A0A3Q0KIX9_SCHMA Loading...

Putative jnk/sapk-associated protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KIX9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 639 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	33.4	Very low	49.9	Very low	224 Å²	224	138.8 Å²	138.8	100%	1.103	68%	0.682	S	S	*	*				0	93.9	0	-74.5	-68.1	-164.1	0	0	106.6	F3	M1-F3 HydrophobicContact CB-CE2 4.38Å; M1-F3 PolarHBondContact O-N 3.02Å
2	D	27.5	Very low	52.8	Low	169 Å²	169	142.3 Å²	142.3	90%	0.904	68%	0.682	S	S	*	*			trans	-84.6	102.2	-172.9	-149.3	4.2	0	0	0	107.9	G4	D2-G4 PolarHBondContact O-N 3.04Å
3	F	36.5	Very low	55.6	Low	196 Å²	196	131.4 Å²	131.4	86%	0.86	63%	0.63	S	S	*	*			trans	-89.9	94.6	176.6	-81.3	-77.8	0	0	0	109.1	M1	M1-F3 HydrophobicContact CB-CE2 4.38Å; M1-F3 PolarHBondContact O-N 3.02Å
4	G	30.3	Very low	57.9	Low	58 Å²	58	129.6 Å²	129.6	60%	0.598	62%	0.615	S	S	*	*			trans	-63.6	130.1	177	0	0	0	0	0	113.4	D2 E6	D2-G4 PolarHBondContact O-N 3.04Å; G4-E6 VanDerWaalsContact C-N 3.25Å; G4-E6 PolarHBondContact O-N 2.89Å
5	K	35.6	Very low	59.9	Low	219 Å²	219	127.3 Å²	127.3	95%	0.952	60%	0.603	S	S	*	*	S	Bend	trans	36.1	15.5	136.2	-66.9	-177.2	178.9	177.4	0	122.3
6	E	39.4	Very low	61.8	Low	173 Å²	173	123.5 Å²	123.5	81%	0.808	59%	0.587	S	S	*	*	S	Bend	trans	-105	108	172.6	-74.7	-178.1	168.8	0	0	111.9	G4	G4-E6 VanDerWaalsContact C-N 3.25Å; G4-E6 PolarHBondContact O-N 2.89Å
7	Q	53.2	Low	63.5	Low	101 Å²	101	116.2 Å²	116.2	47%	0.472	55%	0.553	S	S	.	*			trans	53.2	81.1	161	-78.8	161.5	-1.2	0	0	116.9	I9	Q7-I9 PolarHBondContact O-N 3.43Å
8	R	58.7	Low	64.9	Low	250 Å²	250	114.2 Å²	114.2	94%	0.943	54%	0.543	S	S	*	.			trans	-70.3	94.4	159.7	-69.2	-170.9	-178	-168	1.5	109.1	S10	R8-S10 PolarHBondContact O-N 2.94Å
9	I	70.3	Confident	66.2	Low	24 Å²	24	113.5 Å²	113.5	12%	0.123	54%	0.542	C	S	.	.			trans	-49.7	137	164.4	-64.4	158.3	0	0	0	108.2	Q7 V13 S587 L590	Q7-I9 PolarHBondContact O-N 3.43Å; I9-V13 HydrophobicContact CG2-CB 3.65Å; I9-V13 HydrophobicContact CG2-CG1 3.6Å; I9-S587 WeakPolarHBondContact CG1-OG 3.43Å; I9-L590 HydrophobicContact CD1-CD2 4.09Å; I9-L590 HydrophobicContact CD1-CG 3.81Å; I9-L590 HydrophobicContact CG1-CG 4.37Å
10	S	80.8	Confident	67.4	Low	18 Å²	18	109.6 Å²	109.6	13%	0.126	52%	0.524	C	S	.	.			trans	-50.3	133.4	176.8	167.3	0	0	0	0	110.2	R8 R12 V13 Y14 D51 T54	R8-S10 PolarHBondContact O-N 2.94Å; S10-R12 PolarHBondContact O-N 2.79Å; S10-V13 WeakPolarHBondContact O-CA 3.18Å; S10-V13 WeakPolarHBondContact O-CB 3.39Å; S10-V13 PolarHBondContact O-N 3.36Å; S10-Y14 PolarHBondContact O-N 3.44Å; S10-D51 PolarHBondContact N-OD1 2.84Å; S10-T54 VanDerWaalsContact CB-OG1 3.27Å; S10-T54 WeakPolarHBondContact CB-OG1 3.49Å
11	P	82.7	Confident	68.4	Low	95 Å²	95	106.3 Å²	106.3	62%	0.617	51%	0.506	S	S	*	.	H	α-helix	trans	-53.2	-32.4	-177.9	-25.6	32.2	0	0	0	112.7	Q15	P11-Q15 WeakPolarHBondContact O-CB 3.48Å; P11-Q15 VanDerWaalsContact O-CG 3.24Å; P11-Q15 WeakPolarHBondContact O-CG 3.44Å; P11-Q15 PolarHBondContact O-N 3.16Å
12	R	85.2	Confident	70.9	Confident	181 Å²	181	104.2 Å²	104.2	68%	0.683	49%	0.486	S	S	*	.	H	α-helix	trans	-71.2	-42.9	177.3	-171.9	58.7	173.5	-179.8	-0.5	112.2	S10 Y14 Q15 L16	S10-R12 PolarHBondContact O-N 2.79Å; R12-Y14 VanDerWaalsContact C-N 3.32Å; R12-Q15 PolarHBondContact O-N 3.44Å; R12-L16 PolarHBondContact O-N 3.25Å
13	V	89.1	Confident	73.7	Confident	0 Å²	0	102.1 Å²	102.1	0%	0	47%	0.471	C	S	.	.	H	α-helix	trans	-64.5	-41	175	178.6	0	0	0	0	110	I9 S10 L16 A17 L47 M50 D51 T54 L590	I9-V13 HydrophobicContact CG2-CB 3.65Å; I9-V13 HydrophobicContact CG2-CG1 3.6Å; S10-V13 WeakPolarHBondContact O-CA 3.18Å; S10-V13 WeakPolarHBondContact O-CB 3.39Å; S10-V13 PolarHBondContact O-N 3.36Å; V13-L16 PolarHBondContact O-N 2.97Å; V13-A17 VanDerWaalsContact O-CB 3.3Å; V13-A17 WeakPolarHBondContact O-CB 3.3Å; V13-A17 PolarHBondContact O-N 2.94Å; V13-L47 HydrophobicContact CG1-CB 4.42Å; V13-L47 HydrophobicContact CG1-CD2 4.18Å; V13-M50 HydrophobicContact CB-CE 3.77Å; V13-M50 HydrophobicContact CG1-CE 3.81Å; V13-M50 HydrophobicContact CG2-CB 4.47Å; V13-M50 HydrophobicContact CG2-CE 3.47Å; V13-M50 VanDerWaalsContact CG2-CE 3.47Å; V13-M50 HydrophobicContact CG2-CG 4.14Å; V13-D51 HydrophobicContact CG1-CB 4.18Å; V13-D51 HydrophobicContact CG2-CB 4.18Å; V13-T54 HydrophobicContact CG2-CG2 4.18Å; V13-L590 HydrophobicContact CG1-CD1 4.34Å; V13-L590 HydrophobicContact CG1-CD2 4.4Å
14	Y	87.8	Confident	76.1	Confident	106 Å²	106	93.2 Å²	93.2	42%	0.416	43%	0.432	S	S	.	.	H	α-helix	trans	-63.2	-45.2	177	-177.6	-100.1	0	0	0	112.4	S10 R12 L16 A17 Q18 M593	S10-Y14 PolarHBondContact O-N 3.44Å; R12-Y14 VanDerWaalsContact C-N 3.32Å; Y14-L16 VanDerWaalsContact C-N 3.34Å; Y14-L16 PolarHBondContact O-N 3.39Å; Y14-A17 PolarHBondContact O-N 3.5Å; Y14-Q18 HydrophobicContact CD1-CG 4.49Å; Y14-Q18 HydrophobicContact CE1-CG 4.16Å; Y14-Q18 VanDerWaalsContact CZ-NE2 3.28Å; Y14-Q18 WeakPolarHBondContact O-CG 3.46Å; Y14-Q18 PolarHBondContact O-N 3.04Å; Y14-Q18 PolarHBondContact OH-NE2 3.32Å; Y14-Q18 VanDerWaalsContact OH-NE2 3.12Å; Y14-M593 HydrophobicContact CD2-CE 3.58Å; Y14-M593 HydrophobicContact CE2-CE 3.39Å
15	Q	88.3	Confident	78.6	Confident	95 Å²	95	94.3 Å²	94.3	44%	0.444	42%	0.421	S	S	.	.	H	α-helix	trans	-60	-43.8	173.8	-75.7	169.7	9.3	0	0	111.8	P11 R12 Q18 I19	P11-Q15 WeakPolarHBondContact O-CB 3.48Å; P11-Q15 VanDerWaalsContact O-CG 3.24Å; P11-Q15 WeakPolarHBondContact O-CG 3.44Å; P11-Q15 PolarHBondContact O-N 3.16Å; R12-Q15 PolarHBondContact O-N 3.44Å; Q15-Q18 PolarHBondContact O-N 2.82Å; Q15-I19 WeakPolarHBondContact O-CG1 3.47Å; Q15-I19 PolarHBondContact O-N 2.88Å; Q15-I19 VanDerWaalsContact O-N 3.11Å
16	L	90.7	Very high	80.9	Confident	67 Å²	67	87.6 Å²	87.6	35%	0.351	40%	0.398	S	S	.	.	H	α-helix	trans	-64.8	-43.5	177.9	-172.2	63.3	0	0	0	111.2	R12 V13 Y14 Q18 I19 I20 L47 M50	R12-L16 PolarHBondContact O-N 3.25Å; V13-L16 PolarHBondContact O-N 2.97Å; Y14-L16 VanDerWaalsContact C-N 3.34Å; Y14-L16 PolarHBondContact O-N 3.39Å; L16-Q18 VanDerWaalsContact C-N 3.28Å; L16-Q18 PolarHBondContact O-N 2.91Å; L16-I19 PolarHBondContact O-N 3.43Å; L16-I20 HydrophobicContact CD1-CD1 4.25Å; L16-I20 HydrophobicContact CD1-CG1 4.44Å; L16-I20 HydrophobicContact CD2-CD1 4.23Å; L16-I20 HydrophobicContact CG-CD1 3.74Å; L16-I20 HydrophobicContact CG-CG1 4.34Å; L16-I20 WeakPolarHBondContact O-CB 3.34Å; L16-I20 VanDerWaalsContact O-CG1 3.25Å; L16-I20 WeakPolarHBondContact O-CG1 3.27Å; L16-I20 PolarHBondContact O-N 3.09Å; L16-L47 HydrophobicContact CB-CD2 4.33Å; L16-L47 HydrophobicContact CD2-CD2 3.96Å; L16-L47 HydrophobicContact CG-CD2 4.17Å; L16-M50 HydrophobicContact CB-CE 4.2Å; L16-M50 HydrophobicContact CD2-CE 3.53Å; L16-M50 HydrophobicContact CD2-SD 3.91Å; L16-M50 HydrophobicContact CG-CE 4.46Å
17	A	89.7	Confident	82.8	Confident	0 Å²	0	81.7 Å²	81.7	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-58.3	-39.4	175.8	0	0	0	0	0	111.9	V13 Y14 Y21 L47 L590 M593 F594	V13-A17 VanDerWaalsContact O-CB 3.3Å; V13-A17 WeakPolarHBondContact O-CB 3.3Å; V13-A17 PolarHBondContact O-N 2.94Å; Y14-A17 PolarHBondContact O-N 3.5Å; A17-Y21 WeakPolarHBondContact O-CB 3.28Å; A17-Y21 PolarHBondContact O-N 2.86Å; A17-L47 HydrophobicContact CB-CD1 3.85Å; A17-L47 HydrophobicContact CB-CD2 4.47Å; A17-L590 HydrophobicContact CB-CD2 3.68Å; A17-M593 HydrophobicContact CB-CE 3.99Å; A17-M593 HydrophobicContact CB-SD 3.64Å; A17-F594 HydrophobicContact CB-CE2 4.14Å
18	Q	88.6	Confident	84	Confident	80 Å²	80	80.3 Å²	80.3	37%	0.374	36%	0.364	S	S	.	.	H	α-helix	trans	-65.2	-42.6	175	-74.6	-175.5	-16.7	0	0	113.3	Y14 Q15 L16 Y21 R22	Y14-Q18 HydrophobicContact CD1-CG 4.49Å; Y14-Q18 HydrophobicContact CE1-CG 4.16Å; Y14-Q18 VanDerWaalsContact CZ-NE2 3.28Å; Y14-Q18 WeakPolarHBondContact O-CG 3.46Å; Y14-Q18 PolarHBondContact O-N 3.04Å; Y14-Q18 PolarHBondContact OH-NE2 3.32Å; Y14-Q18 VanDerWaalsContact OH-NE2 3.12Å; Q15-Q18 PolarHBondContact O-N 2.82Å; L16-Q18 VanDerWaalsContact C-N 3.28Å; L16-Q18 PolarHBondContact O-N 2.91Å; Q18-Y21 PolarHBondContact O-N 3.26Å; Q18-R22 WeakPolarHBondContact O-CG 3.12Å; Q18-R22 PolarHBondContact O-N 3.07Å
19	I	90.6	Very high	85	Confident	101 Å²	101	76.8 Å²	76.8	52%	0.518	36%	0.355	S	S	.	.	H	α-helix	trans	-62.5	-49.5	177.2	-66.3	165.1	0	0	0	109.2	Q15 L16 Y21 R22 E23	Q15-I19 WeakPolarHBondContact O-CG1 3.47Å; Q15-I19 PolarHBondContact O-N 2.88Å; Q15-I19 VanDerWaalsContact O-N 3.11Å; L16-I19 PolarHBondContact O-N 3.43Å; I19-Y21 VanDerWaalsContact C-N 3.33Å; I19-Y21 PolarHBondContact O-N 3.5Å; I19-R22 WeakPolarHBondContact O-CB 2.78Å; I19-R22 PolarHBondContact O-N 3.49Å; I19-E23 PolarHBondContact O-N 2.87Å; I19-E23 VanDerWaalsContact O-N 3.08Å
20	I	89.7	Confident	85.5	Confident	35 Å²	35	80.4 Å²	80.4	18%	0.179	38%	0.378	C	S	.	.	H	α-helix	trans	-59.5	-44.1	177.9	-71.5	173.9	0	0	0	111	L16 R22 E23 F24 V43 L47 F594	L16-I20 HydrophobicContact CD1-CD1 4.25Å; L16-I20 HydrophobicContact CD1-CG1 4.44Å; L16-I20 HydrophobicContact CD2-CD1 4.23Å; L16-I20 HydrophobicContact CG-CD1 3.74Å; L16-I20 HydrophobicContact CG-CG1 4.34Å; L16-I20 WeakPolarHBondContact O-CB 3.34Å; L16-I20 VanDerWaalsContact O-CG1 3.25Å; L16-I20 WeakPolarHBondContact O-CG1 3.27Å; L16-I20 PolarHBondContact O-N 3.09Å; I20-R22 VanDerWaalsContact C-N 3.34Å; I20-R22 PolarHBondContact O-N 2.97Å; I20-E23 PolarHBondContact O-N 3.19Å; I20-F24 HydrophobicContact CG2-CD2 3.58Å; I20-F24 HydrophobicContact CG2-CE2 3.3Å; I20-F24 HydrophobicContact CG2-CZ 4.46Å; I20-F24 WeakPolarHBondContact O-CD2 3.37Å; I20-F24 PolarHBondContact O-N 3.36Å; I20-V43 HydrophobicContact CD1-CG1 3.81Å; I20-V43 HydrophobicContact CG2-CG1 3.54Å; I20-L47 HydrophobicContact CD1-CD1 4.18Å; I20-L47 HydrophobicContact CD1-CD2 4.1Å; I20-L47 HydrophobicContact CD1-CG 4.37Å; I20-F594 HydrophobicContact CB-CZ 4.3Å; I20-F594 HydrophobicContact CG2-CE1 3.79Å; I20-F594 HydrophobicContact CG2-CZ 3.69Å
21	Y	87.9	Confident	85.2	Confident	41 Å²	41	86.2 Å²	86.2	16%	0.161	40%	0.401	C	S	.	.	H	α-helix	trans	-60.8	-41.6	178.1	-179.6	-87.9	0	0	0	111.8	A17 Q18 I19 F24 E25 M593 F594 R596 L597	A17-Y21 WeakPolarHBondContact O-CB 3.28Å; A17-Y21 PolarHBondContact O-N 2.86Å; Q18-Y21 PolarHBondContact O-N 3.26Å; I19-Y21 VanDerWaalsContact C-N 3.33Å; I19-Y21 PolarHBondContact O-N 3.5Å; Y21-F24 PolarHBondContact O-N 3.29Å; Y21-E25 HydrophobicContact CD1-CG 4.25Å; Y21-E25 HydrophobicContact CE1-CG 3.79Å; Y21-E25 WeakPolarHBondContact CE1-OE1 3.35Å; Y21-E25 PolarHBondContact O-N 2.66Å; Y21-E25 PolarHBondContact OH-OE1 3.08Å; Y21-E25 VanDerWaalsContact OH-OE1 3.14Å; Y21-M593 HydrophobicContact CD2-CG 4.2Å; Y21-M593 WeakPolarHBondContact CE2-O 3.25Å; Y21-F594 HydrophobicContact CD2-CD1 4.45Å; Y21-R596 HydrophobicContact CE2-CB 4.37Å; Y21-L597 HydrophobicContact CD2-CD1 3.58Å; Y21-L597 HydrophobicContact CD2-CG 4.05Å; Y21-L597 HydrophobicContact CE2-CD1 3.73Å; Y21-L597 HydrophobicContact CE2-CD2 4.29Å; Y21-L597 HydrophobicContact CE2-CG 3.64Å; Y21-L597 HydrophobicContact CG-CD1 4.45Å
22	R	86.8	Confident	84.7	Confident	180 Å²	180	83.1 Å²	83.1	68%	0.679	39%	0.387	S	S	*	.	H	α-helix	trans	-62	-41.8	174.2	-75	179.1	-179.9	-125.8	1.5	112.2	Q18 I19 I20 E25 V26	Q18-R22 WeakPolarHBondContact O-CG 3.12Å; Q18-R22 PolarHBondContact O-N 3.07Å; I19-R22 WeakPolarHBondContact O-CB 2.78Å; I19-R22 PolarHBondContact O-N 3.49Å; I20-R22 VanDerWaalsContact C-N 3.34Å; I20-R22 PolarHBondContact O-N 2.97Å; R22-E25 WeakPolarHBondContact O-CB 3.13Å; R22-E25 PolarHBondContact O-N 3.27Å; R22-V26 WeakPolarHBondContact O-CG2 3.05Å; R22-V26 PolarHBondContact O-N 3.22Å
23	E	85.8	Confident	84.1	Confident	124 Å²	124	79.7 Å²	79.7	58%	0.579	38%	0.379	S	S	*	.	H	α-helix	trans	-64.4	-39.9	175.9	-68.8	-58.3	147.4	0	0	111.7	I19 I20 E25 V26 M27	I19-E23 PolarHBondContact O-N 2.87Å; I19-E23 VanDerWaalsContact O-N 3.08Å; I20-E23 PolarHBondContact O-N 3.19Å; E23-E25 VanDerWaalsContact C-N 3.33Å; E23-E25 PolarHBondContact O-N 2.89Å; E23-V26 PolarHBondContact O-N 3.08Å; E23-M27 WeakPolarHBondContact O-CB 3.43Å; E23-M27 PolarHBondContact O-N 3.27Å
24	F	86.7	Confident	83.1	Confident	9 Å²	9	85.1 Å²	85.1	4%	0.039	42%	0.417	C	S	.	.	H	α-helix	trans	-65.6	-34.1	172.6	-77.3	-64.2	0	0	0	112.8	I20 Y21 M27 K28 Y36 L39 V40 V43 F594 L597	I20-F24 HydrophobicContact CG2-CD2 3.58Å; I20-F24 HydrophobicContact CG2-CE2 3.3Å; I20-F24 HydrophobicContact CG2-CZ 4.46Å; I20-F24 WeakPolarHBondContact O-CD2 3.37Å; I20-F24 PolarHBondContact O-N 3.36Å; Y21-F24 PolarHBondContact O-N 3.29Å; F24-M27 HydrophobicContact CD1-CE 3.45Å; F24-M27 VanDerWaalsContact CD1-CE 3.45Å; F24-M27 HydrophobicContact CE1-CE 3.49Å; F24-M27 VanDerWaalsContact CE1-CE 3.49Å; F24-M27 PolarHBondContact O-N 3.03Å; F24-K28 VanDerWaalsContact O-CB 3.27Å; F24-K28 WeakPolarHBondContact O-CB 3.41Å; F24-K28 PolarHBondContact O-N 2.95Å; F24-Y36 HydrophobicContact CD1-CD2 4.23Å; F24-Y36 HydrophobicContact CD1-CG 4.11Å; F24-L39 HydrophobicContact CE1-CB 4.31Å; F24-L39 HydrophobicContact CE1-CD2 3.89Å; F24-L39 HydrophobicContact CE1-CG 4.05Å; F24-L39 HydrophobicContact CZ-CD2 4.13Å; F24-L39 HydrophobicContact CZ-CG 3.97Å; F24-V40 HydrophobicContact CD1-CG2 3.6Å; F24-V40 HydrophobicContact CD2-CG2 4.1Å; F24-V40 HydrophobicContact CE1-CG2 3.4Å; F24-V40 VanDerWaalsContact CE1-CG2 3.4Å; F24-V40 HydrophobicContact CE2-CG2 3.87Å; F24-V40 HydrophobicContact CG-CG2 3.97Å; F24-V40 HydrophobicContact CZ-CB 4.31Å; F24-V40 HydrophobicContact CZ-CG2 3.54Å; F24-V43 HydrophobicContact CE2-CB 4.31Å; F24-V43 HydrophobicContact CE2-CG1 4.23Å; F24-V43 HydrophobicContact CE2-CG2 4.4Å; F24-V43 HydrophobicContact CZ-CB 4.32Å; F24-V43 HydrophobicContact CZ-CG2 4.04Å; F24-F594 HydrophobicContact CD2-CD1 4.32Å; F24-F594 AromaticContact CD2-CE1 3.72Å; F24-F594 HydrophobicContact CD2-CE1 3.72Å; F24-F594 AromaticContact CE2-CE1 3.89Å; F24-F594 HydrophobicContact CE2-CE1 3.89Å; F24-L597 HydrophobicContact CB-CD1 3.54Å; F24-L597 HydrophobicContact CB-CD2 4.03Å; F24-L597 HydrophobicContact CB-CG 4.43Å; F24-L597 HydrophobicContact CD2-CD1 4.31Å; F24-L597 HydrophobicContact CG-CD1 4.14Å
25	E	82.8	Confident	82.4	Confident	81 Å²	81	82.9 Å²	82.9	38%	0.379	42%	0.42	S	S	.	.	H	α-helix	trans	-65.4	-37.2	172	-77.3	-170	156.4	0	0	112.5	Y21 R22 E23 K29 L597	Y21-E25 HydrophobicContact CD1-CG 4.25Å; Y21-E25 HydrophobicContact CE1-CG 3.79Å; Y21-E25 WeakPolarHBondContact CE1-OE1 3.35Å; Y21-E25 PolarHBondContact O-N 2.66Å; Y21-E25 PolarHBondContact OH-OE1 3.08Å; Y21-E25 VanDerWaalsContact OH-OE1 3.14Å; R22-E25 WeakPolarHBondContact O-CB 3.13Å; R22-E25 PolarHBondContact O-N 3.27Å; E23-E25 VanDerWaalsContact C-N 3.33Å; E23-E25 PolarHBondContact O-N 2.89Å; E25-K29 WeakPolarHBondContact O-CG 3.31Å; E25-K29 PolarHBondContact O-N 3.47Å; E25-L597 HydrophobicContact CG-CD2 4.06Å
26	V	83.8	Confident	81.8	Confident	78 Å²	78	78.4 Å²	78.4	47%	0.473	40%	0.399	S	S	.	.	H	α-helix	trans	-67	-45.4	172.8	174.7	0	0	0	0	110.4	R22 E23 K28 K29 V30	R22-V26 WeakPolarHBondContact O-CG2 3.05Å; R22-V26 PolarHBondContact O-N 3.22Å; E23-V26 PolarHBondContact O-N 3.08Å; V26-K28 VanDerWaalsContact C-N 3.31Å; V26-K28 PolarHBondContact O-N 3.35Å; V26-K29 WeakPolarHBondContact O-CB 3.31Å; V26-K29 PolarHBondContact O-N 3.26Å; V26-V30 PolarHBondContact O-N 3.48Å; V26-V30 VanDerWaalsContact O-N 3.15Å
