	0	0	0	0	0	117.3	C862 D867	C862-G864 PolarHBondContact O-N 2.88Å; G864-D867 VanDerWaalsContact CA-CG 3.44Å; G864-D867 WeakPolarHBondContact CA-OD1 3.5Å; G864-D867 PolarHBondContact N-OD1 3.28Å
865	E	60.8	Low	53	Low	35 Å²	35	69 Å²	69	16%	0.164	36%	0.358	C	S	.	.	S	Bend	trans	89.9	0.5	174.4	-34.7	-149.7	-172.2	0	0	116.8	S772 S773 I776 Y805 D867	S772-E865 WeakPolarHBondContact CB-OE2 3.49Å; S772-E865 VanDerWaalsContact OG-CA 3.27Å; S772-E865 WeakPolarHBondContact OG-CA 3.35Å; S772-E865 WeakPolarHBondContact OG-CB 3.4Å; S772-E865 WeakPolarHBondContact OG-CG 3.41Å; S773-E865 WeakPolarHBondContact CA-O 3.24Å; S773-E865 PolarHBondContact OG-O 2.91Å; I776-E865 HydrophobicContact CD1-CB 3.83Å; I776-E865 WeakPolarHBondContact CD1-O 3.45Å; Y805-E865 HydrophobicContact CE1-CB 4.3Å; Y805-E865 HydrophobicContact CE1-CG 4.2Å; Y805-E865 WeakPolarHBondContact CE1-OE2 3.36Å; Y805-E865 PolarHBondContact OH-OE2 3.49Å; E865-D867 PolarHBondContact N-OD1 3Å
866	M	54.6	Low	51.4	Low	2 Å²	2	77 Å²	77	1%	0.01	39%	0.388	C	S	.	.	S	Bend	trans	170.4	94.7	154.5	-93.7	-160.9	-132.3	0	0	104.4	S773 I776 L777 L780 Y832 I851 F853	S773-M866 WeakPolarHBondContact OG-CA 3.49Å; S773-M866 PolarHBondContact OG-N 3.23Å; I776-M866 HydrophobicContact CB-CE 3.65Å; I776-M866 HydrophobicContact CG2-CE 3.56Å; L777-M866 HydrophobicContact CB-CE 4.08Å; L780-M866 HydrophobicContact CD1-CE 4.07Å; Y832-M866 WeakPolarHBondContact CB-SD 3.27Å; Y832-M866 HydrophobicContact CD1-CE 4.36Å; Y832-M866 HydrophobicContact CD1-CG 4.03Å; Y832-M866 HydrophobicContact CD1-SD 3.27Å; Y832-M866 WeakPolarHBondContact CD1-SD 3.48Å; Y832-M866 HydrophobicContact CD2-CB 4Å; Y832-M866 HydrophobicContact CD2-CG 3.65Å; Y832-M866 HydrophobicContact CD2-SD 3.94Å; Y832-M866 HydrophobicContact CE1-CG 4.34Å; Y832-M866 HydrophobicContact CE1-SD 3.92Å; Y832-M866 HydrophobicContact CE2-CG 4Å; Y832-M866 HydrophobicContact CG-CB 4.17Å; Y832-M866 HydrophobicContact CG-CG 3.66Å; Y832-M866 HydrophobicContact CG-SD 3.27Å; I851-M866 HydrophobicContact CB-SD 4.29Å; I851-M866 HydrophobicContact CD1-CE 3.78Å; I851-M866 HydrophobicContact CD1-SD 4.13Å; I851-M866 HydrophobicContact CG2-CE 4.46Å; I851-M866 HydrophobicContact CG2-SD 4.18Å; F853-M866 HydrophobicContact CE1-CB 4.06Å; F853-M866 VanDerWaalsContact CE2-O 3.23Å; F853-M866 WeakPolarHBondContact CE2-O 3.43Å; F853-M866 HydrophobicContact CZ-CB 4.26Å; F853-M866 WeakPolarHBondContact CZ-O 3.37Å