27	M	80.2	Confident	81.1	Confident	50 Å²	50	76.5 Å²	76.5	25%	0.246	40%	0.396	C	S	.	.	H	α-helix	trans	-63.9	-36.4	178.7	-170.9	150.9	64.5	0	0	112.2	E23 F24 K29 V30 F31 Y36 L39	E23-M27 WeakPolarHBondContact O-CB 3.43Å; E23-M27 PolarHBondContact O-N 3.27Å; F24-M27 HydrophobicContact CD1-CE 3.45Å; F24-M27 VanDerWaalsContact CD1-CE 3.45Å; F24-M27 HydrophobicContact CE1-CE 3.49Å; F24-M27 VanDerWaalsContact CE1-CE 3.49Å; F24-M27 PolarHBondContact O-N 3.03Å; M27-K29 VanDerWaalsContact C-N 3.29Å; M27-K29 PolarHBondContact O-N 3.45Å; M27-V30 PolarHBondContact O-N 3.29Å; M27-F31 HydrophobicContact CG-CD2 3.91Å; M27-F31 PolarHBondContact O-N 3.16Å; M27-Y36 HydrophobicContact CE-CG 4.42Å; M27-Y36 HydrophobicContact CG-CD1 4.39Å; M27-L39 HydrophobicContact CE-CD2 4.04Å
28	K	78.5	Confident	80.8	Confident	71 Å²	71	79.2 Å²	79.2	31%	0.309	42%	0.424	S	S	.	.	H	α-helix	trans	-59.2	-38.5	171.6	-177.7	174.6	-175.8	151.4	0	112.4	F24 V26 G32 E33 Y36	F24-K28 VanDerWaalsContact O-CB 3.27Å; F24-K28 WeakPolarHBondContact O-CB 3.41Å; F24-K28 PolarHBondContact O-N 2.95Å; V26-K28 VanDerWaalsContact C-N 3.31Å; V26-K28 PolarHBondContact O-N 3.35Å; K28-G32 PolarHBondContact O-N 2.73Å; K28-E33 WeakPolarHBondContact CE-OE1 3.28Å; K28-E33 HydrophobicContact CG-CG 4.47Å; K28-E33 IonicContact NZ-OE1 2.7Å; K28-E33 PolarHBondContact NZ-OE1 3.21Å; K28-Y36 HydrophobicContact CB-CE1 3.78Å; K28-Y36 WeakPolarHBondContact CD-OH 3.19Å; K28-Y36 HydrophobicContact CG-CE1 4.18Å; K28-Y36 WeakPolarHBondContact CG-OH 3.33Å
29	K	78.9	Confident	80.6	Confident	177 Å²	177	79.2 Å²	79.2	77%	0.77	43%	0.426	S	S	*	.	H	α-helix	trans	-72	-33.6	177.8	-70.7	174.2	-177.2	176.1	0	113.3	E25 V26 M27	E25-K29 WeakPolarHBondContact O-CG 3.31Å; E25-K29 PolarHBondContact O-N 3.47Å; V26-K29 WeakPolarHBondContact O-CB 3.31Å; V26-K29 PolarHBondContact O-N 3.26Å; M27-K29 VanDerWaalsContact C-N 3.29Å; M27-K29 PolarHBondContact O-N 3.45Å
30	V	80.4	Confident	80.3	Confident	99 Å²	99	74.4 Å²	74.4	60%	0.6	40%	0.402	S	S	*	.	H	α-helix	trans	-92.1	-43.2	-173	179.6	0	0	0	0	112.9	V26 M27	V26-V30 PolarHBondContact O-N 3.48Å; V26-V30 VanDerWaalsContact O-N 3.15Å; M27-V30 PolarHBondContact O-N 3.29Å
31	F	75.4	Confident	80.1	Confident	140 Å²	140	76.1 Å²	76.1	61%	0.614	42%	0.415	S	S	*	.	H	α-helix	trans	-112.8	-4.1	-168.6	-63.1	-83.7	0	0	0	114.3	M27 A35	M27-F31 HydrophobicContact CG-CD2 3.91Å; M27-F31 PolarHBondContact O-N 3.16Å; F31-A35 HydrophobicContact CB-CB 3.6Å
32	G	71.4	Confident	80.1	Confident	31 Å²	31	79.1 Å²	79.1	32%	0.32	43%	0.433	S	S	.	.			trans	74.6	172.6	-174.6	0	0	0	0	0	113.5	K28 S34 Y36	K28-G32 PolarHBondContact O-N 2.73Å; G32-S34 VanDerWaalsContact C-N 3.26Å; G32-S34 PolarHBondContact O-N 3.39Å; G32-Y36 WeakPolarHBondContact O-CE1 3.27Å
33	E	72.1	Confident	80.2	Confident	108 Å²	108	71.6 Å²	71.6	51%	0.505	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-67.6	-22.2	-172	-62.2	-171.6	155.4	0	0	114.1	K28 A35	K28-E33 WeakPolarHBondContact CE-OE1 3.28Å; K28-E33 HydrophobicContact CG-CG 4.47Å; K28-E33 IonicContact NZ-OE1 2.7Å; K28-E33 PolarHBondContact NZ-OE1 3.21Å; E33-A35 PolarHBondContact O-N 3.32Å
34	S	69.8	Low	80.3	Confident	114 Å²	114	66 Å²	66	80%	0.797	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-73.1	-25.2	-176	58.8	0	0	0	0	113.8	G32 Y36	G32-S34 VanDerWaalsContact C-N 3.26Å; G32-S34 PolarHBondContact O-N 3.39Å; S34-Y36 PolarHBondContact O-N 2.84Å
35	A	72.3	Confident	80.3	Confident	59 Å²	59	66.9 Å²	66.9	49%	0.488	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-73	-25.7	-172.2	0	0	0	0	0	113.9	F31 E33	F31-A35 HydrophobicContact CB-CB 3.6Å; E33-A35 PolarHBondContact O-N 3.32Å
36	Y	75.5	Confident	80.7	Confident	1 Å²	1	67.7 Å²	67.7	0%	0.004	40%	0.398	C	S	.	.	S	Bend	trans	-118.1	3.7	-171.8	62.3	-97.4	0	0	0	114.4	F24 M27 K28 G32 S34 G38 L39 V40 L597	F24-Y36 HydrophobicContact CD1-CD2 4.23Å; F24-Y36 HydrophobicContact CD1-CG 4.11Å; M27-Y36 HydrophobicContact CE-CG 4.42Å; M27-Y36 HydrophobicContact CG-CD1 4.39Å; K28-Y36 HydrophobicContact CB-CE1 3.78Å; K28-Y36 WeakPolarHBondContact CD-OH 3.19Å; K28-Y36 HydrophobicContact CG-CE1 4.18Å; K28-Y36 WeakPolarHBondContact CG-OH 3.33Å; G32-Y36 WeakPolarHBondContact O-CE1 3.27Å; S34-Y36 PolarHBondContact O-N 2.84Å; Y36-G38 VanDerWaalsContact C-N 3.3Å; Y36-G38 PolarHBondContact O-N 3.27Å; Y36-L39 PolarHBondContact O-N 2.97Å; Y36-V40 HydrophobicContact CD2-CG2 3.6Å; Y36-V40 HydrophobicContact CE2-CG2 4.34Å; Y36-V40 HydrophobicContact CG-CG2 4.47Å; Y36-V40 PolarHBondContact O-N 3.25Å; Y36-L597 HydrophobicContact CE2-CB 4.27Å; Y36-L597 PolarHBondContact OH-O 3Å; Y36-L597 VanDerWaalsContact OH-O 3.05Å
37	G	76.3	Confident	81	Confident	27 Å²	27	64 Å²	64	28%	0.278	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-34	-174.9	0	0	0	0	0	114.5	P41 F598	G37-P41 WeakPolarHBondContact O-CD 3.31Å; G37-F598 WeakPolarHBondContact O-CZ 3.3Å
38	G	82.3	Confident	81.4	Confident	58 Å²	58	62.5 Å²	62.5	60%	0.598	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-25.9	172.4	0	0	0	0	0	114	Y36 I42	Y36-G38 VanDerWaalsContact C-N 3.3Å; Y36-G38 PolarHBondContact O-N 3.27Å; G38-I42 WeakPolarHBondContact O-CD1 3.39Å; G38-I42 WeakPolarHBondContact O-CG1 3.44Å
39	L	84.8	Confident	81.8	Confident	79 Å²	79	65 Å²	65	41%	0.414	38%	0.381	S	S	.	.	H	α-helix	trans	-79.2	-41.5	-173.9	-175.2	59.9	0	0	0	112.2	F24 M27 Y36 I42 V43	F24-L39 HydrophobicContact CE1-CB 4.31Å; F24-L39 HydrophobicContact CE1-CD2 3.89Å; F24-L39 HydrophobicContact CE1-CG 4.05Å; F24-L39 HydrophobicContact CZ-CD2 4.13Å; F24-L39 HydrophobicContact CZ-CG 3.97Å; M27-L39 HydrophobicContact CE-CD2 4.04Å; Y36-L39 PolarHBondContact O-N 2.97Å; L39-I42 WeakPolarHBondContact O-CB 3.17Å; L39-I42 PolarHBondContact O-N 3.15Å; L39-V43 HydrophobicContact CD1-CG2 4.02Å; L39-V43 HydrophobicContact CG-CG2 4.08Å; L39-V43 WeakPolarHBondContact O-CG2 3.37Å; L39-V43 PolarHBondContact O-N 3.5Å
40	V	85.2	Confident	82.3	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	36%	0.357	C	S	.	.	H	α-helix	trans	-60.4	-45.5	-177.1	175.2	0	0	0	0	112.6	F24 Y36 I42 V43 V44 F594 F598	F24-V40 HydrophobicContact CD1-CG2 3.6Å; F24-V40 HydrophobicContact CD2-CG2 4.1Å; F24-V40 HydrophobicContact CE1-CG2 3.4Å; F24-V40 VanDerWaalsContact CE1-CG2 3.4Å; F24-V40 HydrophobicContact CE2-CG2 3.87Å; F24-V40 HydrophobicContact CG-CG2 3.97Å; F24-V40 HydrophobicContact CZ-CB 4.31Å; F24-V40 HydrophobicContact CZ-CG2 3.54Å; Y36-V40 HydrophobicContact CD2-CG2 3.6Å; Y36-V40 HydrophobicContact CE2-CG2 4.34Å; Y36-V40 HydrophobicContact CG-CG2 4.47Å; Y36-V40 PolarHBondContact O-N 3.25Å; V40-I42 VanDerWaalsContact C-N 3.28Å; V40-I42 PolarHBondContact O-N 3.08Å; V40-V43 PolarHBondContact O-N 3.4Å; V40-V44 HydrophobicContact CG1-CG2 4.06Å; V40-V44 WeakPolarHBondContact O-CB 3.43Å; V40-V44 VanDerWaalsContact O-CG2 3.29Å; V40-V44 WeakPolarHBondContact O-CG2 3.42Å; V40-V44 PolarHBondContact O-N 3.37Å; V40-F594 HydrophobicContact CG1-CB 3.86Å; V40-F594 HydrophobicContact CG1-CD1 3.6Å; V40-F594 HydrophobicContact CG1-CG 4.01Å; V40-F598 HydrophobicContact CB-CE2 3.47Å; V40-F598 VanDerWaalsContact CB-CE2 3.47Å; V40-F598 HydrophobicContact CB-CZ 3.75Å; V40-F598 HydrophobicContact CG1-CD2 4.26Å; V40-F598 HydrophobicContact CG1-CE2 3.45Å; V40-F598 VanDerWaalsContact CG1-CE2 3.45Å; V40-F598 HydrophobicContact CG1-CZ 4.26Å; V40-F598 HydrophobicContact CG2-CE2 4.12Å; V40-F598 HydrophobicContact CG2-CZ 4.27Å
41	P	85.1	Confident	82.8	Confident	70 Å²	70	55.4 Å²	55.4	46%	0.455	33%	0.334	S	S	.	.	H	α-helix	trans	-61.3	-34.9	177	-24.4	35.4	0	0	0	113.4	G37 G45 F598	G37-P41 WeakPolarHBondContact O-CD 3.31Å; P41-G45 PolarHBondContact O-N 2.88Å; P41-F598 HydrophobicContact CG-CZ 4.35Å
42	I	87.6	Confident	83.3	Confident	105 Å²	105	50.5 Å²	50.5	54%	0.538	31%	0.314	S	S	.	.	H	α-helix	trans	-66.2	-48	175.3	-63.4	169.8	0	0	0	109.6	G38 L39 V40 V44 G45 I46	G38-I42 WeakPolarHBondContact O-CD1 3.39Å; G38-I42 WeakPolarHBondContact O-CG1 3.44Å; L39-I42 WeakPolarHBondContact O-CB 3.17Å; L39-I42 PolarHBondContact O-N 3.15Å; V40-I42 VanDerWaalsContact C-N 3.28Å; V40-I42 PolarHBondContact O-N 3.08Å; I42-V44 PolarHBondContact O-N 2.99Å; I42-G45 CarbonylContact O-C 3.57Å; I42-G45 WeakPolarHBondContact O-CA 3.47Å; I42-G45 PolarHBondContact O-N 3.23Å; I42-G45 VanDerWaalsContact O-N 3.09Å; I42-I46 HydrophobicContact CG2-CD1 4.05Å; I42-I46 WeakPolarHBondContact O-CG1 3.4Å; I42-I46 PolarHBondContact O-N 2.88Å
43	V	89.4	Confident	84.2	Confident	22 Å²	22	54.2 Å²	54.2	13%	0.133	33%	0.326	C	S	.	.	H	α-helix	trans	-65.5	-39.5	179.5	175.5	0	0	0	0	111.7	I20 F24 L39 V40 G45 I46 L47	I20-V43 HydrophobicContact CD1-CG1 3.81Å; I20-V43 HydrophobicContact CG2-CG1 3.54Å; F24-V43 HydrophobicContact CE2-CB 4.31Å; F24-V43 HydrophobicContact CE2-CG1 4.23Å; F24-V43 HydrophobicContact CE2-CG2 4.4Å; F24-V43 HydrophobicContact CZ-CB 4.32Å; F24-V43 HydrophobicContact CZ-CG2 4.04Å; L39-V43 HydrophobicContact CD1-CG2 4.02Å; L39-V43 HydrophobicContact CG-CG2 4.08Å; L39-V43 WeakPolarHBondContact O-CG2 3.37Å; L39-V43 PolarHBondContact O-N 3.5Å; V40-V43 PolarHBondContact O-N 3.4Å; V43-G45 VanDerWaalsContact C-N 3.3Å; V43-G45 PolarHBondContact O-N 3.44Å; V43-I46 PolarHBondContact O-N 2.72Å; V43-L47 HydrophobicContact CG1-CD1 4.13Å; V43-L47 HydrophobicContact CG1-CG 4.43Å; V43-L47 WeakPolarHBondContact O-CB 3.44Å; V43-L47 VanDerWaalsContact O-CG 3.29Å; V43-L47 WeakPolarHBondContact O-CG 3.48Å; V43-L47 PolarHBondContact O-N 2.94Å
44	V	87.1	Confident	84.9	Confident	7 Å²	7	50.6 Å²	50.6	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-61.7	-40.9	171.1	172.6	0	0	0	0	110.3	V40 I42 L47 E48 L590 R591 F594	V40-V44 HydrophobicContact CG1-CG2 4.06Å; V40-V44 WeakPolarHBondContact O-CB 3.43Å; V40-V44 VanDerWaalsContact O-CG2 3.29Å; V40-V44 WeakPolarHBondContact O-CG2 3.42Å; V40-V44 PolarHBondContact O-N 3.37Å; I42-V44 PolarHBondContact O-N 2.99Å; V44-L47 PolarHBondContact O-N 2.98Å; V44-E48 HydrophobicContact CG1-CG 4.28Å; V44-E48 WeakPolarHBondContact O-CB 3.44Å; V44-E48 VanDerWaalsContact O-CG 3.25Å; V44-E48 WeakPolarHBondContact O-CG 3.23Å; V44-E48 PolarHBondContact O-N 2.9Å; V44-L590 HydrophobicContact CG1-CB 4.4Å; V44-R591 HydrophobicContact CG1-CG 3.98Å; V44-F594 HydrophobicContact CG2-CB 3.74Å; V44-F594 HydrophobicContact CG2-CD1 4.2Å; V44-F594 HydrophobicContact CG2-CD2 3.53Å; V44-F594 HydrophobicContact CG2-CE2 4.19Å; V44-F594 HydrophobicContact CG2-CG 3.54Å
45	G	87.9	Confident	85.7	Confident	27 Å²	27	48.3 Å²	48.3	28%	0.278	29%	0.292	S	S	.	.	H	α-helix	trans	-59.2	-45.3	173.5	0	0	0	0	0	112.9	P41 I42 V43 E48 E49	P41-G45 PolarHBondContact O-N 2.88Å; I42-G45 CarbonylContact O-C 3.57Å; I42-G45 WeakPolarHBondContact O-CA 3.47Å; I42-G45 PolarHBondContact O-N 3.23Å; I42-G45 VanDerWaalsContact O-N 3.09Å; V43-G45 VanDerWaalsContact C-N 3.3Å; V43-G45 PolarHBondContact O-N 3.44Å; G45-E48 PolarHBondContact O-N 3.26Å; G45-E49 WeakPolarHBondContact O-CB 3.45Å; G45-E49 PolarHBondContact O-N 2.9Å
46	I	90.6	Very high	86.4	Confident	97 Å²	97	48.6 Å²	48.6	50%	0.497	29%	0.285	S	S	.	.	H	α-helix	trans	-63.6	-41.3	175.6	-65.9	166.1	0	0	0	110.8	I42 V43 E49 M50	I42-I46 HydrophobicContact CG2-CD1 4.05Å; I42-I46 WeakPolarHBondContact O-CG1 3.4Å; I42-I46 PolarHBondContact O-N 2.88Å; V43-I46 PolarHBondContact O-N 2.72Å; I46-E49 PolarHBondContact O-N 3.42Å; I46-M50 VanDerWaalsContact O-CB 3.25Å; I46-M50 WeakPolarHBondContact O-CB 3.38Å; I46-M50 PolarHBondContact O-N 3.26Å
47	L	90.2	Very high	87.1	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.01	31%	0.312	C	S	.	.	H	α-helix	trans	-68	-37.5	177.6	-71.5	170.5	0	0	0	111.9	V13 L16 A17 I20 V43 V44 M50 D51 L590 F594	V13-L47 HydrophobicContact CG1-CB 4.42Å; V13-L47 HydrophobicContact CG1-CD2 4.18Å; L16-L47 HydrophobicContact CB-CD2 4.33Å; L16-L47 HydrophobicContact CD2-CD2 3.96Å; L16-L47 HydrophobicContact CG-CD2 4.17Å; A17-L47 HydrophobicContact CB-CD1 3.85Å; A17-L47 HydrophobicContact CB-CD2 4.47Å; I20-L47 HydrophobicContact CD1-CD1 4.18Å; I20-L47 HydrophobicContact CD1-CD2 4.1Å; I20-L47 HydrophobicContact CD1-CG 4.37Å; V43-L47 HydrophobicContact CG1-CD1 4.13Å; V43-L47 HydrophobicContact CG1-CG 4.43Å; V43-L47 WeakPolarHBondContact O-CB 3.44Å; V43-L47 VanDerWaalsContact O-CG 3.29Å; V43-L47 WeakPolarHBondContact O-CG 3.48Å; V43-L47 PolarHBondContact O-N 2.94Å; V44-L47 PolarHBondContact O-N 2.98Å; L47-M50 HydrophobicContact CD2-CE 3.83Å; L47-M50 PolarHBondContact O-N 3.47Å; L47-D51 WeakPolarHBondContact O-CB 3.24Å; L47-D51 PolarHBondContact O-N 3.34Å; L47-L590 VanDerWaalsContact C-CD1 3.45Å; L47-L590 HydrophobicContact CB-CD1 3.53Å; L47-L590 HydrophobicContact CB-CD2 4.13Å; L47-L590 HydrophobicContact CB-CG 4.44Å; L47-L590 HydrophobicContact CD1-CD2 4.2Å; L47-F594 HydrophobicContact CD1-CE2 3.63Å; L47-F594 HydrophobicContact CD1-CZ 3.8Å
48	E	88.1	Confident	87.8	Confident	17 Å²	17	58.9 Å²	58.9	8%	0.079	32%	0.324	C	S	.	.	H	α-helix	trans	-63.8	-44.2	173.3	-75.7	177.5	159.3	0	0	111.2	V44 G45 D51 L52 K586 S587 L590 R591	V44-E48 HydrophobicContact CG1-CG 4.28Å; V44-E48 WeakPolarHBondContact O-CB 3.44Å; V44-E48 VanDerWaalsContact O-CG 3.25Å; V44-E48 WeakPolarHBondContact O-CG 3.23Å; V44-E48 PolarHBondContact O-N 2.9Å; G45-E48 PolarHBondContact O-N 3.26Å; E48-D51 PolarHBondContact O-N 3.42Å; E48-L52 PolarHBondContact O-N 2.79Å; E48-K586 VanDerWaalsContact OE1-CA 3.22Å; E48-K586 WeakPolarHBondContact OE1-CA 3.5Å; E48-S587 PolarHBondContact OE1-N 2.92Å; E48-L590 HydrophobicContact CG-CD1 3.94Å; E48-R591 IonicContact OE1-CZ 3.31Å; E48-R591 VanDerWaalsContact OE1-CZ 3.31Å; E48-R591 IonicContact OE1-NE 2.71Å; E48-R591 PolarHBondContact OE1-NE 3.5Å; E48-R591 IonicContact OE1-NH2 3.72Å; E48-R591 PolarHBondContact OE1-NH2 3.12Å; E48-R591 VanDerWaalsContact OE1-NH2 3.16Å; E48-R591 IonicContact OE2-CZ 3.72Å; E48-R591 IonicContact OE2-NE 3.85Å; E48-R591 IonicContact OE2-NH2 2.92Å; E48-R591 PolarHBondContact OE2-NH2 3.27Å
49	E	88.3	Confident	88.2	Confident	125 Å²	125	60.2 Å²	60.2	58%	0.584	31%	0.314	S	S	*	.	H	α-helix	trans	-66.2	-40.4	175.9	-173.9	166.4	-158.6	0	0	111.7	G45 I46 D51 L52 L53	G45-E49 WeakPolarHBondContact O-CB 3.45Å; G45-E49 PolarHBondContact O-N 2.9Å; I46-E49 PolarHBondContact O-N 3.42Å; E49-D51 PolarHBondContact O-N 3.26Å; E49-L52 WeakPolarHBondContact O-CB 3.4Å; E49-L52 PolarHBondContact O-N 3.08Å; E49-L53 HydrophobicContact CG-CD1 4.39Å; E49-L53 WeakPolarHBondContact O-CB 3.44Å; E49-L53 VanDerWaalsContact O-CG 3.31Å; E49-L53 WeakPolarHBondContact O-CG 3.25Å; E49-L53 PolarHBondContact O-N 2.81Å
50	M	89.2	Confident	88.6	Confident	52 Å²	52	62 Å²	62	26%	0.256	32%	0.323	S	S	.	.	H	α-helix	trans	-65.2	-37.7	175.5	-168.6	176.8	72.4	0	0	112.1	V13 L16 I46 L47 L53 T54	V13-M50 HydrophobicContact CB-CE 3.77Å; V13-M50 HydrophobicContact CG1-CE 3.81Å; V13-M50 HydrophobicContact CG2-CB 4.47Å; V13-M50 HydrophobicContact CG2-CE 3.47Å; V13-M50 VanDerWaalsContact CG2-CE 3.47Å; V13-M50 HydrophobicContact CG2-CG 4.14Å; L16-M50 HydrophobicContact CB-CE 4.2Å; L16-M50 HydrophobicContact CD2-CE 3.53Å; L16-M50 HydrophobicContact CD2-SD 3.91Å; L16-M50 HydrophobicContact CG-CE 4.46Å; I46-M50 VanDerWaalsContact O-CB 3.25Å; I46-M50 WeakPolarHBondContact O-CB 3.38Å; I46-M50 PolarHBondContact O-N 3.26Å; L47-M50 HydrophobicContact CD2-CE 3.83Å; L47-M50 PolarHBondContact O-N 3.47Å; M50-L53 PolarHBondContact O-N 2.81Å; M50-T54 WeakPolarHBondContact O-CG2 3.47Å; M50-T54 PolarHBondContact O-N 3.45Å; M50-T54 PolarHBondContact O-OG1 2.91Å
51	D	89.4	Confident	89	Confident	22 Å²	22	65.4 Å²	65.4	12%	0.118	34%	0.341	C	S	.	.	H	α-helix	trans	-63.6	-46.4	174.3	-159.5	42.1	0	0	0	111.3	S10 V13 L47 E48 E49 L53 T54 V55	S10-D51 PolarHBondContact N-OD1 2.84Å; V13-D51 HydrophobicContact CG1-CB 4.18Å; V13-D51 HydrophobicContact CG2-CB 4.18Å; L47-D51 WeakPolarHBondContact O-CB 3.24Å; L47-D51 PolarHBondContact O-N 3.34Å; E48-D51 PolarHBondContact O-N 3.42Å; E49-D51 PolarHBondContact O-N 3.26Å; D51-L53 PolarHBondContact O-N 3.22Å; D51-T54 WeakPolarHBondContact CA-OG1 3.41Å; D51-T54 PolarHBondContact O-N 2.84Å; D51-T54 VanDerWaalsContact O-N 3.14Å; D51-T54 PolarHBondContact O-OG1 3.28Å; D51-V55 PolarHBondContact O-N 2.9Å
52	L	87.3	Confident	89.5	Confident	36 Å²	36	67.8 Å²	67.8	19%	0.188	35%	0.349	C	S	.	.	H	α-helix	trans	-54.6	-50.7	172.3	-111.1	150	0	0	0	111.7	E48 E49 T54 V55 D56 R585	E48-L52 PolarHBondContact O-N 2.79Å; E49-L52 WeakPolarHBondContact O-CB 3.4Å; E49-L52 PolarHBondContact O-N 3.08Å; L52-T54 VanDerWaalsContact C-N 3.28Å; L52-T54 PolarHBondContact O-N 3.39Å; L52-V55 PolarHBondContact O-N 2.84Å; L52-V55 VanDerWaalsContact O-N 3.13Å; L52-D56 PolarHBondContact O-N 2.82Å; L52-R585 HydrophobicContact CD1-CB 3.93Å
53	L	88.8	Confident	89.8	Confident	109 Å²	109	65.4 Å²	65.4	57%	0.571	34%	0.338	S	S	*	.	H	α-helix	trans	-60.9	-34.7	177.5	-72.8	173	0	0	0	112.6	E49 M50 D51 K57	E49-L53 HydrophobicContact CG-CD1 4.39Å; E49-L53 WeakPolarHBondContact O-CB 3.44Å; E49-L53 VanDerWaalsContact O-CG 3.31Å; E49-L53 WeakPolarHBondContact O-CG 3.25Å; E49-L53 PolarHBondContact O-N 2.81Å; M50-L53 PolarHBondContact O-N 2.81Å; D51-L53 PolarHBondContact O-N 3.22Å; L53-K57 VanDerWaalsContact O-CB 3.26Å; L53-K57 WeakPolarHBondContact O-CB 3.46Å; L53-K57 PolarHBondContact O-N 2.92Å
54	T	88.2	Confident	89.9	Confident	33 Å²	33	69.3 Å²	69.3	20%	0.202	36%	0.357	C	S	.	.	H	α-helix	trans	-69.8	-35.1	175.8	57.1	0	0	0	0	113.1	S10 V13 M50 D51 L52 Q58	S10-T54 VanDerWaalsContact CB-OG1 3.27Å; S10-T54 WeakPolarHBondContact CB-OG1 3.49Å; V13-T54 HydrophobicContact CG2-CG2 4.18Å; M50-T54 WeakPolarHBondContact O-CG2 3.47Å; M50-T54 PolarHBondContact O-N 3.45Å; M50-T54 PolarHBondContact O-OG1 2.91Å; D51-T54 WeakPolarHBondContact CA-OG1 3.41Å; D51-T54 PolarHBondContact O-N 2.84Å; D51-T54 VanDerWaalsContact O-N 3.14Å; D51-T54 PolarHBondContact O-OG1 3.28Å; L52-T54 VanDerWaalsContact C-N 3.28Å; L52-T54 PolarHBondContact O-N 3.39Å; T54-Q58 WeakPolarHBondContact O-CG 3.14Å; T54-Q58 PolarHBondContact O-N 3.47Å; T54-Q58 VanDerWaalsContact O-N 3.1Å
55	V	86.1	Confident	90.3	Very high	65 Å²	65	73.9 Å²	73.9	39%	0.394	38%	0.382	S	S	.	.	H	α-helix	trans	-70.7	-44.9	175.3	173.7	0	0	0	0	110.7	D51 L52 K57 Q58 K59	D51-V55 PolarHBondContact O-N 2.9Å; L52-V55 PolarHBondContact O-N 2.84Å; L52-V55 VanDerWaalsContact O-N 3.13Å; V55-K57 VanDerWaalsContact C-N 3.3Å; V55-K57 PolarHBondContact O-N 3.36Å; V55-Q58 PolarHBondContact O-N 3.42Å; V55-Q58 VanDerWaalsContact O-N 3.16Å; V55-K59 PolarHBondContact O-N 3.44Å
56	D	87	Confident	90.6	Very high	65 Å²	65	77.3 Å²	77.3	35%	0.348	39%	0.393	S	S	.	.	H	α-helix	trans	-62.9	-39.2	177.1	-72.8	-13	0	0	0	111.2	L52 K59 L60	L52-D56 PolarHBondContact O-N 2.82Å; D56-K59 PolarHBondContact O-N 3.33Å; D56-L60 WeakPolarHBondContact O-CB 3.44Å; D56-L60 WeakPolarHBondContact O-CG 3.34Å; D56-L60 PolarHBondContact O-N 3Å
57	K	90.6	Very high	90.8	Very high	130 Å²	130	77.8 Å²	77.8	57%	0.565	40%	0.396	S	S	*	.	H	α-helix	trans	-58.7	-48.1	171.3	177.7	178.4	174.3	170.8	0	112	L53 V55 K59 L60 D61	L53-K57 VanDerWaalsContact O-CB 3.26Å; L53-K57 WeakPolarHBondContact O-CB 3.46Å; L53-K57 PolarHBondContact O-N 2.92Å; V55-K57 VanDerWaalsContact C-N 3.3Å; V55-K57 PolarHBondContact O-N 3.36Å; K57-K59 VanDerWaalsContact C-N 3.27Å; K57-K59 PolarHBondContact O-N 2.84Å; K57-L60 PolarHBondContact O-N 2.9Å; K57-D61 WeakPolarHBondContact CE-OD2 3.49Å; K57-D61 WeakPolarHBondContact O-CB 3.29Å; K57-D61 VanDerWaalsContact O-CG 3.28Å; K57-D61 PolarHBondContact O-N 2.9Å
58	Q	90.6	Very high	91.1	Very high	114 Å²	114	80.7 Å²	80.7	53%	0.533	41%	0.414	S	S	.	.	H	α-helix	trans	-60.9	-37.9	178.7	-75.5	174.4	-10.3	0	0	112.2	T54 V55 L62	T54-Q58 WeakPolarHBondContact O-CG 3.14Å; T54-Q58 PolarHBondContact O-N 3.47Å; T54-Q58 VanDerWaalsContact O-N 3.1Å; V55-Q58 PolarHBondContact O-N 3.42Å; V55-Q58 VanDerWaalsContact O-N 3.16Å; Q58-L62 WeakPolarHBondContact O-CG 3.32Å; Q58-L62 PolarHBondContact O-N 3.1Å; Q58-L62 VanDerWaalsContact O-N 3.09Å
59	K	90.4	Very high	91.4	Very high	87 Å²	87	82.6 Å²	82.6	38%	0.378	43%	0.433	S	S	.	.	H	α-helix	trans	-64.8	-49	174.6	-175.3	-175.1	174.8	-172.4	0	111.4	V55 D56 K57 D61 L62 D63	V55-K59 PolarHBondContact O-N 3.44Å; D56-K59 PolarHBondContact O-N 3.33Å; K57-K59 VanDerWaalsContact C-N 3.27Å; K57-K59 PolarHBondContact O-N 2.84Å; K59-D61 VanDerWaalsContact C-N 3.3Å; K59-D61 PolarHBondContact O-N 2.81Å; K59-L62 WeakPolarHBondContact O-CB 3.18Å; K59-L62 PolarHBondContact O-N 3.42Å; K59-L62 VanDerWaalsContact O-N 3.14Å; K59-D63 PolarHBondContact O-N 2.86Å
60	L	94	Very high	91.7	Very high	116 Å²	116	81.2 Å²	81.2	61%	0.607	43%	0.426	S	S	*	.	H	α-helix	trans	-61.7	-37.6	177.4	-71.6	169.8	0	0	0	112.3	D56 K57 L62 D63 L64	D56-L60 WeakPolarHBondContact O-CB 3.44Å; D56-L60 WeakPolarHBondContact O-CG 3.34Å; D56-L60 PolarHBondContact O-N 3Å; K57-L60 PolarHBondContact O-N 2.9Å; L60-L62 VanDerWaalsContact C-N 3.34Å; L60-D63 PolarHBondContact O-N 3.41Å; L60-L64 VanDerWaalsContact O-CB 3.27Å; L60-L64 WeakPolarHBondContact O-CB 3.38Å; L60-L64 PolarHBondContact O-N 3.28Å
61	D	94.2	Very high	92	Very high	72 Å²	72	85.8 Å²	85.8	39%	0.385	45%	0.445	S	S	.	.	H	α-helix	trans	-64.1	-39	175.1	-74	-24.1	0	0	0	111.1	K57 K59 N65	K57-D61 WeakPolarHBondContact CE-OD2 3.49Å; K57-D61 WeakPolarHBondContact O-CB 3.29Å; K57-D61 VanDerWaalsContact O-CG 3.28Å; K57-D61 PolarHBondContact O-N 2.9Å; K59-D61 VanDerWaalsContact C-N 3.3Å; K59-D61 PolarHBondContact O-N 2.81Å; D61-N65 VanDerWaalsContact O-CG 3.24Å; D61-N65 PolarHBondContact O-N 3.48Å; D61-N65 VanDerWaalsContact O-N 3.11Å; D61-N65 PolarHBondContact O-ND2 2.94Å
62	L	94.6	Very high	92.3	Very high	120 Å²	120	89.1 Å²	89.1	63%	0.628	46%	0.463	S	S	*	.	H	α-helix	trans	-67.1	-45.8	174	-73.5	170.2	0	0	0	112.1	Q58 K59 L60 L64 N65 L66	Q58-L62 WeakPolarHBondContact O-CG 3.32Å; Q58-L62 PolarHBondContact O-N 3.1Å; Q58-L62 VanDerWaalsContact O-N 3.09Å; K59-L62 WeakPolarHBondContact O-CB 3.18Å; K59-L62 PolarHBondContact O-N 3.42Å; K59-L62 VanDerWaalsContact O-N 3.14Å; L60-L62 VanDerWaalsContact C-N 3.34Å; L62-L64 VanDerWaalsContact C-N 3.31Å; L62-L64 PolarHBondContact O-N 3.23Å; L62-N65 PolarHBondContact O-N 2.93Å; L62-L66 PolarHBondContact O-N 2.91Å
63	D	93	Very high	92.8	Very high	56 Å²	56	91.6 Å²	91.6	30%	0.299	48%	0.476	S	S	.	.	H	α-helix	trans	-62.4	-40.3	178.5	-67.9	-18.1	0	0	0	110.9	K59 L60 N65 L66 L67	K59-D63 PolarHBondContact O-N 2.86Å; L60-D63 PolarHBondContact O-N 3.41Å; D63-N65 PolarHBondContact O-N 3.48Å; D63-L66 PolarHBondContact O-N 2.73Å; D63-L67 WeakPolarHBondContact O-CB 3.43Å; D63-L67 WeakPolarHBondContact O-CG 3.49Å; D63-L67 PolarHBondContact O-N 3.09Å
64	L	93.3	Very high	93.1	Very high	103 Å²	103	91.5 Å²	91.5	54%	0.539	48%	0.475	S	S	.	.	H	α-helix	trans	-61.6	-43	174.6	-176.8	68.7	0	0	0	111.6	L60 L62 T68	L60-L64 VanDerWaalsContact O-CB 3.27Å; L60-L64 WeakPolarHBondContact O-CB 3.38Å; L60-L64 PolarHBondContact O-N 3.28Å; L62-L64 VanDerWaalsContact C-N 3.31Å; L62-L64 PolarHBondContact O-N 3.23Å; L64-T68 VanDerWaalsContact O-CB 3.25Å; L64-T68 WeakPolarHBondContact O-CB 3.33Å; L64-T68 PolarHBondContact O-N 3.18Å; L64-T68 PolarHBondContact O-OG1 2.83Å
65	N	94.2	Very high	93.4	Very high	104 Å²	104	93.4 Å²	93.4	56%	0.556	49%	0.489	S	S	*	.	H	α-helix	trans	-65.7	-40.4	177.5	-74.1	-36.9	0	0	0	111.8	D61 L62 D63 T68 A69	D61-N65 VanDerWaalsContact O-CG 3.24Å; D61-N65 PolarHBondContact O-N 3.48Å; D61-N65 VanDerWaalsContact O-N 3.11Å; D61-N65 PolarHBondContact O-ND2 2.94Å; L62-N65 PolarHBondContact O-N 2.93Å; D63-N65 PolarHBondContact O-N 3.48Å; N65-T68 PolarHBondContact O-N 2.91Å; N65-A69 WeakPolarHBondContact O-CB 3.46Å; N65-A69 PolarHBondContact O-N 2.89Å
66	L	95.3	Very high	93.9	Very high	99 Å²	99	95.1 Å²	95.1	52%	0.518	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-51.1	176	-179.5	63.3	0	0	0	111.3	L62 D63 T68 A69 E70	L62-L66 PolarHBondContact O-N 2.91Å; D63-L66 PolarHBondContact O-N 2.73Å; L66-T68 PolarHBondContact O-N 3.34Å; L66-A69 WeakPolarHBondContact O-CB 3.03Å; L66-A69 PolarHBondContact O-N 3.44Å; L66-A69 VanDerWaalsContact O-N 3.09Å; L66-E70 WeakPolarHBondContact O-CG 3.38Å; L66-E70 PolarHBondContact O-N 3.41Å
67	L	93.5	Very high	94.2	Very high	107 Å²	107	97.1 Å²	97.1	56%	0.56	51%	0.507	S	S	*	.	H	α-helix	trans	-61.5	-34.6	177	-73.3	171.2	0	0	0	112.2	D63 K71	D63-L67 WeakPolarHBondContact O-CB 3.43Å; D63-L67 WeakPolarHBondContact O-CG 3.49Å; D63-L67 PolarHBondContact O-N 3.09Å; L67-K71 VanDerWaalsContact O-CB 3.27Å; L67-K71 WeakPolarHBondContact O-CB 3.47Å; L67-K71 PolarHBondContact O-N 3.48Å
68	T	96	Very high	94.4	Very high	62 Å²	62	95.1 Å²	95.1	38%	0.38	50%	0.502	S	S	.	.	H	α-helix	trans	-67.7	-39.9	175.2	-59.7	0	0	0	0	111.3	L64 N65 L66 N72	L64-T68 VanDerWaalsContact O-CB 3.25Å; L64-T68 WeakPolarHBondContact O-CB 3.33Å; L64-T68 PolarHBondContact O-N 3.18Å; L64-T68 PolarHBondContact O-OG1 2.83Å; N65-T68 PolarHBondContact O-N 2.91Å; L66-T68 PolarHBondContact O-N 3.34Å; T68-N72 WeakPolarHBondContact O-CB 3.36Å; T68-N72 PolarHBondContact O-N 3.15Å; T68-N72 PolarHBondContact O-ND2 3.42Å
69	A	94.8	Very high	94.6	Very high	57 Å²	57	92.7 Å²	92.7	47%	0.471	50%	0.497	S	S	.	.	H	α-helix	trans	-64.7	-46.1	174.6	0	0	0	0	0	111.7	N65 L66 N72 D73	N65-A69 WeakPolarHBondContact O-CB 3.46Å; N65-A69 PolarHBondContact O-N 2.89Å; L66-A69 WeakPolarHBondContact O-CB 3.03Å; L66-A69 PolarHBondContact O-N 3.44Å; L66-A69 VanDerWaalsContact O-N 3.09Å; A69-N72 PolarHBondContact O-N 2.94Å; A69-D73 PolarHBondContact O-N 3.07Å
70	E	95.4	Very high	94.8	Very high	96 Å²	96	95.9 Å²	95.9	45%	0.449	51%	0.507	S	S	.	.	H	α-helix	trans	-61.5	-44	176.1	-70.6	179.8	173.4	0	0	112.1	L66 N72 D73 I74	L66-E70 WeakPolarHBondContact O-CG 3.38Å; L66-E70 PolarHBondContact O-N 3.41Å; E70-N72 VanDerWaalsContact C-N 3.31Å; E70-N72 PolarHBondContact O-N 3.28Å; E70-D73 PolarHBondContact O-N 2.96Å; E70-I74 WeakPolarHBondContact O-CG1 3.47Å; E70-I74 PolarHBondContact O-N 2.87Å
71	K	95.7	Very high	94.8	Very high	148 Å²	148	96.4 Å²	96.4	64%	0.643	51%	0.506	S	S	*	.	H	α-helix	trans	-58	-44.2	174.2	177.5	-168.7	170.3	-172.7	0	111.5	L67 S75	L67-K71 VanDerWaalsContact O-CB 3.27Å; L67-K71 WeakPolarHBondContact O-CB 3.47Å; L67-K71 PolarHBondContact O-N 3.48Å; K71-S75 WeakPolarHBondContact O-CB 3.33Å; K71-S75 PolarHBondContact O-N 3.19Å
72	N	96.2	Very high	95	Very high	93 Å²	93	99 Å²	99	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-66.1	-41.6	179.9	-72.4	-20.5	0	0	0	111.2	T68 A69 E70 S75 V76	T68-N72 WeakPolarHBondContact O-CB 3.36Å; T68-N72 PolarHBondContact O-N 3.15Å; T68-N72 PolarHBondContact O-ND2 3.42Å; A69-N72 PolarHBondContact O-N 2.94Å; E70-N72 VanDerWaalsContact C-N 3.31Å; E70-N72 PolarHBondContact O-N 3.28Å; N72-S75 WeakPolarHBondContact O-CB 3.38Å; N72-S75 PolarHBondContact O-N 3.22Å; N72-V76 WeakPolarHBondContact O-CG2 3.32Å; N72-V76 PolarHBondContact O-N 2.89Å
73	D	96	Very high	95	Very high	88 Å²	88	99.2 Å²	99.2	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-60.7	-50.6	175.4	-176.2	61.3	0	0	0	111.9	A69 E70 S75 V76 Q77	A69-D73 PolarHBondContact O-N 3.07Å; E70-D73 PolarHBondContact O-N 2.96Å; D73-S75 VanDerWaalsContact C-N 3.25Å; D73-S75 PolarHBondContact O-N 3.44Å; D73-V76 PolarHBondContact O-N 2.81Å; D73-V76 VanDerWaalsContact O-N 3.09Å; D73-Q77 WeakPolarHBondContact O-CG 3.32Å; D73-Q77 PolarHBondContact O-N 3.33Å; D73-Q77 PolarHBondContact OD2-NE2 2.87Å
74	I	95.5	Very high	95.1	Very high	107 Å²	107	101.1 Å²	101.1	55%	0.549	52%	0.521	S	S	.	.	H	α-helix	trans	-58.4	-39.3	175.9	-65.9	167.5	0	0	0	111	E70 Q77 L78	E70-I74 WeakPolarHBondContact O-CG1 3.47Å; E70-I74 PolarHBondContact O-N 2.87Å; I74-Q77 PolarHBondContact O-N 3.29Å; I74-L78 VanDerWaalsContact O-CB 3.23Å; I74-L78 WeakPolarHBondContact O-CB 3.22Å; I74-L78 PolarHBondContact O-N 3.46Å
75	S	96	Very high	95.2	Very high	72 Å²	72	103.6 Å²	103.6	50%	0.503	53%	0.525	S	S	.	.	H	α-helix	trans	-64	-39.7	177.7	-172.4	0	0	0	0	112.4	K71 N72 D73 C79	K71-S75 WeakPolarHBondContact O-CB 3.33Å; K71-S75 PolarHBondContact O-N 3.19Å; N72-S75 WeakPolarHBondContact O-CB 3.38Å; N72-S75 PolarHBondContact O-N 3.22Å; D73-S75 VanDerWaalsContact C-N 3.25Å; D73-S75 PolarHBondContact O-N 3.44Å; S75-C79 WeakPolarHBondContact O-CB 3.33Å; S75-C79 PolarHBondContact O-N 3.26Å
76	V	96.5	Very high	95.3	Very high	101 Å²	101	102.3 Å²	102.3	61%	0.612	52%	0.517	S	S	*	.	H	α-helix	trans	-68.5	-45.5	176.6	171.7	0	0	0	0	110.6	N72 D73 L78 C79 R80	N72-V76 WeakPolarHBondContact O-CG2 3.32Å; N72-V76 PolarHBondContact O-N 2.89Å; D73-V76 PolarHBondContact O-N 2.81Å; D73-V76 VanDerWaalsContact O-N 3.09Å; V76-L78 VanDerWaalsContact C-N 3.32Å; V76-L78 PolarHBondContact O-N 3.42Å; V76-C79 WeakPolarHBondContact O-CB 3.39Å; V76-C79 PolarHBondContact O-N 2.91Å; V76-C79 VanDerWaalsContact O-N 3.14Å; V76-R80 PolarHBondContact O-N 3.05Å
77	Q	93	Very high	95.3	Very high	108 Å²	108	99.9 Å²	99.9	51%	0.505	51%	0.511	S	S	.	.	H	α-helix	trans	-59.3	-42.9	176.1	-67.5	-174.5	30.2	0	0	111.8	D73 I74 C79 R80 Q81	D73-Q77 WeakPolarHBondContact O-CG 3.32Å; D73-Q77 PolarHBondContact O-N 3.33Å; D73-Q77 PolarHBondContact OD2-NE2 2.87Å; I74-Q77 PolarHBondContact O-N 3.29Å; Q77-C79 VanDerWaalsContact C-N 3.34Å; Q77-C79 PolarHBondContact O-N 3.46Å; Q77-R80 PolarHBondContact O-N 3.36Å; Q77-Q81 WeakPolarHBondContact O-CB 3.37Å; Q77-Q81 PolarHBondContact O-N 2.75Å
78	L	93.8	Very high	95.4	Very high	87 Å²	87	97.1 Å²	97.1	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-65.2	-36.5	176.3	179.6	151.6	0	0	0	112.1	I74 V76 K82	I74-L78 VanDerWaalsContact O-CB 3.23Å; I74-L78 WeakPolarHBondContact O-CB 3.22Å; I74-L78 PolarHBondContact O-N 3.46Å; V76-L78 VanDerWaalsContact C-N 3.32Å; V76-L78 PolarHBondContact O-N 3.42Å; L78-K82 HydrophobicContact CD2-CD 3.76Å; L78-K82 HydrophobicContact CD2-CG 4.4Å; L78-K82 WeakPolarHBondContact O-CB 3.48Å; L78-K82 VanDerWaalsContact O-CG 3.3Å; L78-K82 WeakPolarHBondContact O-CG 3.4Å; L78-K82 PolarHBondContact O-N 2.96Å
79	C	94.9	Very high	95.4	Very high	64 Å²	64	99.1 Å²	99.1	43%	0.432	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-49.8	173.8	-165.2	0	0	0	0	111.1	S75 V76 Q77 Q81 K82 E83	S75-C79 WeakPolarHBondContact O-CB 3.33Å; S75-C79 PolarHBondContact O-N 3.26Å; V76-C79 WeakPolarHBondContact O-CB 3.39Å; V76-C79 PolarHBondContact O-N 2.91Å; V76-C79 VanDerWaalsContact O-N 3.14Å; Q77-C79 VanDerWaalsContact C-N 3.34Å; Q77-C79 PolarHBondContact O-N 3.46Å; C79-Q81 VanDerWaalsContact C-N 3.35Å; C79-Q81 PolarHBondContact O-N 3.36Å; C79-K82 WeakPolarHBondContact O-CB 3.31Å; C79-K82 PolarHBondContact O-N 2.91Å; C79-E83 PolarHBondContact O-N 3.29Å