867	D	56.2	Low	50.1	Low	50 Å²	50	77.3 Å²	77.3	27%	0.267	40%	0.397	S	S	.	.			trans	-96.7	135	-134.1	-63.3	-9.9	0	0	0	117.6	L769 C862 G864 E865 F881	L769-D867 WeakPolarHBondContact CB-OD2 3.42Å; L769-D867 WeakPolarHBondContact CD1-OD2 3.47Å; C862-D867 CarbonylContact O-C 3.56Å; C862-D867 WeakPolarHBondContact O-CA 3.4Å; G864-D867 VanDerWaalsContact CA-CG 3.44Å; G864-D867 WeakPolarHBondContact CA-OD1 3.5Å; G864-D867 PolarHBondContact N-OD1 3.28Å; E865-D867 PolarHBondContact N-OD1 3Å; D867-F881 HydrophobicContact CB-CE2 4.5Å; D867-F881 WeakPolarHBondContact OD2-CE2 3.38Å
868	C	48.2	Very low	49.1	Very low	11 Å²	11	78.4 Å²	78.4	7%	0.074	40%	0.399	C	S	.	.			trans	-105.1	151.7	166.5	-41	0	0	0	0	113	C830 F853 C855 A861 C862 C863	C830-C868 HydrophobicContact CB-CB 4.45Å; C830-C868 WeakPolarHBondContact CB-SG 3.39Å; C830-C868 WeakPolarHBondContact SG-CB 3.36Å; C830-C868 CovalentContact SG-SG 2.03Å; C830-C868 PolarHBondContact SG-SG 2.88Å; F853-C868 WeakPolarHBondContact CE2-SG 3.33Å; F853-C868 WeakPolarHBondContact CZ-SG 3.39Å; C855-C868 PolarHBondContact SG-SG 3.37Å; A861-C868 HydrophobicContact CB-CB 4.29Å; C862-C868 CarbonylContact C-O 3.6Å; C862-C868 HydrophobicContact CB-CB 3.8Å; C862-C868 WeakPolarHBondContact O-CA 2.87Å; C862-C868 PolarHBondContact O-N 3.37Å; C863-C868 PolarHBondContact N-O 2.93Å
869	C	48.7	Very low	48.7	Very low	29 Å²	29	72.5 Å²	72.5	20%	0.196	38%	0.382	C	S	.	.			trans	-74	155.9	-166.1	-61.7	0	0	0	0	114.5	A861 V871 I877 Y878 S879	A861-C869 WeakPolarHBondContact CB-O 3.32Å; C869-V871 PolarHBondContact O-N 3.39Å; C869-I877 HydrophobicContact CB-CG2 3.25Å; C869-I877 VanDerWaalsContact SG-CG2 3.59Å; C869-Y878 CarbonylContact C-O 3.48Å; C869-Y878 WeakPolarHBondContact CA-O 3.38Å; C869-Y878 VanDerWaalsContact CB-C 3.46Å; C869-Y878 WeakPolarHBondContact CB-O 3.39Å; C869-S879 WeakPolarHBondContact SG-CA 3.47Å
870	L	45.8	Very low	48.3	Very low	82 Å²	82	72.4 Å²	72.4	43%	0.429	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	129.3	164.3	-70.9	167.9	0	0	0	108.4	Y878	L870-Y878 PolarHBondContact N-O 3.34Å; L870-Y878 PolarHBondContact O-N 3.25Å
871	V	45.1	Very low	48	Very low	68 Å²	68	68.6 Å²	68.6	41%	0.412	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	118.9	171.7	-174.1	0	0	0	0	107.3	A861 C869 R876 I877	A861-V871 HydrophobicContact CB-CG2 4.28Å; C869-V871 PolarHBondContact O-N 3.39Å; V871-R876 CarbonylContact C-O 3.51Å; V871-R876 VanDerWaalsContact CA-O 3.24Å; V871-R876 WeakPolarHBondContact CA-O 3.46Å; V871-I877 HydrophobicContact CG2-CG1 4.21Å