80	R	95.3	Very high	95.5	Very high	154 Å²	154	103.9 Å²	103.9	58%	0.581	51%	0.513	S	S	*	.	H	α-helix	trans	-57.3	-45.6	175.9	-177.8	-177.2	178.1	-160.1	1	112	V76 Q77 K82 E83 L84	V76-R80 PolarHBondContact O-N 3.05Å; Q77-R80 PolarHBondContact O-N 3.36Å; R80-K82 VanDerWaalsContact C-N 3.33Å; R80-K82 PolarHBondContact O-N 2.97Å; R80-E83 PolarHBondContact O-N 3.41Å; R80-L84 HydrophobicContact CG-CD1 4.48Å; R80-L84 PolarHBondContact O-N 2.97Å; R80-L84 VanDerWaalsContact O-N 3.08Å
81	Q	94.2	Very high	95.5	Very high	127 Å²	127	104.8 Å²	104.8	59%	0.593	52%	0.517	S	S	*	.	H	α-helix	trans	-65.7	-36.2	180	-168.1	64.4	13.1	0	0	112.3	Q77 C79 Y85	Q77-Q81 WeakPolarHBondContact O-CB 3.37Å; Q77-Q81 PolarHBondContact O-N 2.75Å; C79-Q81 VanDerWaalsContact C-N 3.35Å; C79-Q81 PolarHBondContact O-N 3.36Å; Q81-Y85 WeakPolarHBondContact O-CB 3.5Å; Q81-Y85 PolarHBondContact O-N 3.5Å
82	K	97	Very high	95.3	Very high	125 Å²	125	102 Å²	102	54%	0.543	51%	0.508	S	S	.	.	H	α-helix	trans	-64.9	-42.3	174	-78.4	177.7	177	176.1	0	112	L78 C79 R80 Y85 I86	L78-K82 HydrophobicContact CD2-CD 3.76Å; L78-K82 HydrophobicContact CD2-CG 4.4Å; L78-K82 WeakPolarHBondContact O-CB 3.48Å; L78-K82 VanDerWaalsContact O-CG 3.3Å; L78-K82 WeakPolarHBondContact O-CG 3.4Å; L78-K82 PolarHBondContact O-N 2.96Å; C79-K82 WeakPolarHBondContact O-CB 3.31Å; C79-K82 PolarHBondContact O-N 2.91Å; R80-K82 VanDerWaalsContact C-N 3.33Å; R80-K82 PolarHBondContact O-N 2.97Å; K82-Y85 PolarHBondContact O-N 3.13Å; K82-I86 WeakPolarHBondContact O-CD1 3.41Å; K82-I86 WeakPolarHBondContact O-CG1 3.38Å; K82-I86 PolarHBondContact O-N 3.45Å
83	E	95.9	Very high	95.1	Very high	126 Å²	126	101.9 Å²	101.9	59%	0.589	51%	0.505	S	S	*	.	H	α-helix	trans	-62.2	-45.7	177.7	-72.6	172.6	-179.6	0	0	111.8	C79 R80 Y85 I86 A87	C79-E83 PolarHBondContact O-N 3.29Å; R80-E83 PolarHBondContact O-N 3.41Å; E83-Y85 PolarHBondContact O-N 3Å; E83-I86 PolarHBondContact O-N 2.91Å; E83-A87 WeakPolarHBondContact O-CB 3.49Å; E83-A87 PolarHBondContact O-N 2.84Å
84	L	94.7	Very high	95.2	Very high	95 Å²	95	100.9 Å²	100.9	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-61.7	-42.7	174.9	-69.8	174.9	0	0	0	112.1	R80 I86 A87 A88	R80-L84 HydrophobicContact CG-CD1 4.48Å; R80-L84 PolarHBondContact O-N 2.97Å; R80-L84 VanDerWaalsContact O-N 3.08Å; L84-I86 PolarHBondContact O-N 2.83Å; L84-A87 PolarHBondContact O-N 3.11Å; L84-A88 WeakPolarHBondContact O-CB 3.41Å; L84-A88 PolarHBondContact O-N 3.47Å
85	Y	95.1	Very high	95.1	Very high	155 Å²	155	99.3 Å²	99.3	61%	0.608	50%	0.496	S	S	*	.	H	α-helix	trans	-60.9	-44.4	176.1	175.4	-98.7	0	0	0	112	Q81 K82 E83 A88 K89	Q81-Y85 WeakPolarHBondContact O-CB 3.5Å; Q81-Y85 PolarHBondContact O-N 3.5Å; K82-Y85 PolarHBondContact O-N 3.13Å; E83-Y85 PolarHBondContact O-N 3Å; Y85-A88 PolarHBondContact O-N 3.13Å; Y85-K89 WeakPolarHBondContact O-CB 3.42Å; Y85-K89 PolarHBondContact O-N 3.12Å
86	I	96.6	Very high	95	Very high	77 Å²	77	100.3 Å²	100.3	40%	0.395	49%	0.493	S	S	.	.	H	α-helix	trans	-67.8	-39.1	178.7	-60	163.3	0	0	0	110.1	K82 E83 L84 K89 R90	K82-I86 WeakPolarHBondContact O-CD1 3.41Å; K82-I86 WeakPolarHBondContact O-CG1 3.38Å; K82-I86 PolarHBondContact O-N 3.45Å; E83-I86 PolarHBondContact O-N 2.91Å; L84-I86 PolarHBondContact O-N 2.83Å; I86-K89 PolarHBondContact O-N 2.68Å; I86-R90 VanDerWaalsContact CG2-NH2 3.31Å; I86-R90 WeakPolarHBondContact O-CG 3.5Å; I86-R90 PolarHBondContact O-N 3.46Å
87	A	96.1	Very high	95	Very high	49 Å²	49	100.8 Å²	100.8	41%	0.405	49%	0.492	S	S	.	.	H	α-helix	trans	-62.3	-48	175.2	0	0	0	0	0	112.2	E83 L84 K89 R90 H91	E83-A87 WeakPolarHBondContact O-CB 3.49Å; E83-A87 PolarHBondContact O-N 2.84Å; L84-A87 PolarHBondContact O-N 3.11Å; A87-K89 VanDerWaalsContact C-N 3.33Å; A87-K89 PolarHBondContact O-N 3.41Å; A87-R90 PolarHBondContact O-N 3.35Å; A87-H91 PolarHBondContact O-N 2.81Å
88	A	94.6	Very high	95.1	Very high	49 Å²	49	101.6 Å²	101.6	41%	0.405	50%	0.496	S	S	.	.	H	α-helix	trans	-60.2	-42.5	175.8	0	0	0	0	0	111.8	L84 Y85 R90 H91 I92	L84-A88 WeakPolarHBondContact O-CB 3.41Å; L84-A88 PolarHBondContact O-N 3.47Å; Y85-A88 PolarHBondContact O-N 3.13Å; A88-R90 PolarHBondContact O-N 3.45Å; A88-H91 WeakPolarHBondContact O-CB 3.47Å; A88-H91 PolarHBondContact O-N 2.9Å; A88-I92 WeakPolarHBondContact O-CG1 3.42Å; A88-I92 PolarHBondContact O-N 3.47Å
89	K	96.2	Very high	95.1	Very high	104 Å²	104	103.1 Å²	103.1	45%	0.452	50%	0.504	S	S	.	.	H	α-helix	trans	-61.5	-41.3	176.3	-174.7	175.4	-179.8	178.5	0	112.6	Y85 I86 A87 H91 I92 H93	Y85-K89 WeakPolarHBondContact O-CB 3.42Å; Y85-K89 PolarHBondContact O-N 3.12Å; I86-K89 PolarHBondContact O-N 2.68Å; A87-K89 VanDerWaalsContact C-N 3.33Å; A87-K89 PolarHBondContact O-N 3.41Å; K89-H91 VanDerWaalsContact C-N 3.34Å; K89-I92 PolarHBondContact O-N 2.9Å; K89-H93 PolarHBondContact O-CD2 2.97Å; K89-H93 VanDerWaalsContact O-CD2 3.24Å; K89-H93 PolarHBondContact O-N 3.3Å
90	R	96	Very high	95.1	Very high	157 Å²	157	104.4 Å²	104.4	59%	0.592	51%	0.506	S	S	*	.	H	α-helix	trans	-63.7	-41	174.5	-70.7	-175.7	-164.3	106.3	-4.4	111.5	I86 A87 A88 H93 C94	I86-R90 VanDerWaalsContact CG2-NH2 3.31Å; I86-R90 WeakPolarHBondContact O-CG 3.5Å; I86-R90 PolarHBondContact O-N 3.46Å; A87-R90 PolarHBondContact O-N 3.35Å; A88-R90 PolarHBondContact O-N 3.45Å; R90-H93 PolarHBondContact O-N 3.11Å; R90-C94 PolarHBondContact O-N 2.87Å; R90-C94 VanDerWaalsContact O-N 3.07Å; R90-C94 PolarHBondContact O-SG 3.23Å; R90-C94 VanDerWaalsContact O-SG 3.38Å
91	H	95.5	Very high	95.1	Very high	114 Å²	114	99 Å²	99	53%	0.528	50%	0.498	S	S	.	.	H	α-helix	trans	-63.5	-41.6	178	-176	53.3	0	0	0	112.3	A87 A88 K89 H93 C94 L95	A87-H91 PolarHBondContact O-N 2.81Å; A88-H91 WeakPolarHBondContact O-CB 3.47Å; A88-H91 PolarHBondContact O-N 2.9Å; K89-H91 VanDerWaalsContact C-N 3.34Å; H91-H93 VanDerWaalsContact C-N 3.33Å; H91-H93 PolarHBondContact O-N 3.39Å; H91-C94 PolarHBondContact O-N 3.25Å; H91-L95 WeakPolarHBondContact O-CG 3.31Å; H91-L95 PolarHBondContact O-N 3.36Å
92	I	93.2	Very high	95.1	Very high	90 Å²	90	99.1 Å²	99.1	46%	0.462	50%	0.5	S	S	.	.	H	α-helix	trans	-57.5	-46.7	173.6	-68.9	166.3	0	0	0	110.6	A88 K89 C94 L95 E96	A88-I92 WeakPolarHBondContact O-CG1 3.42Å; A88-I92 PolarHBondContact O-N 3.47Å; K89-I92 PolarHBondContact O-N 2.9Å; I92-C94 VanDerWaalsContact C-N 3.35Å; I92-C94 PolarHBondContact O-N 3.42Å; I92-L95 PolarHBondContact O-N 3.08Å; I92-E96 HydrophobicContact CG2-CG 4.27Å; I92-E96 WeakPolarHBondContact O-CG 3.35Å; I92-E96 PolarHBondContact O-N 3.46Å
93	H	91.8	Very high	95.1	Very high	90 Å²	90	99 Å²	99	42%	0.417	50%	0.5	S	S	.	.	H	α-helix	trans	-61.3	-39.1	177.3	-74.5	-50.1	0	0	0	113.3	K89 R90 H91 E96 D97	K89-H93 PolarHBondContact O-CD2 2.97Å; K89-H93 VanDerWaalsContact O-CD2 3.24Å; K89-H93 PolarHBondContact O-N 3.3Å; R90-H93 PolarHBondContact O-N 3.11Å; H91-H93 VanDerWaalsContact C-N 3.33Å; H91-H93 PolarHBondContact O-N 3.39Å; H93-E96 IonicContact CE1-OE2 3.09Å; H93-E96 IonicContact CG-OE2 2.79Å; H93-E96 IonicContact ND1-OE2 3.16Å; H93-E96 PolarHBondContact ND1-OE2 3.48Å; H93-E96 PolarHBondContact O-N 2.86Å; H93-D97 PolarHBondContact O-N 3.46Å
94	C	96.5	Very high	95.2	Very high	67 Å²	67	99.6 Å²	99.6	45%	0.453	50%	0.5	S	S	.	.	H	α-helix	trans	-62.9	-42.8	174	-62.7	0	0	0	0	112.2	R90 H91 I92 D97 E98	R90-C94 PolarHBondContact O-N 2.87Å; R90-C94 VanDerWaalsContact O-N 3.07Å; R90-C94 PolarHBondContact O-SG 3.23Å; R90-C94 VanDerWaalsContact O-SG 3.38Å; H91-C94 PolarHBondContact O-N 3.25Å; I92-C94 VanDerWaalsContact C-N 3.35Å; I92-C94 PolarHBondContact O-N 3.42Å; C94-D97 PolarHBondContact O-N 3.35Å; C94-E98 WeakPolarHBondContact O-CG 3.33Å; C94-E98 PolarHBondContact O-N 2.89Å
95	L	94	Very high	95.3	Very high	74 Å²	74	99.2 Å²	99.2	39%	0.387	50%	0.496	S	S	.	.	H	α-helix	trans	-65.6	-38.5	177.2	-69.8	174.5	0	0	0	112.1	H91 I92 E98 L99	H91-L95 WeakPolarHBondContact O-CG 3.31Å; H91-L95 PolarHBondContact O-N 3.36Å; I92-L95 PolarHBondContact O-N 3.08Å; L95-E98 PolarHBondContact O-N 3.25Å; L95-L99 WeakPolarHBondContact O-CB 3.27Å; L95-L99 WeakPolarHBondContact O-CG 3.47Å; L95-L99 PolarHBondContact O-N 2.99Å
96	E	94	Very high	95.1	Very high	93 Å²	93	95.6 Å²	95.6	44%	0.435	49%	0.49	S	S	.	.	H	α-helix	trans	-59.8	-45.5	173.3	-72.9	171.7	161.1	0	0	111.1	I92 H93 L99 L100	I92-E96 HydrophobicContact CG2-CG 4.27Å; I92-E96 WeakPolarHBondContact O-CG 3.35Å; I92-E96 PolarHBondContact O-N 3.46Å; H93-E96 IonicContact CE1-OE2 3.09Å; H93-E96 IonicContact CG-OE2 2.79Å; H93-E96 IonicContact ND1-OE2 3.16Å; H93-E96 PolarHBondContact ND1-OE2 3.48Å; H93-E96 PolarHBondContact O-N 2.86Å; E96-L99 PolarHBondContact O-N 3.48Å; E96-L100 WeakPolarHBondContact O-CB 3.36Å; E96-L100 VanDerWaalsContact O-CG 3.27Å; E96-L100 WeakPolarHBondContact O-CG 3.45Å; E96-L100 PolarHBondContact O-N 3.47Å
97	D	96.1	Very high	95.1	Very high	112 Å²	112	95.4 Å²	95.4	60%	0.599	49%	0.49	S	S	*	.	H	α-helix	trans	-65	-41.3	177.8	-75.5	-20.5	0	0	0	112.3	H93 C94 L100 G101	H93-D97 PolarHBondContact O-N 3.46Å; C94-D97 PolarHBondContact O-N 3.35Å; D97-L100 PolarHBondContact O-N 3.23Å; D97-G101 PolarHBondContact O-N 3.06Å
98	E	95.9	Very high	95.2	Very high	124 Å²	124	98.4 Å²	98.4	58%	0.579	49%	0.494	S	S	*	.	H	α-helix	trans	-62.4	-46.6	174.8	-75.2	174.6	-165.5	0	0	111.8	C94 L95 L100 G101 M102	C94-E98 WeakPolarHBondContact O-CG 3.33Å; C94-E98 PolarHBondContact O-N 2.89Å; L95-E98 PolarHBondContact O-N 3.25Å; E98-L100 VanDerWaalsContact C-N 3.35Å; E98-L100 PolarHBondContact O-N 3.17Å; E98-G101 PolarHBondContact O-N 2.85Å; E98-G101 VanDerWaalsContact O-N 3.17Å; E98-M102 WeakPolarHBondContact O-CG 3.37Å; E98-M102 PolarHBondContact O-N 2.85Å
99	L	94.1	Very high	95.3	Very high	119 Å²	119	101.3 Å²	101.3	62%	0.623	50%	0.497	S	S	*	.	H	α-helix	trans	-62.3	-41.1	176.1	-75.7	175.3	0	0	0	111.9	L95 E96 G101 M102 K103	L95-L99 WeakPolarHBondContact O-CB 3.27Å; L95-L99 WeakPolarHBondContact O-CG 3.47Å; L95-L99 PolarHBondContact O-N 2.99Å; E96-L99 PolarHBondContact O-N 3.48Å; L99-G101 VanDerWaalsContact C-N 3.32Å; L99-M102 PolarHBondContact O-N 2.93Å; L99-K103 WeakPolarHBondContact O-CB 3.27Å; L99-K103 PolarHBondContact O-N 3.47Å
100	L	95.6	Very high	95.3	Very high	92 Å²	92	102.8 Å²	102.8	48%	0.482	50%	0.504	S	S	.	.	H	α-helix	trans	-64.6	-37.4	174.2	-75.1	173.6	0	0	0	111.9	E96 D97 E98 K104	E96-L100 WeakPolarHBondContact O-CB 3.36Å; E96-L100 VanDerWaalsContact O-CG 3.27Å; E96-L100 WeakPolarHBondContact O-CG 3.45Å; E96-L100 PolarHBondContact O-N 3.47Å; D97-L100 PolarHBondContact O-N 3.23Å; E98-L100 VanDerWaalsContact C-N 3.35Å; E98-L100 PolarHBondContact O-N 3.17Å; L100-K104 WeakPolarHBondContact O-CG 3.37Å; L100-K104 PolarHBondContact O-N 3.05Å
101	G	95.3	Very high	95.3	Very high	40 Å²	40	100.9 Å²	100.9	41%	0.412	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-49.7	173.8	0	0	0	0	0	112.1	D97 E98 L99 K103 K104 E105	D97-G101 PolarHBondContact O-N 3.06Å; E98-G101 PolarHBondContact O-N 2.85Å; E98-G101 VanDerWaalsContact O-N 3.17Å; L99-G101 VanDerWaalsContact C-N 3.32Å; G101-K103 PolarHBondContact O-N 3.35Å; G101-K104 PolarHBondContact O-N 3.07Å; G101-E105 PolarHBondContact O-N 2.99Å; G101-E105 VanDerWaalsContact O-N 3.07Å
102	M	93.8	Very high	95.3	Very high	130 Å²	130	100.8 Å²	100.8	64%	0.64	50%	0.502	S	S	*	.	H	α-helix	trans	-60.1	-44.1	176.1	-72.2	-174.9	63.6	0	0	112	E98 L99 K104 E105 T106	E98-M102 WeakPolarHBondContact O-CG 3.37Å; E98-M102 PolarHBondContact O-N 2.85Å; L99-M102 PolarHBondContact O-N 2.93Å; M102-K104 PolarHBondContact O-N 3.39Å; M102-E105 PolarHBondContact O-N 3.34Å; M102-T106 WeakPolarHBondContact O-CG2 3.41Å; M102-T106 PolarHBondContact O-N 3.43Å; M102-T106 PolarHBondContact O-OG1 2.83Å
103	K	96.8	Very high	95.5	Very high	123 Å²	123	102.2 Å²	102.2	54%	0.535	51%	0.51	S	S	.	.	H	α-helix	trans	-59.2	-47	177.2	-172.9	-166.9	173.3	-163.7	0	111.7	L99 G101 E105 T106 D107	L99-K103 WeakPolarHBondContact O-CB 3.27Å; L99-K103 PolarHBondContact O-N 3.47Å; G101-K103 PolarHBondContact O-N 3.35Å; K103-E105 VanDerWaalsContact C-N 3.28Å; K103-E105 PolarHBondContact O-N 2.87Å; K103-T106 WeakPolarHBondContact CA-OG1 3.42Å; K103-T106 PolarHBondContact O-N 2.82Å; K103-T106 PolarHBondContact O-OG1 3.14Å; K103-D107 WeakPolarHBondContact O-CB 3.12Å; K103-D107 PolarHBondContact O-N 3.14Å
104	K	97.4	Very high	95.6	Very high	138 Å²	138	102.5 Å²	102.5	60%	0.6	51%	0.511	S	S	*	.	H	α-helix	trans	-60.4	-38.9	177.3	-75.8	174.5	-178.9	176.3	0	112.1	L100 G101 M102 D107 K108	L100-K104 WeakPolarHBondContact O-CG 3.37Å; L100-K104 PolarHBondContact O-N 3.05Å; G101-K104 PolarHBondContact O-N 3.07Å; M102-K104 PolarHBondContact O-N 3.39Å; K104-D107 PolarHBondContact O-N 2.97Å; K104-K108 WeakPolarHBondContact O-CG 3.3Å; K104-K108 PolarHBondContact O-N 3.19Å
105	E	96.2	Very high	95.6	Very high	86 Å²	86	104.6 Å²	104.6	40%	0.402	51%	0.514	S	S	.	.	H	α-helix	trans	-68.5	-39.9	177.4	-174.2	59.7	-158.7	0	0	112	G101 M102 K103 K109	G101-E105 PolarHBondContact O-N 2.99Å; G101-E105 VanDerWaalsContact O-N 3.07Å; M102-E105 PolarHBondContact O-N 3.34Å; K103-E105 VanDerWaalsContact C-N 3.28Å; K103-E105 PolarHBondContact O-N 2.87Å; E105-K109 WeakPolarHBondContact O-CG 3.22Å; E105-K109 PolarHBondContact O-N 3.07Å; E105-K109 VanDerWaalsContact O-N 3.12Å; E105-K109 WeakPolarHBondContact OE1-CE 3.33Å
106	T	92.6	Very high	95.7	Very high	80 Å²	80	105.1 Å²	105.1	49%	0.491	52%	0.517	S	S	.	.	H	α-helix	trans	-67.3	-36.7	174.1	54.4	0	0	0	0	112.4	M102 K103 K109 F110	M102-T106 WeakPolarHBondContact O-CG2 3.41Å; M102-T106 PolarHBondContact O-N 3.43Å; M102-T106 PolarHBondContact O-OG1 2.83Å; K103-T106 WeakPolarHBondContact CA-OG1 3.42Å; K103-T106 PolarHBondContact O-N 2.82Å; K103-T106 PolarHBondContact O-OG1 3.14Å; T106-K109 PolarHBondContact O-N 3.43Å; T106-F110 WeakPolarHBondContact O-CB 3.34Å; T106-F110 PolarHBondContact O-N 3.36Å
107	D	96	Very high	95.9	Very high	72 Å²	72	105.4 Å²	105.4	39%	0.385	52%	0.521	S	S	.	.	H	α-helix	trans	-65.5	-43.3	177.2	-68.5	-16.7	0	0	0	110.6	K103 K104 K109 F110 E111	K103-D107 WeakPolarHBondContact O-CB 3.12Å; K103-D107 PolarHBondContact O-N 3.14Å; K104-D107 PolarHBondContact O-N 2.97Å; D107-K109 PolarHBondContact O-N 3.05Å; D107-F110 WeakPolarHBondContact O-CB 3.34Å; D107-F110 PolarHBondContact O-N 2.61Å; D107-E111 WeakPolarHBondContact O-CG 3.46Å; D107-E111 PolarHBondContact O-N 3.21Å
108	K	97.2	Very high	95.9	Very high	113 Å²	113	106.6 Å²	106.6	49%	0.491	52%	0.517	S	S	.	.	H	α-helix	trans	-59.3	-47.1	173.2	-73.1	174	-176	177.1	0	112.8	K104 F110 E111 E112	K104-K108 WeakPolarHBondContact O-CG 3.3Å; K104-K108 PolarHBondContact O-N 3.19Å; K108-F110 PolarHBondContact O-N 3.5Å; K108-E111 PolarHBondContact O-N 2.9Å; K108-E112 WeakPolarHBondContact O-CG 3.4Å; K108-E112 PolarHBondContact O-N 3.24Å
109	K	96.8	Very high	95.9	Very high	110 Å²	110	106.2 Å²	106.2	48%	0.478	52%	0.515	S	S	.	.	H	α-helix	trans	-61.4	-34.2	177.1	-72.4	176.6	-178.2	178.2	0	112	E105 T106 D107 L113	E105-K109 WeakPolarHBondContact O-CG 3.22Å; E105-K109 PolarHBondContact O-N 3.07Å; E105-K109 VanDerWaalsContact O-N 3.12Å; E105-K109 WeakPolarHBondContact OE1-CE 3.33Å; T106-K109 PolarHBondContact O-N 3.43Å; D107-K109 PolarHBondContact O-N 3.05Å; K109-L113 WeakPolarHBondContact O-CB 3.49Å; K109-L113 VanDerWaalsContact O-CG 3.31Å; K109-L113 WeakPolarHBondContact O-CG 3.39Å; K109-L113 PolarHBondContact O-N 2.87Å; K109-L113 VanDerWaalsContact O-N 3.07Å
110	F	95.7	Very high	96	Very high	135 Å²	135	107.6 Å²	107.6	59%	0.592	51%	0.513	S	S	*	.	H	α-helix	trans	-67.2	-46.3	174.6	-176.9	-91.3	0	0	0	111.4	T106 D107 K108 E112 L113 E114	T106-F110 WeakPolarHBondContact O-CB 3.34Å; T106-F110 PolarHBondContact O-N 3.36Å; D107-F110 WeakPolarHBondContact O-CB 3.34Å; D107-F110 PolarHBondContact O-N 2.61Å; K108-F110 PolarHBondContact O-N 3.5Å; F110-E112 PolarHBondContact O-N 3.49Å; F110-L113 PolarHBondContact O-N 3.33Å; F110-E114 WeakPolarHBondContact O-CB 3.25Å; F110-E114 PolarHBondContact O-N 2.89Å
111	E	96.5	Very high	96	Very high	117 Å²	117	108 Å²	108	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-58.3	-45	175.2	-70.9	174.2	-176.7	0	0	111.9	D107 K108 L113 E114 E115	D107-E111 WeakPolarHBondContact O-CG 3.46Å; D107-E111 PolarHBondContact O-N 3.21Å; K108-E111 PolarHBondContact O-N 2.9Å; E111-L113 PolarHBondContact O-N 3.48Å; E111-E114 PolarHBondContact O-N 2.98Å; E111-E115 WeakPolarHBondContact O-CG 3.4Å; E111-E115 PolarHBondContact O-N 3.25Å
112	E	97	Very high	96.1	Very high	112 Å²	112	110.7 Å²	110.7	52%	0.523	52%	0.517	S	S	.	.	H	α-helix	trans	-61.4	-43	175.9	-71.7	172.5	-170.1	0	0	112.5	K108 F110 E115 N116	K108-E112 WeakPolarHBondContact O-CG 3.4Å; K108-E112 PolarHBondContact O-N 3.24Å; F110-E112 PolarHBondContact O-N 3.49Å; E112-E115 PolarHBondContact O-N 3.49Å; E112-N116 PolarHBondContact O-N 3.49Å; E112-N116 PolarHBondContact O-ND2 3.01Å
113	L	95.4	Very high	96.2	Very high	120 Å²	120	109.1 Å²	109.1	63%	0.628	51%	0.511	S	S	*	.	H	α-helix	trans	-67.6	-36.4	176.3	-76	171	0	0	0	112.1	K109 F110 E111 N116 L117	K109-L113 WeakPolarHBondContact O-CB 3.49Å; K109-L113 VanDerWaalsContact O-CG 3.31Å; K109-L113 WeakPolarHBondContact O-CG 3.39Å; K109-L113 PolarHBondContact O-N 2.87Å; K109-L113 VanDerWaalsContact O-N 3.07Å; F110-L113 PolarHBondContact O-N 3.33Å; E111-L113 PolarHBondContact O-N 3.48Å; L113-N116 PolarHBondContact O-N 3.31Å; L113-L117 WeakPolarHBondContact O-CB 3.31Å; L113-L117 PolarHBondContact O-N 3.25Å
114	E	95.3	Very high	96.1	Very high	95 Å²	95	107.1 Å²	107.1	44%	0.444	51%	0.509	S	S	.	.	H	α-helix	trans	-67.9	-37.9	175.6	-172	174.5	-175	0	0	111.7	F110 E111 L117 R118	F110-E114 WeakPolarHBondContact O-CB 3.25Å; F110-E114 PolarHBondContact O-N 2.89Å; E111-E114 PolarHBondContact O-N 2.98Å; E114-L117 PolarHBondContact O-N 3.27Å; E114-R118 WeakPolarHBondContact O-CG 3.47Å; E114-R118 PolarHBondContact O-N 3.39Å
115	E	96.5	Very high	96.1	Very high	112 Å²	112	107.4 Å²	107.4	52%	0.523	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-48.1	171	-79.1	179.7	179.1	0	0	112.3	E111 E112 L117 R118 H119	E111-E115 WeakPolarHBondContact O-CG 3.4Å; E111-E115 PolarHBondContact O-N 3.25Å; E112-E115 PolarHBondContact O-N 3.49Å; E115-L117 VanDerWaalsContact C-N 3.35Å; E115-L117 PolarHBondContact O-N 3.46Å; E115-R118 PolarHBondContact O-N 3.01Å; E115-R118 IonicContact OE1-NH2 2.97Å; E115-H119 PolarHBondContact O-N 3.28Å
116	N	96.6	Very high	96.1	Very high	84 Å²	84	107.2 Å²	107.2	45%	0.449	51%	0.512	S	S	.	.	H	α-helix	trans	-61.7	-42.4	176.7	-73.9	-31.9	0	0	0	111.8	E112 L113 R118 H119 Y120	E112-N116 PolarHBondContact O-N 3.49Å; E112-N116 PolarHBondContact O-ND2 3.01Å; L113-N116 PolarHBondContact O-N 3.31Å; N116-R118 VanDerWaalsContact C-N 3.35Å; N116-R118 PolarHBondContact O-N 3.17Å; N116-H119 WeakPolarHBondContact O-CB 3.4Å; N116-H119 PolarHBondContact O-N 3.46Å; N116-Y120 HydrophobicContact CB-CE2 4.43Å; N116-Y120 WeakPolarHBondContact O-CD2 3.38Å; N116-Y120 PolarHBondContact O-N 3.2Å
117	L	96.3	Very high	96.2	Very high	99 Å²	99	105.5 Å²	105.5	52%	0.518	51%	0.506	S	S	.	.	H	α-helix	trans	-60.1	-44.6	175.2	179.6	63.5	0	0	0	111.4	L113 E114 E115 H119 Y120 Q121	L113-L117 WeakPolarHBondContact O-CB 3.31Å; L113-L117 PolarHBondContact O-N 3.25Å; E114-L117 PolarHBondContact O-N 3.27Å; E115-L117 VanDerWaalsContact C-N 3.35Å; E115-L117 PolarHBondContact O-N 3.46Å; L117-H119 VanDerWaalsContact C-N 3.31Å; L117-H119 PolarHBondContact O-N 2.82Å; L117-Y120 PolarHBondContact O-N 3.28Å; L117-Q121 HydrophobicContact CD1-CG 4.39Å; L117-Q121 WeakPolarHBondContact O-CB 3.49Å; L117-Q121 VanDerWaalsContact O-CG 3.25Å; L117-Q121 WeakPolarHBondContact O-CG 3.13Å; L117-Q121 PolarHBondContact O-N 3.49Å
118	R	96.2	Very high	96.2	Very high	138 Å²	138	106.6 Å²	106.6	52%	0.521	51%	0.511	S	S	.	.	H	α-helix	trans	-60.7	-40.4	175.1	-76.6	-174.4	-74.9	139.7	-11.3	111.9	E114 E115 N116 Q121 L122	E114-R118 WeakPolarHBondContact O-CG 3.47Å; E114-R118 PolarHBondContact O-N 3.39Å; E115-R118 PolarHBondContact O-N 3.01Å; E115-R118 IonicContact OE1-NH2 2.97Å; N116-R118 VanDerWaalsContact C-N 3.35Å; N116-R118 PolarHBondContact O-N 3.17Å; R118-Q121 PolarHBondContact O-N 2.97Å; R118-L122 PolarHBondContact O-N 2.88Å; R118-L122 VanDerWaalsContact O-N 3.07Å
119	H	97	Very high	96.1	Very high	116 Å²	116	104.5 Å²	104.5	54%	0.537	51%	0.506	S	S	.	.	H	α-helix	trans	-63.2	-48.9	176.1	-178.7	67.1	0	0	0	112.1	E115 N116 L117 Q121 L122 L123	E115-H119 PolarHBondContact O-N 3.28Å; N116-H119 WeakPolarHBondContact O-CB 3.4Å; N116-H119 PolarHBondContact O-N 3.46Å; L117-H119 VanDerWaalsContact C-N 3.31Å; L117-H119 PolarHBondContact O-N 2.82Å; H119-Q121 VanDerWaalsContact C-N 3.34Å; H119-Q121 PolarHBondContact O-N 2.97Å; H119-L122 PolarHBondContact O-N 3.35Å; H119-L123 PolarHBondContact O-N 2.95Å
120	Y	95.6	Very high	96	Very high	148 Å²	148	105.1 Å²	105.1	58%	0.58	51%	0.51	S	S	*	.	H	α-helix	trans	-63.7	-38	176.9	-72.8	-59.4	0	0	0	112.6	N116 L117 L122 L123 V124	N116-Y120 HydrophobicContact CB-CE2 4.43Å; N116-Y120 WeakPolarHBondContact O-CD2 3.38Å; N116-Y120 PolarHBondContact O-N 3.2Å; L117-Y120 PolarHBondContact O-N 3.28Å; Y120-L122 VanDerWaalsContact C-N 3.31Å; Y120-L122 PolarHBondContact O-N 2.9Å; Y120-L123 PolarHBondContact O-N 3.42Å; Y120-V124 VanDerWaalsContact O-CG2 3.31Å; Y120-V124 WeakPolarHBondContact O-CG2 3.42Å; Y120-V124 PolarHBondContact O-N 2.8Å
121	Q	96.2	Very high	96	Very high	100 Å²	100	102.7 Å²	102.7	47%	0.467	50%	0.502	S	S	.	.	H	α-helix	trans	-61.2	-39.7	174	-76.6	176.1	2.7	0	0	112.3	L117 R118 H119 K125	L117-Q121 HydrophobicContact CD1-CG 4.39Å; L117-Q121 WeakPolarHBondContact O-CB 3.49Å; L117-Q121 VanDerWaalsContact O-CG 3.25Å; L117-Q121 WeakPolarHBondContact O-CG 3.13Å; L117-Q121 PolarHBondContact O-N 3.49Å; R118-Q121 PolarHBondContact O-N 2.97Å; H119-Q121 VanDerWaalsContact C-N 3.34Å; H119-Q121 PolarHBondContact O-N 2.97Å; Q121-K125 WeakPolarHBondContact O-CG 3.42Å; Q121-K125 PolarHBondContact O-N 3.45Å
122	L	96.4	Very high	95.9	Very high	97 Å²	97	103.1 Å²	103.1	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-66.5	-42.8	175	-175.1	66.9	0	0	0	111.3	R118 H119 Y120 V124 K125 N126	R118-L122 PolarHBondContact O-N 2.88Å; R118-L122 VanDerWaalsContact O-N 3.07Å; H119-L122 PolarHBondContact O-N 3.35Å; Y120-L122 VanDerWaalsContact C-N 3.31Å; Y120-L122 PolarHBondContact O-N 2.9Å; L122-V124 PolarHBondContact O-N 2.95Å; L122-K125 PolarHBondContact O-N 2.98Å; L122-N126 VanDerWaalsContact O-CG 3.28Å; L122-N126 PolarHBondContact O-N 2.81Å; L122-N126 PolarHBondContact O-OD1 3.44Å
123	L	96.8	Very high	95.8	Very high	96 Å²	96	104.9 Å²	104.9	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-61.7	-43.3	177.5	-173.8	63.8	0	0	0	111.8	H119 Y120 N126 A127	H119-L123 PolarHBondContact O-N 2.95Å; Y120-L123 PolarHBondContact O-N 3.42Å; L123-N126 PolarHBondContact O-N 3.05Å; L123-A127 WeakPolarHBondContact O-CB 3.18Å; L123-A127 PolarHBondContact O-N 3.19Å
124	V	95.2	Very high	95.7	Very high	81 Å²	81	104.9 Å²	104.9	49%	0.491	51%	0.505	S	S	.	.	H	α-helix	trans	-62.6	-42.9	174.5	170.8	0	0	0	0	111.1	Y120 L122 N126 A127 N128	Y120-V124 VanDerWaalsContact O-CG2 3.31Å; Y120-V124 WeakPolarHBondContact O-CG2 3.42Å; Y120-V124 PolarHBondContact O-N 2.8Å; L122-V124 PolarHBondContact O-N 2.95Å; V124-N126 PolarHBondContact O-N 3.18Å; V124-A127 PolarHBondContact O-N 3.44Å; V124-N128 WeakPolarHBondContact O-CB 3.42Å; V124-N128 VanDerWaalsContact O-CG 3.25Å; V124-N128 PolarHBondContact O-N 2.94Å
125	K	96.8	Very high	95.6	Very high	145 Å²	145	105.7 Å²	105.7	63%	0.63	51%	0.508	S	S	*	.	H	α-helix	trans	-61.3	-43	175.5	-78.2	179.5	178.7	-179.5	0	112.2	Q121 L122 N128 D129	Q121-K125 WeakPolarHBondContact O-CG 3.42Å; Q121-K125 PolarHBondContact O-N 3.45Å; L122-K125 PolarHBondContact O-N 2.98Å; K125-N128 PolarHBondContact O-N 2.66Å; K125-D129 PolarHBondContact O-N 3.48Å
126	N	95.5	Very high	95.5	Very high	82 Å²	82	105.8 Å²	105.8	44%	0.439	51%	0.509	S	S	.	.	H	α-helix	trans	-65.2	-44.9	176.9	-68.9	-9.9	0	0	0	111.2	L122 L123 V124 N128 D129 H130	L122-N126 VanDerWaalsContact O-CG 3.28Å; L122-N126 PolarHBondContact O-N 2.81Å; L122-N126 PolarHBondContact O-OD1 3.44Å; L123-N126 PolarHBondContact O-N 3.05Å; V124-N126 PolarHBondContact O-N 3.18Å; N126-N128 VanDerWaalsContact C-N 3.34Å; N126-N128 PolarHBondContact O-N 3.32Å; N126-D129 PolarHBondContact O-N 2.99Å; N126-H130 PolarHBondContact O-CD2 3.47Å; N126-H130 PolarHBondContact O-N 3.38Å
127	A	95.4	Very high	95.4	Very high	44 Å²	44	109.8 Å²	109.8	36%	0.364	52%	0.518	S	S	.	.	H	α-helix	trans	-60.8	-42	176	0	0	0	0	0	111.9	L123 V124 H130 I131	L123-A127 WeakPolarHBondContact O-CB 3.18Å; L123-A127 PolarHBondContact O-N 3.19Å; V124-A127 PolarHBondContact O-N 3.44Å; A127-H130 WeakPolarHBondContact O-CB 3.11Å; A127-H130 PolarHBondContact O-N 2.92Å; A127-I131 VanDerWaalsContact O-CG1 3.31Å; A127-I131 WeakPolarHBondContact O-CG1 3.41Å; A127-I131 PolarHBondContact O-N 3.3Å
128	N	96.2	Very high	95.2	Very high	94 Å²	94	109.5 Å²	109.5	50%	0.503	51%	0.513	S	S	.	.	H	α-helix	trans	-64.1	-39.6	175.3	-74.8	-10.3	0	0	0	112.4	V124 K125 N126 H130 I131 F132	V124-N128 WeakPolarHBondContact O-CB 3.42Å; V124-N128 VanDerWaalsContact O-CG 3.25Å; V124-N128 PolarHBondContact O-N 2.94Å; K125-N128 PolarHBondContact O-N 2.66Å; N126-N128 VanDerWaalsContact C-N 3.34Å; N126-N128 PolarHBondContact O-N 3.32Å; N128-H130 VanDerWaalsContact C-N 3.33Å; N128-I131 PolarHBondContact O-N 2.84Å; N128-F132 WeakPolarHBondContact O-CB 3.47Å; N128-F132 PolarHBondContact O-N 3.41Å
129	D	95.4	Very high	95.1	Very high	70 Å²	70	108.7 Å²	108.7	37%	0.374	52%	0.516	S	S	.	.	H	α-helix	trans	-63.4	-39.5	173.9	-172.5	64	0	0	0	111.5	K125 N126 F132 R133	K125-D129 PolarHBondContact O-N 3.48Å; N126-D129 PolarHBondContact O-N 2.99Å; D129-F132 PolarHBondContact O-N 3.47Å; D129-R133 VanDerWaalsContact O-CG 3.31Å; D129-R133 WeakPolarHBondContact O-CG 3.47Å; D129-R133 PolarHBondContact O-N 3.24Å; D129-R133 VanDerWaalsContact O-N 3.13Å; D129-R133 IonicContact OD1-NE 3.22Å; D129-R133 IonicContact OD2-CZ 3.88Å; D129-R133 VanDerWaalsContact OD2-CZ 3.22Å; D129-R133 IonicContact OD2-NE 3.76Å; D129-R133 PolarHBondContact OD2-NE 2.89Å; D129-R133 IonicContact OD2-NH2 2.75Å; D129-R133 PolarHBondContact OD2-NH2 3.38Å
130	H	94.6	Very high	95	Very high	122 Å²	122	107.8 Å²	107.8	57%	0.565	52%	0.515	S	S	*	.	H	α-helix	trans	-64.2	-44.2	173.9	-79.1	-69.5	0	0	0	112.7	N126 A127 N128 R133 L134	N126-H130 PolarHBondContact O-CD2 3.47Å; N126-H130 PolarHBondContact O-N 3.38Å; A127-H130 WeakPolarHBondContact O-CB 3.11Å; A127-H130 PolarHBondContact O-N 2.92Å; N128-H130 VanDerWaalsContact C-N 3.33Å; H130-R133 PolarHBondContact O-N 2.91Å; H130-L134 WeakPolarHBondContact O-CG 3.37Å; H130-L134 PolarHBondContact O-N 3.46Å; H130-L134 VanDerWaalsContact O-N 3.13Å
131	I	94.9	Very high	94.9	Very high	85 Å²	85	106 Å²	106	44%	0.436	52%	0.515	S	S	.	.	H	α-helix	trans	-60.6	-49	176.1	-70	164.7	0	0	0	109.8	A127 N128 R133 L134 E135	A127-I131 VanDerWaalsContact O-CG1 3.31Å; A127-I131 WeakPolarHBondContact O-CG1 3.41Å; A127-I131 PolarHBondContact O-N 3.3Å; N128-I131 PolarHBondContact O-N 2.84Å; I131-R133 VanDerWaalsContact C-N 3.32Å; I131-R133 PolarHBondContact O-N 2.88Å; I131-L134 CarbonylContact O-C 3.57Å; I131-L134 WeakPolarHBondContact O-CA 3.25Å; I131-L134 WeakPolarHBondContact O-CB 3.39Å; I131-L134 PolarHBondContact O-N 2.87Å; I131-E135 HydrophobicContact CG2-CG 4.09Å; I131-E135 WeakPolarHBondContact CG2-OE1 3.38Å; I131-E135 WeakPolarHBondContact O-CG 3.37Å; I131-E135 PolarHBondContact O-N 2.87Å
132	F	94.9	Very high	94.8	Very high	126 Å²	126	108.4 Å²	108.4	55%	0.553	52%	0.52	S	S	*	.	H	α-helix	trans	-57.3	-42.6	-179.6	-177	-97.7	0	0	0	112.7	N128 D129 L134 E135 E136	N128-F132 WeakPolarHBondContact O-CB 3.47Å; N128-F132 PolarHBondContact O-N 3.41Å; D129-F132 PolarHBondContact O-N 3.47Å; F132-L134 VanDerWaalsContact C-N 3.34Å; F132-L134 PolarHBondContact O-N 2.87Å; F132-E135 PolarHBondContact O-N 2.91Å; F132-E136 PolarHBondContact O-N 3.43Å
133	R	94.1	Very high	94.7	Very high	149 Å²	149	106.9 Å²	106.9	56%	0.562	52%	0.517	S	S	*	.	H	α-helix	trans	-65.4	-35.2	175.5	-68.8	174.1	-166.9	-148.5	7.3	113.1	D129 H130 I131 R137	D129-R133 VanDerWaalsContact O-CG 3.31Å; D129-R133 WeakPolarHBondContact O-CG 3.47Å; D129-R133 PolarHBondContact O-N 3.24Å; D129-R133 VanDerWaalsContact O-N 3.13Å; D129-R133 IonicContact OD1-NE 3.22Å; D129-R133 IonicContact OD2-CZ 3.88Å; D129-R133 VanDerWaalsContact OD2-CZ 3.22Å; D129-R133 IonicContact OD2-NE 3.76Å; D129-R133 PolarHBondContact OD2-NE 2.89Å; D129-R133 IonicContact OD2-NH2 2.75Å; D129-R133 PolarHBondContact OD2-NH2 3.38Å; H130-R133 PolarHBondContact O-N 2.91Å; I131-R133 VanDerWaalsContact C-N 3.32Å; I131-R133 PolarHBondContact O-N 2.88Å; R133-R137 WeakPolarHBondContact O-CB 3.43Å; R133-R137 PolarHBondContact O-N 3.25Å
134	L	93.3	Very high	94.6	Very high	120 Å²	120	106.7 Å²	106.7	63%	0.628	51%	0.513	S	S	*	.	H	α-helix	trans	-72.6	-40.5	176.7	-72.1	174.2	0	0	0	111.2	H130 I131 F132 R137 E138	H130-L134 WeakPolarHBondContact O-CG 3.37Å; H130-L134 PolarHBondContact O-N 3.46Å; H130-L134 VanDerWaalsContact O-N 3.13Å; I131-L134 CarbonylContact O-C 3.57Å; I131-L134 WeakPolarHBondContact O-CA 3.25Å; I131-L134 WeakPolarHBondContact O-CB 3.39Å; I131-L134 PolarHBondContact O-N 2.87Å; F132-L134 VanDerWaalsContact C-N 3.34Å; F132-L134 PolarHBondContact O-N 2.87Å; L134-R137 PolarHBondContact O-N 2.78Å; L134-E138 WeakPolarHBondContact O-CB 3.46Å; L134-E138 PolarHBondContact O-N 2.92Å
135	E	94.1	Very high	94.5	Very high	111 Å²	111	108 Å²	108	52%	0.519	52%	0.517	S	S	.	.	H	α-helix	trans	-61.7	-42.5	174.5	-72.4	176	165.6	0	0	111.7	I131 F132 E138 Q139	I131-E135 HydrophobicContact CG2-CG 4.09Å; I131-E135 WeakPolarHBondContact CG2-OE1 3.38Å; I131-E135 WeakPolarHBondContact O-CG 3.37Å; I131-E135 PolarHBondContact O-N 2.87Å; F132-E135 PolarHBondContact O-N 2.91Å; E135-E138 PolarHBondContact O-N 3.46Å; E135-Q139 WeakPolarHBondContact O-CB 3.26Å; E135-Q139 PolarHBondContact O-N 2.91Å