872	D	47.7	Very low	47.4	Very low	48 Å²	48	72.8 Å²	72.8	26%	0.257	38%	0.381	S	S	.	.			trans	-73.4	171.1	175.2	67	22.6	0	0	0	112	T874 G875 R876 Y878	D872-T874 VanDerWaalsContact CG-OG1 3.26Å; D872-T874 PolarHBondContact O-N 3.28Å; D872-T874 VanDerWaalsContact O-N 3.08Å; D872-T874 WeakPolarHBondContact OD1-CA 3.43Å; D872-T874 WeakPolarHBondContact OD1-CB 3.36Å; D872-T874 PolarHBondContact OD1-N 3.3Å; D872-T874 PolarHBondContact OD1-OG1 3.39Å; D872-T874 PolarHBondContact OD2-OG1 3.2Å; D872-G875 PolarHBondContact O-N 2.98Å; D872-G875 PolarHBondContact OD1-N 3.09Å; D872-G875 VanDerWaalsContact OD1-N 3.12Å; D872-R876 PolarHBondContact N-O 3.1Å; D872-R876 WeakPolarHBondContact OD1-CB 3.31Å; D872-R876 PolarHBondContact OD1-N 3.08Å; D872-R876 WeakPolarHBondContact OD2-CB 3.5Å; D872-Y878 HydrophobicContact CB-CE2 3.88Å; D872-Y878 VanDerWaalsContact OD2-CE2 3.27Å; D872-Y878 WeakPolarHBondContact OD2-CE2 3.07Å; D872-Y878 PolarHBondContact OD2-OH 3.05Å
873	E	46	Very low	46.4	Very low	208 Å²	208	80.6 Å²	80.6	97%	0.972	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-19.5	178.5	-61.8	-176.1	171.4	0	0	113.2	G875	E873-G875 VanDerWaalsContact C-N 3.29Å
874	T	50	Low	45.8	Very low	105 Å²	105	90.3 Å²	90.3	64%	0.644	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-2.7	176	75.1	0	0	0	0	113.2	D872 R876	D872-T874 VanDerWaalsContact CG-OG1 3.26Å; D872-T874 PolarHBondContact O-N 3.28Å; D872-T874 VanDerWaalsContact O-N 3.08Å; D872-T874 WeakPolarHBondContact OD1-CA 3.43Å; D872-T874 WeakPolarHBondContact OD1-CB 3.36Å; D872-T874 PolarHBondContact OD1-N 3.3Å; D872-T874 PolarHBondContact OD1-OG1 3.39Å; D872-T874 PolarHBondContact OD2-OG1 3.2Å; T874-R876 WeakPolarHBondContact OG1-CG 3.37Å
875	G	42.9	Very low	45.8	Very low	50 Å²	50	94.3 Å²	94.3	52%	0.515	48%	0.482	S	S	.	.			trans	82.1	12.4	-177.8	0	0	0	0	0	114	D872 E873	D872-G875 PolarHBondContact O-N 2.98Å; D872-G875 PolarHBondContact OD1-N 3.09Å; D872-G875 VanDerWaalsContact OD1-N 3.12Å; E873-G875 VanDerWaalsContact C-N 3.29Å
876	R	43.4	Very low	45	Very low	169 Å²	169	97.4 Å²	97.4	64%	0.638	50%	0.498	S	S	*	.			trans	-81.1	135.1	176.1	-66.4	175.6	176.2	-165.8	-0	110.5	V871 D872 T874 Y878	V871-R876 CarbonylContact C-O 3.51Å; V871-R876 VanDerWaalsContact CA-O 3.24Å; V871-R876 WeakPolarHBondContact CA-O 3.46Å; D872-R876 PolarHBondContact N-O 3.1Å; D872-R876 WeakPolarHBondContact OD1-CB 3.31Å; D872-R876 PolarHBondContact OD1-N 3.08Å; D872-R876 WeakPolarHBondContact OD2-CB 3.5Å; T874-R876 WeakPolarHBondContact OG1-CG 3.37Å; R876-Y878 HydrophobicContact CB-CE2 4.17Å
877	I	47.4	Very low	44.5	Very low	123 Å²	123	102.7 Å²	102.7	63%	0.631	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	115.6	-174.4	-55.9	178.3	0	0	0	108.3	C869 V871	C869-I877 HydrophobicContact CB-CG2 3.25Å; C869-I877 VanDerWaalsContact SG-CG2 3.59Å; V871-I877 HydrophobicContact CG2-CG1 4.21Å