136	E	93.2	Very high	94.3	Very high	115 Å²	115	104.7 Å²	104.7	54%	0.537	51%	0.512	S	S	.	.	H	α-helix	trans	-60.3	-47.1	174.1	-176.3	177.8	-153.3	0	0	111.1	F132 E138 Q139 D140	F132-E136 PolarHBondContact O-N 3.43Å; E136-E138 VanDerWaalsContact C-N 3.34Å; E136-E138 PolarHBondContact O-N 3.17Å; E136-Q139 PolarHBondContact O-N 3.46Å; E136-D140 PolarHBondContact O-N 3.35Å
137	R	94.3	Very high	94.2	Very high	168 Å²	168	102.4 Å²	102.4	63%	0.634	51%	0.505	S	S	*	.	H	α-helix	trans	-65.3	-36.2	177.6	-171.2	174.4	178.8	77	1.6	112.5	R133 L134 L141	R133-R137 WeakPolarHBondContact O-CB 3.43Å; R133-R137 PolarHBondContact O-N 3.25Å; L134-R137 PolarHBondContact O-N 2.78Å; R137-L141 WeakPolarHBondContact O-CG 3.34Å; R137-L141 PolarHBondContact O-N 3.5Å; R137-L141 VanDerWaalsContact O-N 3.09Å
138	E	93.1	Very high	94.1	Very high	92 Å²	92	103.3 Å²	103.3	43%	0.43	50%	0.501	S	S	.	.	H	α-helix	trans	-65.6	-43	173.9	-171.2	-172.3	157.4	0	0	110.8	L134 E135 E136 D140 L141 R142	L134-E138 WeakPolarHBondContact O-CB 3.46Å; L134-E138 PolarHBondContact O-N 2.92Å; E135-E138 PolarHBondContact O-N 3.46Å; E136-E138 VanDerWaalsContact C-N 3.34Å; E136-E138 PolarHBondContact O-N 3.17Å; E138-D140 VanDerWaalsContact C-N 3.34Å; E138-D140 PolarHBondContact O-N 3.04Å; E138-L141 PolarHBondContact O-N 2.92Å; E138-R142 HydrophobicContact CG-CG 4.49Å; E138-R142 WeakPolarHBondContact O-CB 3.45Å; E138-R142 VanDerWaalsContact O-CG 3.32Å; E138-R142 WeakPolarHBondContact O-CG 3.38Å; E138-R142 PolarHBondContact O-N 3.49Å; E138-R142 IonicContact OE1-CZ 3.27Å; E138-R142 IonicContact OE1-NE 2.64Å; E138-R142 PolarHBondContact OE1-NE 3.37Å; E138-R142 IonicContact OE1-NH2 3.87Å; E138-R142 PolarHBondContact OE1-NH2 3.38Å
139	Q	94.9	Very high	93.9	Very high	122 Å²	122	102.4 Å²	102.4	57%	0.57	50%	0.497	S	S	*	.	H	α-helix	trans	-63.1	-40.7	177.2	-175.6	61.5	14.3	0	0	111.8	E135 E136 R142 S143	E135-Q139 WeakPolarHBondContact O-CB 3.26Å; E135-Q139 PolarHBondContact O-N 2.91Å; E136-Q139 PolarHBondContact O-N 3.46Å; Q139-R142 PolarHBondContact O-N 2.9Å; Q139-S143 WeakPolarHBondContact O-CB 3.45Å; Q139-S143 PolarHBondContact O-N 3.45Å
140	D	93.9	Very high	93.7	Very high	97 Å²	97	104.2 Å²	104.2	52%	0.519	50%	0.503	S	S	.	.	H	α-helix	trans	-59.1	-47.9	172.8	-74.9	-19	0	0	0	111.2	E136 E138 R142 S143 E144	E136-D140 PolarHBondContact O-N 3.35Å; E138-D140 VanDerWaalsContact C-N 3.34Å; E138-D140 PolarHBondContact O-N 3.04Å; D140-R142 PolarHBondContact O-N 3.23Å; D140-S143 PolarHBondContact O-N 3.46Å; D140-S143 PolarHBondContact O-OG 3.01Å; D140-E144 PolarHBondContact O-N 3.22Å
141	L	93.7	Very high	93.7	Very high	111 Å²	111	104.1 Å²	104.1	58%	0.581	50%	0.497	S	S	*	.	H	α-helix	trans	-63	-40.6	177.4	-72.2	171.8	0	0	0	112.4	R137 E138 S143 E144 L145	R137-L141 WeakPolarHBondContact O-CG 3.34Å; R137-L141 PolarHBondContact O-N 3.5Å; R137-L141 VanDerWaalsContact O-N 3.09Å; E138-L141 PolarHBondContact O-N 2.92Å; L141-S143 VanDerWaalsContact C-N 3.3Å; L141-S143 PolarHBondContact O-N 3.27Å; L141-E144 PolarHBondContact O-N 3.44Å; L141-L145 WeakPolarHBondContact O-CB 3.41Å; L141-L145 PolarHBondContact O-N 3.12Å
142	R	94.1	Very high	93.5	Very high	150 Å²	150	107.3 Å²	107.3	57%	0.566	51%	0.505	S	S	*	.	H	α-helix	trans	-61.7	-39.9	174.2	-75	175.4	177.1	-122.8	5	111.1	E138 Q139 D140 S146	E138-R142 HydrophobicContact CG-CG 4.49Å; E138-R142 WeakPolarHBondContact O-CB 3.45Å; E138-R142 VanDerWaalsContact O-CG 3.32Å; E138-R142 WeakPolarHBondContact O-CG 3.38Å; E138-R142 PolarHBondContact O-N 3.49Å; E138-R142 IonicContact OE1-CZ 3.27Å; E138-R142 IonicContact OE1-NE 2.64Å; E138-R142 PolarHBondContact OE1-NE 3.37Å; E138-R142 IonicContact OE1-NH2 3.87Å; E138-R142 PolarHBondContact OE1-NH2 3.38Å; Q139-R142 PolarHBondContact O-N 2.9Å; D140-R142 PolarHBondContact O-N 3.23Å; R142-S146 WeakPolarHBondContact O-CB 3.44Å; R142-S146 PolarHBondContact O-N 3.38Å
143	S	94.1	Very high	93.3	Very high	64 Å²	64	104.2 Å²	104.2	45%	0.448	50%	0.496	S	S	.	.	H	α-helix	trans	-69.3	-41.3	177.7	80.2	0	0	0	0	112.7	Q139 D140 L141 S146 A147	Q139-S143 WeakPolarHBondContact O-CB 3.45Å; Q139-S143 PolarHBondContact O-N 3.45Å; D140-S143 PolarHBondContact O-N 3.46Å; D140-S143 PolarHBondContact O-OG 3.01Å; L141-S143 VanDerWaalsContact C-N 3.3Å; L141-S143 PolarHBondContact O-N 3.27Å; S143-S146 WeakPolarHBondContact O-CB 3.43Å; S143-S146 PolarHBondContact O-N 3.17Å; S143-A147 WeakPolarHBondContact O-CB 3.41Å; S143-A147 PolarHBondContact O-N 3.39Å
144	E	94.3	Very high	93.3	Very high	92 Å²	92	102.2 Å²	102.2	43%	0.43	49%	0.492	S	S	.	.	H	α-helix	trans	-67	-41.3	175.8	-177.1	61.1	-150.4	0	0	111	D140 L141 S146 A147 Q148 R151	D140-E144 PolarHBondContact O-N 3.22Å; L141-E144 PolarHBondContact O-N 3.44Å; E144-S146 VanDerWaalsContact C-N 3.33Å; E144-S146 PolarHBondContact O-N 2.89Å; E144-A147 PolarHBondContact O-N 3.33Å; E144-Q148 HydrophobicContact CG-CG 4.44Å; E144-Q148 VanDerWaalsContact O-CG 3.25Å; E144-Q148 WeakPolarHBondContact O-CG 3.42Å; E144-Q148 PolarHBondContact O-N 2.95Å; E144-Q148 PolarHBondContact OE1-NE2 3.11Å; E144-R151 IonicContact OE1-CZ 3.95Å; E144-R151 IonicContact OE1-NH2 2.82Å; E144-R151 PolarHBondContact OE1-NH2 3.41Å
145	L	92.8	Very high	93.2	Very high	110 Å²	110	100.4 Å²	100.4	58%	0.576	48%	0.482	S	S	*	.	H	α-helix	trans	-59.6	-44.3	174.2	-176.6	69	0	0	0	111.2	L141 Q148 N149	L141-L145 WeakPolarHBondContact O-CB 3.41Å; L141-L145 PolarHBondContact O-N 3.12Å; L145-Q148 PolarHBondContact O-N 2.94Å; L145-N149 WeakPolarHBondContact O-CB 3.04Å; L145-N149 PolarHBondContact O-N 3.34Å; L145-N149 PolarHBondContact O-ND2 2.85Å
146	S	92.5	Very high	93	Very high	75 Å²	75	99.6 Å²	99.6	52%	0.524	48%	0.481	S	S	.	.	H	α-helix	trans	-61	-44.9	174.7	-176	0	0	0	0	111.8	R142 S143 E144 Q148 N149 E150	R142-S146 WeakPolarHBondContact O-CB 3.44Å; R142-S146 PolarHBondContact O-N 3.38Å; S143-S146 WeakPolarHBondContact O-CB 3.43Å; S143-S146 PolarHBondContact O-N 3.17Å; E144-S146 VanDerWaalsContact C-N 3.33Å; E144-S146 PolarHBondContact O-N 2.89Å; S146-Q148 PolarHBondContact O-N 3.25Å; S146-N149 PolarHBondContact O-N 3.08Å; S146-E150 PolarHBondContact O-N 2.86Å
147	A	95	Very high	92.8	Very high	34 Å²	34	99.3 Å²	99.3	28%	0.281	48%	0.478	S	S	.	.	H	α-helix	trans	-66.3	-34.6	178	0	0	0	0	0	113.3	S143 E144 R151	S143-A147 WeakPolarHBondContact O-CB 3.41Å; S143-A147 PolarHBondContact O-N 3.39Å; E144-A147 PolarHBondContact O-N 3.33Å; A147-R151 WeakPolarHBondContact O-CG 3.31Å; A147-R151 PolarHBondContact O-N 3.45Å; A147-R151 VanDerWaalsContact O-N 3.15Å; A147-R151 PolarHBondContact O-NE 3.25Å
148	Q	93.1	Very high	92.6	Very high	63 Å²	63	96.4 Å²	96.4	29%	0.294	47%	0.474	S	S	.	.	H	α-helix	trans	-69	-44	172.5	-67.8	-68.3	-7.6	0	0	111.1	E144 L145 S146 E150 R151 Y152	E144-Q148 HydrophobicContact CG-CG 4.44Å; E144-Q148 VanDerWaalsContact O-CG 3.25Å; E144-Q148 WeakPolarHBondContact O-CG 3.42Å; E144-Q148 PolarHBondContact O-N 2.95Å; E144-Q148 PolarHBondContact OE1-NE2 3.11Å; L145-Q148 PolarHBondContact O-N 2.94Å; S146-Q148 PolarHBondContact O-N 3.25Å; Q148-E150 VanDerWaalsContact C-N 3.31Å; Q148-E150 PolarHBondContact O-N 3.49Å; Q148-R151 VanDerWaalsContact CD-CZ 3.42Å; Q148-R151 WeakPolarHBondContact O-CA 3.22Å; Q148-R151 WeakPolarHBondContact O-CB 3.41Å; Q148-R151 PolarHBondContact O-N 3.31Å; Q148-R151 VanDerWaalsContact O-N 3.08Å; Q148-Y152 HydrophobicContact CB-CE2 4.34Å; Q148-Y152 WeakPolarHBondContact O-CD2 3.42Å; Q148-Y152 PolarHBondContact O-N 2.96Å
149	N	91.6	Very high	92.4	Very high	75 Å²	75	98.7 Å²	98.7	40%	0.401	48%	0.479	S	S	.	.	H	α-helix	trans	-57.8	-44.1	174.4	-76	-25.2	0	0	0	111.4	L145 S146 R151 Y152 T153	L145-N149 WeakPolarHBondContact O-CB 3.04Å; L145-N149 PolarHBondContact O-N 3.34Å; L145-N149 PolarHBondContact O-ND2 2.85Å; S146-N149 PolarHBondContact O-N 3.08Å; N149-R151 VanDerWaalsContact C-N 3.3Å; N149-R151 PolarHBondContact O-N 2.99Å; N149-Y152 PolarHBondContact O-N 3.01Å; N149-T153 PolarHBondContact O-N 3.01Å; N149-T153 PolarHBondContact O-OG1 3.48Å
150	E	91.6	Very high	91.9	Very high	107 Å²	107	93.5 Å²	93.5	50%	0.5	46%	0.456	S	S	.	.	H	α-helix	trans	-61.1	-38.6	175.4	-163.7	-169.1	159.6	0	0	112.2	S146 Q148 T153 K154	S146-E150 PolarHBondContact O-N 2.86Å; Q148-E150 VanDerWaalsContact C-N 3.31Å; Q148-E150 PolarHBondContact O-N 3.49Å; E150-T153 PolarHBondContact O-N 2.83Å; E150-K154 VanDerWaalsContact O-CG 3.31Å; E150-K154 WeakPolarHBondContact O-CG 3.43Å; E150-K154 PolarHBondContact O-N 3.21Å; E150-K154 WeakPolarHBondContact OE1-CE 3.16Å; E150-K154 IonicContact OE1-NZ 2.66Å; E150-K154 PolarHBondContact OE1-NZ 3.07Å
151	R	93.3	Very high	91.5	Very high	121 Å²	121	93.2 Å²	93.2	46%	0.457	46%	0.455	S	S	.	.	H	α-helix	trans	-64.7	-45.4	174	-79.5	179.8	-84.9	-162.9	-7.1	112.2	E144 A147 Q148 N149 K154 L155	E144-R151 IonicContact OE1-CZ 3.95Å; E144-R151 IonicContact OE1-NH2 2.82Å; E144-R151 PolarHBondContact OE1-NH2 3.41Å; A147-R151 WeakPolarHBondContact O-CG 3.31Å; A147-R151 PolarHBondContact O-N 3.45Å; A147-R151 VanDerWaalsContact O-N 3.15Å; A147-R151 PolarHBondContact O-NE 3.25Å; Q148-R151 VanDerWaalsContact CD-CZ 3.42Å; Q148-R151 WeakPolarHBondContact O-CA 3.22Å; Q148-R151 WeakPolarHBondContact O-CB 3.41Å; Q148-R151 PolarHBondContact O-N 3.31Å; Q148-R151 VanDerWaalsContact O-N 3.08Å; N149-R151 VanDerWaalsContact C-N 3.3Å; N149-R151 PolarHBondContact O-N 2.99Å; R151-K154 PolarHBondContact O-N 3.36Å; R151-L155 WeakPolarHBondContact O-CB 3.39Å; R151-L155 PolarHBondContact O-N 3.28Å
152	Y	92.4	Very high	91.2	Very high	152 Å²	152	94.7 Å²	94.7	60%	0.596	45%	0.454	S	S	*	.	H	α-helix	trans	-62.2	-42.3	175.5	-74.5	-61.8	0	0	0	111.8	Q148 N149 K154 L155 L156	Q148-Y152 HydrophobicContact CB-CE2 4.34Å; Q148-Y152 WeakPolarHBondContact O-CD2 3.42Å; Q148-Y152 PolarHBondContact O-N 2.96Å; N149-Y152 PolarHBondContact O-N 3.01Å; Y152-K154 VanDerWaalsContact C-N 3.34Å; Y152-K154 PolarHBondContact O-N 2.95Å; Y152-L155 PolarHBondContact O-N 3.35Å; Y152-L156 WeakPolarHBondContact O-CB 3.46Å; Y152-L156 PolarHBondContact O-N 2.92Å
153	T	90.9	Very high	90.6	Very high	60 Å²	60	90.9 Å²	90.9	37%	0.368	44%	0.443	S	S	.	.	H	α-helix	trans	-61.1	-41.5	174.8	-55.4	0	0	0	0	111.7	N149 E150 K157	N149-T153 PolarHBondContact O-N 3.01Å; N149-T153 PolarHBondContact O-OG1 3.48Å; E150-T153 PolarHBondContact O-N 2.83Å; T153-K157 WeakPolarHBondContact O-CG 3.09Å; T153-K157 PolarHBondContact O-N 3.01Å; T153-K157 VanDerWaalsContact O-N 3.16Å
154	K	92.6	Very high	89.5	Confident	108 Å²	108	88.5 Å²	88.5	47%	0.47	43%	0.426	S	S	.	.	H	α-helix	trans	-64.9	-43.6	175	-74.5	170.1	-175.4	165.8	0	112	E150 R151 Y152 K157 I158	E150-K154 VanDerWaalsContact O-CG 3.31Å; E150-K154 WeakPolarHBondContact O-CG 3.43Å; E150-K154 PolarHBondContact O-N 3.21Å; E150-K154 WeakPolarHBondContact OE1-CE 3.16Å; E150-K154 IonicContact OE1-NZ 2.66Å; E150-K154 PolarHBondContact OE1-NZ 3.07Å; R151-K154 PolarHBondContact O-N 3.36Å; Y152-K154 VanDerWaalsContact C-N 3.34Å; Y152-K154 PolarHBondContact O-N 2.95Å; K154-K157 PolarHBondContact O-N 3.37Å; K154-I158 WeakPolarHBondContact O-CG1 3.43Å; K154-I158 PolarHBondContact O-N 3.41Å; K154-I158 VanDerWaalsContact O-N 3.08Å
155	L	92.1	Very high	88.7	Confident	82 Å²	82	88.5 Å²	88.5	43%	0.429	43%	0.432	S	S	.	.	H	α-helix	trans	-62.1	-44.1	178.3	-176.6	62.2	0	0	0	111.4	R151 Y152 K157 I158 Y159	R151-L155 WeakPolarHBondContact O-CB 3.39Å; R151-L155 PolarHBondContact O-N 3.28Å; Y152-L155 PolarHBondContact O-N 3.35Å; L155-K157 PolarHBondContact O-N 2.74Å; L155-I158 PolarHBondContact O-N 3.1Å; L155-Y159 HydrophobicContact CD1-CD2 3.85Å; L155-Y159 HydrophobicContact CD1-CE2 3.53Å; L155-Y159 HydrophobicContact CD2-CE2 4.12Å; L155-Y159 HydrophobicContact CG-CD2 3.77Å; L155-Y159 HydrophobicContact CG-CE2 3.66Å; L155-Y159 WeakPolarHBondContact O-CD2 3.46Å; L155-Y159 PolarHBondContact O-N 3.49Å
156	L	89.4	Confident	87.9	Confident	93 Å²	93	86.5 Å²	86.5	49%	0.487	42%	0.422	S	S	.	.	H	α-helix	trans	-59.7	-45	176.7	-174.7	67.8	0	0	0	111.5	Y152 I158 Y159 V160	Y152-L156 WeakPolarHBondContact O-CB 3.46Å; Y152-L156 PolarHBondContact O-N 2.92Å; L156-I158 PolarHBondContact O-N 3.01Å; L156-Y159 PolarHBondContact O-N 2.95Å; L156-V160 VanDerWaalsContact O-CG2 3.31Å; L156-V160 WeakPolarHBondContact O-CG2 3.47Å; L156-V160 PolarHBondContact O-N 3.46Å
157	K	88.7	Confident	86.5	Confident	109 Å²	109	87 Å²	87	47%	0.474	42%	0.418	S	S	.	.	H	α-helix	trans	-57.6	-47.2	175	-72.5	176.3	179.6	-174.7	0	111.9	T153 K154 L155 Y159 V160 D161	T153-K157 WeakPolarHBondContact O-CG 3.09Å; T153-K157 PolarHBondContact O-N 3.01Å; T153-K157 VanDerWaalsContact O-N 3.16Å; K154-K157 PolarHBondContact O-N 3.37Å; L155-K157 PolarHBondContact O-N 2.74Å; K157-Y159 PolarHBondContact O-N 3.19Å; K157-V160 PolarHBondContact O-N 2.94Å; K157-D161 PolarHBondContact O-N 3.19Å
158	I	89.6	Confident	84.7	Confident	107 Å²	107	91.3 Å²	91.3	55%	0.549	44%	0.436	S	S	.	.	H	α-helix	trans	-62.7	-41.4	178.1	-65.4	165.3	0	0	0	111.9	K154 L155 L156 V160 D161 Y162	K154-I158 WeakPolarHBondContact O-CG1 3.43Å; K154-I158 PolarHBondContact O-N 3.41Å; K154-I158 VanDerWaalsContact O-N 3.08Å; L155-I158 PolarHBondContact O-N 3.1Å; L156-I158 PolarHBondContact O-N 3.01Å; I158-V160 VanDerWaalsContact C-N 3.33Å; I158-V160 PolarHBondContact O-N 2.9Å; I158-D161 PolarHBondContact O-N 3.27Å; I158-Y162 WeakPolarHBondContact O-CB 3.39Å; I158-Y162 PolarHBondContact O-N 3.4Å
159	Y	88.9	Confident	82.9	Confident	140 Å²	140	92 Å²	92	55%	0.549	45%	0.448	S	S	.	.	H	α-helix	trans	-63.6	-39.5	177.5	-91.2	-70.2	0	0	0	112.1	L155 L156 K157 Y162 I163	L155-Y159 HydrophobicContact CD1-CD2 3.85Å; L155-Y159 HydrophobicContact CD1-CE2 3.53Å; L155-Y159 HydrophobicContact CD2-CE2 4.12Å; L155-Y159 HydrophobicContact CG-CD2 3.77Å; L155-Y159 HydrophobicContact CG-CE2 3.66Å; L155-Y159 WeakPolarHBondContact O-CD2 3.46Å; L155-Y159 PolarHBondContact O-N 3.49Å; L156-Y159 PolarHBondContact O-N 2.95Å; K157-Y159 PolarHBondContact O-N 3.19Å; Y159-Y162 PolarHBondContact O-N 3.33Å; Y159-I163 VanDerWaalsContact O-CG1 3.27Å; Y159-I163 WeakPolarHBondContact O-CG1 3.43Å; Y159-I163 PolarHBondContact O-N 3.07Å
160	V	86.4	Confident	81.1	Confident	14 Å²	14	92.8 Å²	92.8	9%	0.085	46%	0.455	C	S	.	.	H	α-helix	trans	-65.4	-48.6	176.2	172.4	0	0	0	0	110.1	L156 K157 I158 Y162 I163 E164 M302 I303 V306	L156-V160 VanDerWaalsContact O-CG2 3.31Å; L156-V160 WeakPolarHBondContact O-CG2 3.47Å; L156-V160 PolarHBondContact O-N 3.46Å; K157-V160 PolarHBondContact O-N 2.94Å; I158-V160 VanDerWaalsContact C-N 3.33Å; I158-V160 PolarHBondContact O-N 2.9Å; V160-Y162 PolarHBondContact O-N 2.98Å; V160-I163 PolarHBondContact O-N 3.22Å; V160-E164 WeakPolarHBondContact O-CG 3.48Å; V160-E164 PolarHBondContact O-N 2.85Å; V160-E164 VanDerWaalsContact O-N 3.09Å; V160-M302 HydrophobicContact CG1-CE 4.41Å; V160-I303 HydrophobicContact CG1-CG1 4.42Å; V160-V306 HydrophobicContact CG1-CG2 4.37Å; V160-V306 HydrophobicContact CG2-CG1 4.12Å; V160-V306 HydrophobicContact CG2-CG2 4.01Å
161	D	85.4	Confident	78.9	Confident	90 Å²	90	92.4 Å²	92.4	48%	0.481	46%	0.464	S	S	.	.	H	α-helix	trans	-56.7	-38.4	174.3	-64.9	-19.4	0	0	0	111.9	K157 I158 T165	K157-D161 PolarHBondContact O-N 3.19Å; I158-D161 PolarHBondContact O-N 3.27Å; D161-T165 WeakPolarHBondContact O-CB 3.22Å; D161-T165 VanDerWaalsContact O-CG2 3.3Å; D161-T165 WeakPolarHBondContact O-CG2 3.41Å; D161-T165 PolarHBondContact O-N 3.36Å; D161-T165 PolarHBondContact O-OG1 3.48Å
162	Y	85.9	Confident	76.6	Confident	143 Å²	143	92.8 Å²	92.8	56%	0.561	48%	0.476	S	S	*	.	H	α-helix	trans	-67.6	-46	177.4	176.1	-96.4	0	0	0	112.6	I158 Y159 V160 E164 T165 N166	I158-Y162 WeakPolarHBondContact O-CB 3.39Å; I158-Y162 PolarHBondContact O-N 3.4Å; Y159-Y162 PolarHBondContact O-N 3.33Å; V160-Y162 PolarHBondContact O-N 2.98Å; Y162-E164 PolarHBondContact O-N 3.47Å; Y162-T165 WeakPolarHBondContact CA-OG1 3.31Å; Y162-T165 PolarHBondContact O-N 3.26Å; Y162-T165 PolarHBondContact O-OG1 3.04Å; Y162-T165 VanDerWaalsContact O-OG1 3.04Å; Y162-N166 VanDerWaalsContact O-CB 3.27Å; Y162-N166 WeakPolarHBondContact O-CB 3.32Å; Y162-N166 PolarHBondContact O-N 3.2Å
163	I	82.5	Confident	74.3	Confident	69 Å²	69	93.4 Å²	93.4	35%	0.354	49%	0.489	S	S	.	.	H	α-helix	trans	-60.9	-37.4	179	-68.5	163.8	0	0	0	110	Y159 V160 N167 M302	Y159-I163 VanDerWaalsContact O-CG1 3.27Å; Y159-I163 WeakPolarHBondContact O-CG1 3.43Å; Y159-I163 PolarHBondContact O-N 3.07Å; V160-I163 PolarHBondContact O-N 3.22Å; I163-N167 VanDerWaalsContact O-CB 3.25Å; I163-N167 WeakPolarHBondContact O-CB 3.31Å; I163-N167 VanDerWaalsContact O-CG 3.27Å; I163-N167 PolarHBondContact O-N 2.9Å; I163-N167 PolarHBondContact O-ND2 3.49Å; I163-M302 HydrophobicContact CB-CE 3.96Å; I163-M302 HydrophobicContact CG2-CE 3.57Å; I163-M302 HydrophobicContact CG2-SD 4.21Å
164	E	70.3	Confident	71.8	Confident	15 Å²	15	98.1 Å²	98.1	7%	0.07	51%	0.512	C	S	.	.	H	α-helix	trans	-75.7	-43.3	-179.9	-68.9	178.3	164.2	0	0	112.9	V160 Y162 N166 N167 L168 M302 I303	V160-E164 WeakPolarHBondContact O-CG 3.48Å; V160-E164 PolarHBondContact O-N 2.85Å; V160-E164 VanDerWaalsContact O-N 3.09Å; Y162-E164 PolarHBondContact O-N 3.47Å; E164-N166 VanDerWaalsContact C-N 3.28Å; E164-N166 PolarHBondContact O-N 3.04Å; E164-N167 PolarHBondContact O-N 3.42Å; E164-L168 WeakPolarHBondContact O-CB 3.47Å; E164-L168 WeakPolarHBondContact O-CD1 3.39Å; E164-L168 PolarHBondContact O-N 2.85Å; E164-M302 HydrophobicContact CG-CE 3.53Å; E164-I303 VanDerWaalsContact CD-CG1 3.43Å; E164-I303 WeakPolarHBondContact OE1-CD1 3.47Å; E164-I303 WeakPolarHBondContact OE1-CG1 3.21Å; E164-I303 PolarHBondContact OE1-N 2.87Å; E164-I303 VanDerWaalsContact OE1-N 3.07Å; E164-I303 WeakPolarHBondContact OE2-CD1 3.38Å; E164-I303 WeakPolarHBondContact OE2-CG1 3.32Å
165	T	78.3	Confident	69.8	Low	92 Å²	92	98.9 Å²	98.9	56%	0.564	53%	0.525	S	S	*	.	H	α-helix	trans	-62.1	-37.3	173.8	50.1	0	0	0	0	111.8	D161 Y162 S169	D161-T165 WeakPolarHBondContact O-CB 3.22Å; D161-T165 VanDerWaalsContact O-CG2 3.3Å; D161-T165 WeakPolarHBondContact O-CG2 3.41Å; D161-T165 PolarHBondContact O-N 3.36Å; D161-T165 PolarHBondContact O-OG1 3.48Å; Y162-T165 WeakPolarHBondContact CA-OG1 3.31Å; Y162-T165 PolarHBondContact O-N 3.26Å; Y162-T165 PolarHBondContact O-OG1 3.04Å; Y162-T165 VanDerWaalsContact O-OG1 3.04Å; T165-S169 WeakPolarHBondContact O-CB 3.42Å; T165-S169 PolarHBondContact O-N 3.23Å; T165-S169 VanDerWaalsContact O-N 3.16Å; T165-S169 PolarHBondContact O-OG 3.43Å
166	N	74.8	Confident	67.4	Low	67 Å²	67	103 Å²	103	36%	0.358	54%	0.542	S	S	.	.	H	α-helix	trans	-68.4	-44.8	174	-166.2	42.3	0	0	0	111.3	Y162 E164 L168 S169 V170	Y162-N166 VanDerWaalsContact O-CB 3.27Å; Y162-N166 WeakPolarHBondContact O-CB 3.32Å; Y162-N166 PolarHBondContact O-N 3.2Å; E164-N166 VanDerWaalsContact C-N 3.28Å; E164-N166 PolarHBondContact O-N 3.04Å; N166-L168 PolarHBondContact O-N 3.46Å; N166-S169 WeakPolarHBondContact CA-OG 3.31Å; N166-S169 CarbonylContact O-C 3.6Å; N166-S169 PolarHBondContact O-N 2.89Å; N166-S169 PolarHBondContact O-OG 3.14Å; N166-V170 WeakPolarHBondContact O-CB 3.41Å; N166-V170 WeakPolarHBondContact O-CG2 3.45Å; N166-V170 PolarHBondContact O-N 3.42Å
167	N	63.2	Low	65.2	Low	85 Å²	85	104.1 Å²	104.1	46%	0.455	56%	0.558	S	S	.	*	H	α-helix	trans	-64.1	-36.2	176.6	-81.5	-15	0	0	0	113.2	I163 E164 S169	I163-N167 VanDerWaalsContact O-CB 3.25Å; I163-N167 WeakPolarHBondContact O-CB 3.31Å; I163-N167 VanDerWaalsContact O-CG 3.27Å; I163-N167 PolarHBondContact O-N 2.9Å; I163-N167 PolarHBondContact O-ND2 3.49Å; E164-N167 PolarHBondContact O-N 3.42Å; N167-S169 VanDerWaalsContact C-N 3.26Å; N167-S169 PolarHBondContact O-N 2.94Å
168	L	57.6	Low	62.8	Low	126 Å²	126	102.6 Å²	102.6	66%	0.66	57%	0.574	S	S	*	*	H	α-helix	trans	-67.7	-26	172.1	-92.6	85.7	0	0	0	112.5	E164 N166 S299	E164-L168 WeakPolarHBondContact O-CB 3.47Å; E164-L168 WeakPolarHBondContact O-CD1 3.39Å; E164-L168 PolarHBondContact O-N 2.85Å; N166-L168 PolarHBondContact O-N 3.46Å; L168-S299 VanDerWaalsContact CD1-OG 3.28Å; L168-S299 WeakPolarHBondContact CD1-OG 3.48Å
169	S	55	Low	60.3	Low	76 Å²	76	104.1 Å²	104.1	53%	0.531	59%	0.588	S	S	.	*	H	α-helix	trans	-89	-19.5	179.2	74.9	0	0	0	0	114.4	T165 N166 N167	T165-S169 WeakPolarHBondContact O-CB 3.42Å; T165-S169 PolarHBondContact O-N 3.23Å; T165-S169 VanDerWaalsContact O-N 3.16Å; T165-S169 PolarHBondContact O-OG 3.43Å; N166-S169 WeakPolarHBondContact CA-OG 3.31Å; N166-S169 CarbonylContact O-C 3.6Å; N166-S169 PolarHBondContact O-N 2.89Å; N166-S169 PolarHBondContact O-OG 3.14Å; N167-S169 VanDerWaalsContact C-N 3.26Å; N167-S169 PolarHBondContact O-N 2.94Å
170	V	53.6	Low	57.9	Low	92 Å²	92	104 Å²	104	56%	0.558	60%	0.602	S	S	*	*	H	α-helix	trans	-92.8	-3.4	-174	172.2	0	0	0	0	113.4	N166 N172	N166-V170 WeakPolarHBondContact O-CB 3.41Å; N166-V170 WeakPolarHBondContact O-CG2 3.45Å; N166-V170 PolarHBondContact O-N 3.42Å; V170-N172 PolarHBondContact O-N 2.87Å
171	S	47.1	Very low	55.4	Low	100 Å²	100	108.2 Å²	108.2	70%	0.699	63%	0.631	S	S	*	*	S	Bend	trans	-69.5	3.9	174.8	-175.9	0	0	0	0	115.1
172	N	44.1	Very low	53	Low	129 Å²	129	109.6 Å²	109.6	69%	0.69	64%	0.642	S	S	*	*	S	Bend	trans	-136.2	92.7	172.2	-66.8	-56.2	0	0	0	108.5	V170	V170-N172 PolarHBondContact O-N 2.87Å
173	N	43.3	Very low	50.7	Low	164 Å²	164	108.6 Å²	108.6	88%	0.877	66%	0.656	S	S	*	*			trans	168.8	97.8	146.4	-79.5	-31.8	0	0	0	108.9
174	D	39.7	Very low	48.2	Very low	159 Å²	159	110.9 Å²	110.9	85%	0.85	68%	0.677	S	S	*	*			trans	-62.8	154.9	160	-67.4	-53.6	0	0	0	110.3
175	V	50.6	Low	46.5	Very low	124 Å²	124	117.3 Å²	117.3	75%	0.752	71%	0.707	S	S	*	*			trans	119.6	101.9	159.7	-174.7	0	0	0	0	115.3
176	E	41.7	Very low	44.3	Very low	168 Å²	168	119.8 Å²	119.8	79%	0.785	71%	0.71	S	S	*	*			trans	67.1	116.1	140.6	-76.7	-180	126.3	0	0	122.4
177	S	43.3	Very low	42.6	Very low	117 Å²	117	124.2 Å²	124.2	82%	0.818	73%	0.733	S	S	*	*				82.8	120.3	124.5	-68.1	0	0	0	0	119.1
178	G	38.7	Very low	41.2	Very low	78 Å²	78	126.4 Å²	126.4	80%	0.804	75%	0.75	S	S	*	*			trans	143	66	144.2	0	0	0	0	0	117
179	T	36	Very low	40	Very low	139 Å²	139	129.8 Å²	129.8	85%	0.853	76%	0.759	S	S	*	*			trans	-46.5	130.8	153.6	-45.4	0	0	0	0	111
180	V	38.2	Very low	39	Very low	138 Å²	138	130.4 Å²	130.4	84%	0.836	76%	0.764	S	S	*	*			trans	-171	115	132.1	166.6	0	0	0	0	111.2
181	C	33.5	Very low	38.3	Very low	102 Å²	102	133 Å²	133	69%	0.689	78%	0.775	S	S	*	*			trans	-10.7	137.2	147.8	-145.6	0	0	0	0	121
182	V	34.9	Very low	37.5	Very low	119 Å²	119	136.5 Å²	136.5	72%	0.721	78%	0.78	S	S	*	*			trans	40.5	119.6	133.2	-177.9	0	0	0	0	118.9
183	S	37.7	Very low	37.2	Very low	122 Å²	122	135.6 Å²	135.6	85%	0.853	78%	0.781	S	S	*	*			trans	-152.9	104.1	143.9	-71.3	0	0	0	0	110
184	C	31	Very low	36.5	Very low	116 Å²	116	132.9 Å²	132.9	78%	0.784	77%	0.77	S	S	*	*			trans	-61.4	135.7	149.6	-63.2	0	0	0	0	107.5
185	E	34.1	Very low	36.3	Very low	151 Å²	151	132 Å²	132	71%	0.706	77%	0.765	S	S	*	*			trans	-176.3	128.6	140.2	-103.1	-174.1	173.1	0	0	112
186	K	33.1	Very low	35.3	Very low	144 Å²	144	135 Å²	135	63%	0.626	77%	0.768	S	S	*	*			trans	64.4	118.2	138.9	-63.6	166.8	-172.5	152.7	0	118.5
187	D	37.5	Very low	34.8	Very low	159 Å²	159	132.2 Å²	132.2	85%	0.85	77%	0.767	S	S	*	*				-167.5	103	98.1	-88.7	-31.1	0	0	0	112.4
188	T	33.6	Very low	34.2	Very low	132 Å²	132	132.4 Å²	132.4	81%	0.81	76%	0.763	S	S	*	*			trans	-74	113.4	153.3	33.1	0	0	0	0	108.6
189	K	32.6	Very low	34.1	Very low	196 Å²	196	132.4 Å²	132.4	85%	0.852	76%	0.756	S	S	*	*			trans	-176.8	138.3	139.5	-108.2	159.9	-176.5	172.2	0	113.6
190	S	34.2	Very low	34.1	Very low	90 Å²	90	133.2 Å²	133.2	63%	0.629	76%	0.755	S	S	*	*			trans	84.4	104.1	141.7	80	0	0	0	0	116.4
191	N	39.3	Very low	34.2	Very low	147 Å²	147	131.1 Å²	131.1	79%	0.786	75%	0.746	S	S	*	*				162.9	107.7	94.1	-76.1	-47.6	0	0	0	110
192	E	31.2	Very low	34.4	Very low	173 Å²	173	133.2 Å²	133.2	81%	0.808	75%	0.751	S	S	*	*			trans	-106.3	137.9	142.7	-148.4	-167.9	173.3	0	0	105.6
193	P	36.9	Very low	34.5	Very low	109 Å²	109	132.3 Å²	132.3	71%	0.708	75%	0.75	S	S	*	*				-145.2	140.5	103.9	33.8	-16.9	0	0	0	114.2
194	V	28.9	Very low	34.7	Very low	108 Å²	108	133.6 Å²	133.6	66%	0.655	75%	0.745	S	S	*	*				19.6	121	129.5	-168.6	0	0	0	0	116.3
195	L	35.1	Very low	35.1	Very low	140 Å²	140	134.5 Å²	134.5	73%	0.733	74%	0.742	S	S	*	*				168.2	115	123.6	-87.3	167.5	0	0	0	112
196	K	29.3	Very low	35.3	Very low	187 Å²	187	133 Å²	133	81%	0.813	74%	0.739	S	S	*	*			trans	44.9	123.1	131.2	-61.7	-177.8	-175.6	177.6	0	120
197	S	31.7	Very low	35.6	Very low	110 Å²	110	133.5 Å²	133.5	77%	0.769	75%	0.749	S	S	*	*				120.4	131.7	116.1	-148.2	0	0	0	0	116.9
198	T	31.4	Very low	35.5	Very low	121 Å²	121	131.6 Å²	131.6	74%	0.742	75%	0.745	S	S	*	*			trans	105.2	92.3	137.2	-41	0	0	0	0	118.9
199	A	36.2	Very low	35.8	Very low	78 Å²	78	131.1 Å²	131.1	65%	0.645	75%	0.747	S	S	*	*				91.2	145.9	111.1	0	0	0	0	0	123.5
200	N	36.1	Very low	36	Very low	155 Å²	155	130.5 Å²	130.5	83%	0.829	75%	0.747	S	S	*	*			trans	92	129.5	159.2	-62.7	-3.3	0	0	0	116.2
201	S	40.2	Very low	36	Very low	95 Å²	95	133.9 Å²	133.9	66%	0.664	76%	0.757	S	S	*	*			cis	-174.7	160.4	10	42.4	0	0	0	0	112.1
202	N	38.2	Very low	35.5	Very low	146 Å²	146	131.9 Å²	131.9	78%	0.781	75%	0.754	S	S	*	*			trans	106.1	89.9	159	-56.1	-14.2	0	0	0	116
203	S	35.5	Very low	35.7	Very low	100 Å²	100	129.8 Å²	129.8	70%	0.699	75%	0.753	S	S	*	*				72	115.1	81.5	87.7	0	0	0	0	113.5
204	I	42.3	Very low	35.6	Very low	149 Å²	149	132.9 Å²	132.9	76%	0.764	76%	0.758	S	S	*	*				-175.9	117.1	77.9	-81	149.9	0	0	0	106.3
205	N	39.6	Very low	35.9	Very low	135 Å²	135	133.3 Å²	133.3	72%	0.722	77%	0.766	S	S	*	*				51	134.4	101	-91	33.4	0	0	0	115
206	D	39.5	Very low	35.8	Very low	118 Å²	118	129.9 Å²	129.9	63%	0.631	76%	0.764	S	S	*	*			cis	-160.9	138.6	18.6	-70.7	-53.6	0	0	0	107
207	N	38.1	Very low	35.9	Very low	156 Å²	156	127.4 Å²	127.4	83%	0.834	77%	0.769	S	S	*	*				167.2	135.3	83.6	-90.4	-50.1	0	0	0	109.6
208	P	36	Very low	35.7	Very low	119 Å²	119	129.8 Å²	129.8	77%	0.773	77%	0.771	S	S	*	*			trans	-122.4	147.2	173.8	37.2	-24	0	0	0	115
209	S	40.4	Very low	35.9	Very low	121 Å²	121	132.3 Å²	132.3	85%	0.846	78%	0.779	S	S	*	*			trans	-154.6	90.9	162.1	-63.3	0	0	0	0	108.2
210	Q	35	Very low	35.4	Very low	183 Å²	183	134.7 Å²	134.7	86%	0.855	78%	0.781	S	S	*	*				59.2	115.7	94.5	-71.6	-161.2	-0.2	0	0	116.9
211	I	34.2	Very low	35.4	Very low	162 Å²	162	133.1 Å²	133.1	83%	0.831	78%	0.782	S	S	*	*				169.3	101.1	129.1	-79.9	152.6	0	0	0	106.1
212	S	30.1	Very low	34.9	Very low	105 Å²	105	135.7 Å²	135.7	73%	0.734	79%	0.788	S	S	*	*				62.1	128.7	83.8	-136.6	0	0	0	0	111.9
213	V	35.1	Very low	34.8	Very low	129 Å²	129	133.3 Å²	133.3	78%	0.782	78%	0.783	S	S	*	*			cis	-166.9	147.2	30.1	-141.3	0	0	0	0	104.2
214	E	34.8	Very low	34.9	Very low	174 Å²	174	136 Å²	136	81%	0.813	79%	0.785	S	S	*	*				179.7	124.6	73.2	-170.7	166	-164.8	0	0	111.5
215	S	35.4	Very low	34.4	Very low	117 Å²	117	135.1 Å²	135.1	82%	0.818	78%	0.782	S	S	*	*			trans	25.2	138.8	141.8	-52	0	0	0	0	122.2
216	G	32.7	Very low	34.2	Very low	67 Å²	67	136.8 Å²	136.8	69%	0.691	79%	0.785	S	S	*	*			cis	170.1	174.1	3.6	0	0	0	0	0	114.3
217	C	31.4	Very low	34.1	Very low	136 Å²	136	137.9 Å²	137.9	92%	0.919	79%	0.791	S	S	*	*			trans	85.2	85.2	153.7	-37.1	0	0	0	0	119.7
218	I	26.6	Very low	33.7	Very low	159 Å²	159	139 Å²	139	82%	0.815	80%	0.795	S	S	*	*			trans	-70.2	128.6	147.8	-63.6	167.9	0	0	0	108.6
219	L	35.9	Very low	33.7	Very low	175 Å²	175	138 Å²	138	92%	0.916	79%	0.791	S	S	*	*			trans	-143.2	122	146.7	-85.5	-179.7	0	0	0	111.1
220	N	26.9	Very low	33.3	Very low	128 Å²	128	138.7 Å²	138.7	68%	0.684	79%	0.79	S	S	*	*			trans	-74	139.6	177.1	-166.1	32.5	0	0	0	110.7
221	S	36.3	Very low	33.3	Very low	122 Å²	122	136.7 Å²	136.7	85%	0.853	79%	0.79	S	S	*	*			trans	-173.9	113.6	148.2	-76.9	0	0	0	0	111.3
222	N	29.5	Very low	33.3	Very low	148 Å²	148	131.7 Å²	131.7	79%	0.791	78%	0.779	S	S	*	*			trans	-49.8	143.3	173.4	-55.9	-26	0	0	0	113.9
223	S	35.5	Very low	33.7	Very low	97 Å²	97	135 Å²	135	68%	0.678	79%	0.786	S	S	*	*				159.7	125.9	114.9	-167.5	0	0	0	0	111.7
224	E	36.4	Very low	33.5	Very low	156 Å²	156	134.5 Å²	134.5	73%	0.729	78%	0.779	S	S	*	*			trans	77.9	101.5	149.2	-76.2	171.6	174.3	0	0	120.8
225	N	33.2	Very low	33.6	Very low	131 Å²	131	134.5 Å²	134.5	70%	0.701	78%	0.784	S	S	*	*				88.3	128.5	128.4	-55.6	-30.2	0	0	0	119.9
226	H	35.3	Very low	33.4	Very low	169 Å²	169	134.2 Å²	134.2	78%	0.782	78%	0.777	S	S	*	*			trans	89.5	122.1	160.1	-68.7	-68.6	0	0	0	119.7
227	D	37.6	Very low	33.7	Very low	141 Å²	141	140.3 Å²	140.3	75%	0.754	79%	0.788	S	S	*	*			trans	78.3	92.4	149.2	-51	-16.9	0	0	0	118.5	S229	D227-S229 VanDerWaalsContact C-N 3.34Å; D227-S229 PolarHBondContact O-N 3.4Å
228	I	30.4	Very low	33.7	Very low	181 Å²	181	139.7 Å²	139.7	93%	0.928	79%	0.785	S	S	*	*			trans	-70.5	91.7	160.9	-66.3	170.2	0	0	0	107.5
229	S	34.9	Very low	34.1	Very low	98 Å²	98	135.6 Å²	135.6	69%	0.685	78%	0.782	S	S	*	*			trans	-105	122.5	160.1	179	0	0	0	0	108.6	D227 V231	D227-S229 VanDerWaalsContact C-N 3.34Å; D227-S229 PolarHBondContact O-N 3.4Å; S229-V231 PolarHBondContact O-N 2.85Å
230	T	32.4	Very low	34	Very low	135 Å²	135	134 Å²	134	83%	0.828	78%	0.782	S	S	*	*			trans	-36.5	110.6	167.1	-55.2	0	0	0	0	113.1
231	V	34.7	Very low	34.3	Very low	140 Å²	140	131.4 Å²	131.4	85%	0.848	79%	0.786	S	S	*	*			trans	-105.4	119	160.9	-178.9	0	0	0	0	105.2	S229	S229-V231 PolarHBondContact O-N 2.85Å
232	G	33.3	Very low	34.4	Very low	58 Å²	58	132.4 Å²	132.4	60%	0.598	79%	0.786	S	S	*	*			cis	109	83.7	35.5	0	0	0	0	0	107.2	D234	G232-D234 PolarHBondContact O-N 3.37Å
233	I	39.8	Very low	34.4	Very low	175 Å²	175	132.5 Å²	132.5	90%	0.897	79%	0.787	S	S	*	*			trans	-77.8	113	169.7	-62.2	174.2	0	0	0	106.8
234	D	29.9	Very low	34.2	Very low	118 Å²	118	133.9 Å²	133.9	63%	0.631	79%	0.791	S	S	*	*			trans	-72.3	122	177.2	-163.1	-5.1	0	0	0	110.1	G232 T236	G232-D234 PolarHBondContact O-N 3.37Å; D234-T236 WeakPolarHBondContact OD1-CG2 3.3Å; D234-T236 PolarHBondContact OD1-N 2.82Å; D234-T236 VanDerWaalsContact OD1-N 3.13Å; D234-T236 PolarHBondContact OD1-OG1 3.09Å
235	L	38.3	Very low	33.8	Very low	174 Å²	174	136.1 Å²	136.1	91%	0.911	80%	0.799	S	S	*	*			trans	-135.3	71.4	154.2	-159.1	71.9	0	0	0	108.8	Q237	L235-Q237 PolarHBondContact O-N 2.9Å
236	T	31	Very low	33.6	Very low	111 Å²	111	138.8 Å²	138.8	68%	0.681	81%	0.806	S	S	*	*			trans	-75.7	105.5	161	44.2	0	0	0	0	109.9	D234	D234-T236 WeakPolarHBondContact OD1-CG2 3.3Å; D234-T236 PolarHBondContact OD1-N 2.82Å; D234-T236 VanDerWaalsContact OD1-N 3.13Å; D234-T236 PolarHBondContact OD1-OG1 3.09Å