878	Y	45.7	Very low	43.8	Very low	117 Å²	117	105.8 Å²	105.8	46%	0.459	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	113.5	173.1	-57.4	-88.9	0	0	0	109.8	C869 L870 D872 R876 R880	C869-Y878 CarbonylContact C-O 3.48Å; C869-Y878 WeakPolarHBondContact CA-O 3.38Å; C869-Y878 VanDerWaalsContact CB-C 3.46Å; C869-Y878 WeakPolarHBondContact CB-O 3.39Å; L870-Y878 PolarHBondContact N-O 3.34Å; L870-Y878 PolarHBondContact O-N 3.25Å; D872-Y878 HydrophobicContact CB-CE2 3.88Å; D872-Y878 VanDerWaalsContact OD2-CE2 3.27Å; D872-Y878 WeakPolarHBondContact OD2-CE2 3.07Å; D872-Y878 PolarHBondContact OD2-OH 3.05Å; R876-Y878 HydrophobicContact CB-CE2 4.17Å; Y878-R880 PolarHBondContact O-N 3.48Å
879	S	47.7	Very low	43.6	Very low	66 Å²	66	111.7 Å²	111.7	46%	0.462	57%	0.57	S	S	.	*			trans	-59.5	128.7	165.2	65.3	0	0	0	0	108.2	C869 F881	C869-S879 WeakPolarHBondContact SG-CA 3.47Å; S879-F881 VanDerWaalsContact CB-O 3.32Å; S879-F881 WeakPolarHBondContact CB-O 3.3Å; S879-F881 PolarHBondContact O-N 3.42Å; S879-F881 PolarHBondContact OG-O 2.97Å
880	R	47.6	Very low	43.2	Very low	122 Å²	122	117.2 Å²	117.2	46%	0.46	60%	0.595	S	S	.	*	S	Bend	trans	-64.5	-20.5	178.2	-149.7	-179.7	-154.2	-176.2	7	111.6	Y878	Y878-R880 PolarHBondContact O-N 3.48Å
881	F	41.1	Very low	43	Very low	84 Å²	84	119.7 Å²	119.7	37%	0.368	61%	0.606	S	S	.	*	S	Bend	trans	-115.5	107.2	171.2	-50.2	-67.7	0	0	0	107.4	A766 L769 D867 S879 N883	A766-F881 HydrophobicContact CB-CD1 4.25Å; A766-F881 HydrophobicContact CB-CE1 3.44Å; A766-F881 VanDerWaalsContact CB-CE1 3.44Å; A766-F881 HydrophobicContact CB-CZ 4.07Å; L769-F881 HydrophobicContact CD1-CZ 4.09Å; D867-F881 HydrophobicContact CB-CE2 4.5Å; D867-F881 WeakPolarHBondContact OD2-CE2 3.38Å; S879-F881 VanDerWaalsContact CB-O 3.32Å; S879-F881 WeakPolarHBondContact CB-O 3.3Å; S879-F881 PolarHBondContact O-N 3.42Å; S879-F881 PolarHBondContact OG-O 2.97Å; F881-N883 PolarHBondContact O-N 3.32Å
882	T	35.8	Very low	42.9	Very low	101 Å²	101	123.7 Å²	123.7	62%	0.62	62%	0.621	S	S	*	*			trans	-65.2	126.5	155.3	40.7	0	0	0	0	106.2	E884	T882-E884 PolarHBondContact O-N 2.71Å
883	N	31.6	Very low	42.5	Very low	168 Å²	168	130 Å²	130	90%	0.898	65%	0.652	S	S	*	*			trans	-67.2	85.3	164.2	-78.9	-20	0	0	0	107.2	F881	F881-N883 PolarHBondContact O-N 3.32Å
884	E	30.2	Very low	42.1	Very low	247 Å²	247	122.9 Å²	122.9	100%	1.154	62%	0.623	S	S	*	*			trans	-129.4	0	158.1	-74.7	-171.1	166.7	0	0	107.1	T882	T882-E884 PolarHBondContact O-N 2.71Å

Retrieved 884 of 884 residues in 1136.1 ms (Link to these results)

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