237	Q	38.1	Very low	33.4	Very low	194 Å²	194	135.9 Å²	135.9	91%	0.907	81%	0.805	S	S	*	*			trans	-152.7	129.8	140.9	-120.6	172.7	58.2	0	0	112.8	L235	L235-Q237 PolarHBondContact O-N 2.9Å
238	S	31.9	Very low	33.4	Very low	123 Å²	123	136.6 Å²	136.6	86%	0.86	81%	0.808	S	S	*	*			trans	-76	149.4	-168.2	58.5	0	0	0	0	115
239	G	34.6	Very low	33.5	Very low	73 Å²	73	135.7 Å²	135.7	75%	0.753	81%	0.805	S	S	*	*			trans	170.1	114.8	157.7	0	0	0	0	0	113.4
240	P	33.9	Very low	33.4	Very low	143 Å²	143	135.6 Å²	135.6	93%	0.929	81%	0.805	S	S	*	*			trans	-95.2	144.6	-161.2	36.2	-32.7	0	0	0	113.8
241	G	33.1	Very low	33.5	Very low	73 Å²	73	134.7 Å²	134.7	75%	0.753	80%	0.804	S	S	*	*			trans	177	97.2	169.6	0	0	0	0	0	117.3
242	V	39	Very low	33.5	Very low	143 Å²	143	136 Å²	136	87%	0.867	81%	0.805	S	S	*	*			trans	83.1	90.6	149.4	-160.6	0	0	0	0	119.1
243	N	29.9	Very low	33.6	Very low	150 Å²	150	142.4 Å²	142.4	80%	0.802	82%	0.816	S	S	*	*			trans	-17.1	138.3	144.8	-48.8	-22.5	0	0	0	116.9
244	V	30.6	Very low	33.2	Very low	126 Å²	126	138.8 Å²	138.8	76%	0.764	81%	0.807	S	S	*	*				-170.5	106.7	110.3	173	0	0	0	0	107.2
245	F	27.2	Very low	33.5	Very low	203 Å²	203	140.1 Å²	140.1	89%	0.89	81%	0.814	S	S	*	*			trans	-167.1	96.2	144.4	-99	-69.8	0	0	0	109.1
246	H	30.7	Very low	33.5	Very low	186 Å²	186	138.1 Å²	138.1	86%	0.861	80%	0.804	S	S	*	*			trans	-148.4	105.4	159.7	-111.6	-74.1	0	0	0	107.8
247	S	30.9	Very low	34.2	Very low	108 Å²	108	143.7 Å²	143.7	76%	0.755	81%	0.812	S	S	*	*			trans	156.5	101.8	147.6	-82.2	0	0	0	0	109.6
248	L	36.3	Very low	34.9	Very low	157 Å²	157	137.8 Å²	137.8	82%	0.822	79%	0.79	S	S	*	*				179.9	89.8	104.5	-110.1	120.3	0	0	0	108.5	S250	L248-S250 PolarHBondContact O-N 3.48Å
249	D	33.4	Very low	35.5	Very low	161 Å²	161	134.8 Å²	134.8	86%	0.861	77%	0.772	S	S	*	*			trans	-77	101.7	159	-168.4	14.9	0	0	0	106.7
250	S	33.1	Very low	36.4	Very low	97 Å²	97	134.6 Å²	134.6	68%	0.678	76%	0.759	S	S	*	*			trans	160.6	81.5	171.3	159.2	0	0	0	0	109.3	L248	L248-S250 PolarHBondContact O-N 3.48Å
251	S	34.5	Very low	37	Very low	116 Å²	116	134.7 Å²	134.7	81%	0.811	75%	0.745	S	S	*	*			trans	171.9	60.3	141.9	-165.6	0	0	0	0	109.1	K253	S251-K253 PolarHBondContact O-N 2.98Å
252	L	34.4	Very low	38.3	Very low	166 Å²	166	137.4 Å²	137.4	87%	0.869	74%	0.741	S	S	*	*			trans	-78.2	102	164.5	-70.6	166.5	0	0	0	107.2
253	K	34.6	Very low	39.2	Very low	194 Å²	194	135.6 Å²	135.6	84%	0.843	73%	0.727	S	S	*	*			trans	-148	121.9	161.1	-118.1	165.2	-173.6	175.3	0	111.6	S251	S251-K253 PolarHBondContact O-N 2.98Å
254	S	32.4	Very low	40.6	Very low	99 Å²	99	131.9 Å²	131.9	69%	0.692	71%	0.706	S	S	*	*	S	Bend	trans	86.5	120.5	161.6	85.7	0	0	0	0	116.4
255	N	35.9	Very low	41.9	Very low	146 Å²	146	131.9 Å²	131.9	78%	0.781	69%	0.693	S	S	*	*			trans	103.1	55.4	150.4	-42.1	-17.8	0	0	0	116.1
256	N	37.2	Very low	43.4	Very low	131 Å²	131	128.4 Å²	128.4	70%	0.701	68%	0.684	S	S	*	*			trans	-121.9	82.9	160.3	-110	-0.8	0	0	0	110.6	T258	N256-T258 PolarHBondContact O-N 2.86Å; N256-T258 PolarHBondContact OD1-OG1 2.85Å
257	R	46.3	Very low	44.8	Very low	229 Å²	229	124.3 Å²	124.3	86%	0.864	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	0.6	167.9	-150.1	176.3	-175.8	177.3	0	112.1
258	T	53.3	Low	46.2	Very low	70 Å²	70	123 Å²	123	43%	0.429	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.1	-14.6	-175.2	48.1	0	0	0	0	113.6	N256 S260	N256-T258 PolarHBondContact O-N 2.86Å; N256-T258 PolarHBondContact OD1-OG1 2.85Å; T258-S260 VanDerWaalsContact C-N 3.29Å
259	A	44.3	Very low	47.4	Very low	59 Å²	59	119.6 Å²	119.6	49%	0.488	64%	0.637	S	S	.	*	G	3₁₀ helix	trans	-74.4	-21.8	172.9	0	0	0	0	0	112.3	F261	A259-F261 VanDerWaalsContact C-N 3.3Å; A259-F261 PolarHBondContact O-N 3.13Å
260	S	53	Low	48.5	Very low	69 Å²	69	117.2 Å²	117.2	48%	0.483	63%	0.625	S	S	.	*	G	3₁₀ helix	trans	-73.5	-13.3	179.6	177.9	0	0	0	0	114.5	T258 I264	T258-S260 VanDerWaalsContact C-N 3.29Å; S260-I264 WeakPolarHBondContact O-CD1 3.15Å; S260-I264 WeakPolarHBondContact O-CG1 3.45Å
261	F	47.3	Very low	49.8	Very low	145 Å²	145	120.6 Å²	120.6	64%	0.636	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-92.9	-21.4	-174.5	-89.5	-86.2	0	0	0	113.9	A259	A259-F261 VanDerWaalsContact C-N 3.3Å; A259-F261 PolarHBondContact O-N 3.13Å
262	I	59.1	Low	50.9	Low	131 Å²	131	121.4 Å²	121.4	67%	0.672	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-38	178.5	-128	78.5	0	0	0	110.4	I264 Y265	I262-I264 PolarHBondContact O-N 3.04Å; I262-Y265 PolarHBondContact O-N 3.48Å
263	D	58	Low	52.1	Low	104 Å²	104	117.6 Å²	117.6	56%	0.556	60%	0.599	S	S	*	*	H	α-helix	trans	-69.6	-22.4	177.5	-61.9	-19.4	0	0	0	112.5	Y265	D263-Y265 VanDerWaalsContact C-N 3.35Å
264	I	60.2	Low	53.2	Low	72 Å²	72	111.1 Å²	111.1	37%	0.369	58%	0.581	S	S	.	*	H	α-helix	trans	-74.7	-26.9	177.1	-69	168.6	0	0	0	111.3	S260 I262 I268	S260-I264 WeakPolarHBondContact O-CD1 3.15Å; S260-I264 WeakPolarHBondContact O-CG1 3.45Å; I262-I264 PolarHBondContact O-N 3.04Å; I264-I268 HydrophobicContact CG2-CD1 3.59Å; I264-I268 HydrophobicContact CG2-CG1 4.28Å; I264-I268 VanDerWaalsContact O-CD1 3.26Å; I264-I268 WeakPolarHBondContact O-CD1 3.3Å; I264-I268 WeakPolarHBondContact O-CG1 3.44Å; I264-I268 PolarHBondContact O-N 3.07Å; I264-I268 VanDerWaalsContact O-N 3.17Å
265	Y	57.2	Low	54.2	Low	127 Å²	127	112.8 Å²	112.8	50%	0.498	58%	0.582	S	S	.	*	H	α-helix	trans	-76.3	-35.3	-179.4	-106.7	-88.7	0	0	0	112.6	I262 D263 I268 V269	I262-Y265 PolarHBondContact O-N 3.48Å; D263-Y265 VanDerWaalsContact C-N 3.35Å; Y265-I268 PolarHBondContact O-N 3.21Å; Y265-V269 WeakPolarHBondContact O-CG2 3.39Å; Y265-V269 PolarHBondContact O-N 3.36Å
266	D	59.4	Low	55.1	Low	129 Å²	129	114.3 Å²	114.3	69%	0.69	58%	0.584	S	S	*	*	H	α-helix	trans	-66	-38.5	172.7	-97.6	-4.8	0	0	0	111.1	I268	D266-I268 PolarHBondContact O-N 2.86Å
267	D	59	Low	55.4	Low	100 Å²	100	112.6 Å²	112.6	54%	0.535	58%	0.583	S	S	.	*	H	α-helix	trans	-67.3	-33.5	176	-80.5	-13.3	0	0	0	112.6	D270 Y271	D267-D270 PolarHBondContact O-N 3.47Å; D267-Y271 WeakPolarHBondContact O-CD2 3.13Å; D267-Y271 PolarHBondContact O-N 3.12Å
268	I	61.4	Low	55.2	Low	81 Å²	81	106.6 Å²	106.6	42%	0.415	57%	0.571	S	S	.	*	H	α-helix	trans	-71	-33.4	-176.7	-72	163.3	0	0	0	112.6	I264 Y265 D266 D270 Y271 E272	I264-I268 HydrophobicContact CG2-CD1 3.59Å; I264-I268 HydrophobicContact CG2-CG1 4.28Å; I264-I268 VanDerWaalsContact O-CD1 3.26Å; I264-I268 WeakPolarHBondContact O-CD1 3.3Å; I264-I268 WeakPolarHBondContact O-CG1 3.44Å; I264-I268 PolarHBondContact O-N 3.07Å; I264-I268 VanDerWaalsContact O-N 3.17Å; Y265-I268 PolarHBondContact O-N 3.21Å; D266-I268 PolarHBondContact O-N 2.86Å; I268-D270 VanDerWaalsContact C-N 3.31Å; I268-D270 PolarHBondContact O-N 3.04Å; I268-Y271 PolarHBondContact O-N 3.42Å; I268-E272 PolarHBondContact O-N 3.43Å
269	V	60.4	Low	54.4	Low	85 Å²	85	108.9 Å²	108.9	52%	0.515	59%	0.587	S	S	.	*	H	α-helix	trans	-70.8	-30.2	179.2	-177.1	0	0	0	0	111.4	Y265 T273	Y265-V269 WeakPolarHBondContact O-CG2 3.39Å; Y265-V269 PolarHBondContact O-N 3.36Å; V269-T273 PolarHBondContact O-N 2.86Å; V269-T273 PolarHBondContact O-OG1 3.32Å
270	D	57.6	Low	54.1	Low	112 Å²	112	112.6 Å²	112.6	60%	0.599	60%	0.604	S	S	*	*	H	α-helix	trans	-74.2	-28.6	172.8	-76.2	-10.8	0	0	0	112.6	D267 I268 T273 A274	D267-D270 PolarHBondContact O-N 3.47Å; I268-D270 VanDerWaalsContact C-N 3.31Å; I268-D270 PolarHBondContact O-N 3.04Å; D270-T273 PolarHBondContact O-OG1 3.43Å; D270-A274 WeakPolarHBondContact O-CB 3.48Å; D270-A274 PolarHBondContact O-N 2.9Å
271	Y	59.2	Low	53.5	Low	167 Å²	167	117.8 Å²	117.8	66%	0.655	62%	0.622	S	S	*	*	H	α-helix	trans	-75	-33.3	175.3	-87.7	-75.4	0	0	0	113.6	D267 I268 L275	D267-Y271 WeakPolarHBondContact O-CD2 3.13Å; D267-Y271 PolarHBondContact O-N 3.12Å; I268-Y271 PolarHBondContact O-N 3.42Å; Y271-L275 WeakPolarHBondContact O-CG 3.49Å; Y271-L275 PolarHBondContact O-N 2.98Å
272	E	58.9	Low	52.9	Low	133 Å²	133	114 Å²	114	62%	0.621	63%	0.625	S	S	*	*	H	α-helix	trans	-72.8	-38.3	177.6	-95.5	-177.7	159	0	0	112.3	I268 A274 L275	I268-E272 PolarHBondContact O-N 3.43Å; E272-A274 VanDerWaalsContact C-N 3.34Å; E272-A274 PolarHBondContact O-N 2.86Å; E272-L275 PolarHBondContact O-N 3.48Å
273	T	59	Low	52.1	Low	87 Å²	87	114.7 Å²	114.7	53%	0.534	64%	0.635	S	S	.	*	H	α-helix	trans	-71.8	-25.9	177	44.6	0	0	0	0	113.3	V269 D270	V269-T273 PolarHBondContact O-N 2.86Å; V269-T273 PolarHBondContact O-OG1 3.32Å; D270-T273 PolarHBondContact O-OG1 3.43Å
274	A	57.2	Low	51.2	Low	57 Å²	57	113.1 Å²	113.1	47%	0.471	64%	0.644	S	S	.	*	H	α-helix	trans	-77.3	-25.2	176.5	0	0	0	0	0	114.1	D270 E272	D270-A274 WeakPolarHBondContact O-CB 3.48Å; D270-A274 PolarHBondContact O-N 2.9Å; E272-A274 VanDerWaalsContact C-N 3.34Å; E272-A274 PolarHBondContact O-N 2.86Å
275	L	55.2	Low	50.2	Low	135 Å²	135	116.7 Å²	116.7	71%	0.707	66%	0.663	S	S	*	*	H	α-helix	trans	-85.7	-18.5	-177.8	-71.7	171.9	0	0	0	114	Y271 E272	Y271-L275 WeakPolarHBondContact O-CG 3.49Å; Y271-L275 PolarHBondContact O-N 2.98Å; E272-L275 PolarHBondContact O-N 3.48Å
276	E	53.7	Low	49.7	Very low	178 Å²	178	116.8 Å²	116.8	83%	0.832	67%	0.673	S	S	*	*	S	Bend	trans	-88	-1.1	176.1	-77.5	-176.2	152.4	0	0	114.1
277	S	43.8	Very low	49.4	Very low	95 Å²	95	116.1 Å²	116.1	66%	0.664	67%	0.673	S	S	*	*	S	Bend	trans	-120.1	10.4	-170.8	-59.3	0	0	0	0	116.6
278	T	41.7	Very low	48.9	Very low	102 Å²	102	119.8 Å²	119.8	63%	0.626	69%	0.687	S	S	*	*			trans	-110.8	113.6	-174.8	21.3	0	0	0	0	114.3	V280	T278-V280 PolarHBondContact O-N 3.47Å
279	P	36.5	Very low	48.1	Very low	118 Å²	118	124.7 Å²	124.7	77%	0.766	71%	0.708	S	S	*	*			trans	-80.5	113.1	163.3	31.9	-26.8	0	0	0	108.4	M281	P279-M281 PolarHBondContact O-N 3.4Å; P279-M281 VanDerWaalsContact O-N 3.11Å
280	V	39	Very low	47.1	Very low	137 Å²	137	128.7 Å²	128.7	83%	0.83	73%	0.725	S	S	*	*			trans	-73.3	102.7	178.1	177.6	0	0	0	0	109.6	T278	T278-V280 PolarHBondContact O-N 3.47Å
281	M	39.5	Very low	46.5	Very low	178 Å²	178	131.4 Å²	131.4	88%	0.877	73%	0.734	S	S	*	*			trans	-90.8	130.8	160.5	-74	-68	-69.8	0	0	108.8	P279	P279-M281 PolarHBondContact O-N 3.4Å; P279-M281 VanDerWaalsContact O-N 3.11Å
282	G	34	Very low	45.9	Very low	67 Å²	67	128.9 Å²	128.9	69%	0.691	74%	0.74	S	S	*	*			trans	-83.5	178.8	-163.7	0	0	0	0	0	118
283	T	42.9	Very low	45.2	Very low	145 Å²	145	130.4 Å²	130.4	89%	0.89	75%	0.752	S	S	*	*			trans	-163.5	115.3	154.6	-27	0	0	0	0	106
284	G	39	Very low	44.6	Very low	71 Å²	71	133 Å²	133	73%	0.732	76%	0.763	S	S	*	*				67	117.8	108	0	0	0	0	0	111.6
285	D	40.5	Very low	43.8	Very low	146 Å²	146	136.3 Å²	136.3	78%	0.781	78%	0.777	S	S	*	*			cis	-174	156.5	49.4	-132.7	-9.5	0	0	0	109.7
286	D	45	Very low	43.4	Very low	130 Å²	130	135.1 Å²	135.1	70%	0.695	78%	0.778	S	S	*	*			trans	83.7	104.7	143.6	-68.7	-24.1	0	0	0	124.5
287	V	53.4	Low	43	Very low	115 Å²	115	133.2 Å²	133.2	70%	0.697	77%	0.769	S	S	*	*				104.7	100	121.5	179.9	0	0	0	0	118.4
288	E	48.7	Very low	43.5	Very low	177 Å²	177	134.9 Å²	134.9	83%	0.827	78%	0.778	S	S	*	*			trans	58.7	114.8	133.8	-58.9	-168.4	-162.2	0	0	120.3
289	E	45.1	Very low	44.2	Very low	184 Å²	184	131 Å²	131	86%	0.86	76%	0.755	S	S	*	*				-169	106.7	102.4	-151.9	160.2	-166.9	0	0	108.9
290	I	39.9	Very low	45.2	Very low	168 Å²	168	128.9 Å²	128.9	86%	0.862	74%	0.74	S	S	*	*			trans	-89.5	107.6	178.5	-64.8	170.6	0	0	0	107.2
291	E	45.3	Very low	46.5	Very low	170 Å²	170	124.3 Å²	124.3	79%	0.794	72%	0.721	S	S	*	*			trans	-124.4	124.6	171.2	-140.2	177.4	-164	0	0	110.8
292	S	45.5	Very low	48	Very low	113 Å²	113	118.7 Å²	118.7	79%	0.79	69%	0.693	S	S	*	*			trans	70.4	78.3	165.9	65	0	0	0	0	118.8	D294	S292-D294 PolarHBondContact O-N 3.36Å
293	L	43.4	Very low	49.8	Very low	165 Å²	165	118.3 Å²	118.3	86%	0.864	67%	0.674	S	S	*	*			trans	-79.3	90.5	158.2	-151.3	110	0	0	0	108.4
294	D	47	Very low	51.6	Low	143 Å²	143	117.7 Å²	117.7	77%	0.765	66%	0.659	S	S	*	*			trans	-88.7	126.3	168.2	-164.9	18.6	0	0	0	109.8	S292 C296	S292-D294 PolarHBondContact O-N 3.36Å; D294-C296 PolarHBondContact O-N 3.22Å; D294-C296 VanDerWaalsContact O-N 3.08Å
295	V	40.6	Very low	53.7	Low	126 Å²	126	118.3 Å²	118.3	76%	0.764	64%	0.643	S	S	*	*			trans	-74.8	96.8	-173.9	174.8	0	0	0	0	107.7
296	C	47.8	Very low	55.8	Low	109 Å²	109	112.8 Å²	112.8	74%	0.736	62%	0.615	S	S	*	*			trans	-129.1	135.6	163.5	-89.8	0	0	0	0	109	D294	D294-C296 PolarHBondContact O-N 3.22Å; D294-C296 VanDerWaalsContact O-N 3.08Å
297	E	44.9	Very low	57.7	Low	138 Å²	138	112.3 Å²	112.3	65%	0.645	61%	0.608	S	S	*	*			trans	-36.1	138.7	-168.9	-63.2	-171.2	145.1	0	0	116.2	S299 V300	E297-S299 PolarHBondContact O-N 2.78Å; E297-V300 PolarHBondContact O-N 3.3Å
298	P	54.4	Low	59.4	Low	131 Å²	131	112.1 Å²	112.1	85%	0.851	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-7.3	-179.8	25.6	-34	0	0	0	114.3
299	S	55.5	Low	61.3	Low	20 Å²	20	108.1 Å²	108.1	14%	0.14	58%	0.582	C	S	.	*	T	Hydrogen-bonded Turn	trans	-80.6	-41.5	178.7	-179.6	0	0	0	0	113.2	L168 E297 G301	L168-S299 VanDerWaalsContact CD1-OG 3.28Å; L168-S299 WeakPolarHBondContact CD1-OG 3.48Å; E297-S299 PolarHBondContact O-N 2.78Å; S299-G301 PolarHBondContact O-N 3.24Å
300	V	58.1	Low	63.3	Low	73 Å²	73	101.7 Å²	101.7	44%	0.442	55%	0.553	S	S	.	*	H	α-helix	trans	-81	-18.8	-175.8	179.5	0	0	0	0	112.4	E297 M302 K304	E297-V300 PolarHBondContact O-N 3.3Å; V300-M302 VanDerWaalsContact C-N 3.35Å; V300-K304 HydrophobicContact CG1-CD 4.25Å; V300-K304 WeakPolarHBondContact O-CG 3.49Å
301	G	66.2	Low	65.7	Low	42 Å²	42	100.2 Å²	100.2	43%	0.433	54%	0.54	S	S	.	.	H	α-helix	trans	-70.7	-28.5	176.7	0	0	0	0	0	113.5	S299 E305	S299-G301 PolarHBondContact O-N 3.24Å; G301-E305 WeakPolarHBondContact O-CB 3.19Å; G301-E305 PolarHBondContact O-N 2.93Å
302	M	70.8	Confident	67.9	Low	60 Å²	60	96.8 Å²	96.8	30%	0.296	52%	0.524	S	S	.	.	H	α-helix	trans	-78.1	-49.7	-172.9	-165	179.6	59.8	0	0	112.7	V160 I163 E164 V300 K304 E305 V306	V160-M302 HydrophobicContact CG1-CE 4.41Å; I163-M302 HydrophobicContact CB-CE 3.96Å; I163-M302 HydrophobicContact CG2-CE 3.57Å; I163-M302 HydrophobicContact CG2-SD 4.21Å; E164-M302 HydrophobicContact CG-CE 3.53Å; V300-M302 VanDerWaalsContact C-N 3.35Å; M302-K304 VanDerWaalsContact C-N 3.25Å; M302-K304 PolarHBondContact O-N 2.82Å; M302-E305 PolarHBondContact O-N 2.84Å; M302-V306 HydrophobicContact CG-CG2 4.44Å; M302-V306 WeakPolarHBondContact O-CB 3.37Å; M302-V306 VanDerWaalsContact O-CG2 3.28Å; M302-V306 WeakPolarHBondContact O-CG2 3.37Å; M302-V306 PolarHBondContact O-N 2.86Å
303	I	72.2	Confident	70	Confident	58 Å²	58	96.5 Å²	96.5	30%	0.297	51%	0.514	S	S	.	.	H	α-helix	trans	-48.8	-50.2	167.3	-90	151.2	0	0	0	110.4	V160 E164 E305 V306 E307	V160-I303 HydrophobicContact CG1-CG1 4.42Å; E164-I303 VanDerWaalsContact CD-CG1 3.43Å; E164-I303 WeakPolarHBondContact OE1-CD1 3.47Å; E164-I303 WeakPolarHBondContact OE1-CG1 3.21Å; E164-I303 PolarHBondContact OE1-N 2.87Å; E164-I303 VanDerWaalsContact OE1-N 3.07Å; E164-I303 WeakPolarHBondContact OE2-CD1 3.38Å; E164-I303 WeakPolarHBondContact OE2-CG1 3.32Å; I303-E305 VanDerWaalsContact C-N 3.32Å; I303-E305 PolarHBondContact O-N 3.14Å; I303-V306 PolarHBondContact O-N 2.87Å; I303-E307 VanDerWaalsContact CG2-CD 3.48Å; I303-E307 HydrophobicContact CG2-CG 3.97Å; I303-E307 VanDerWaalsContact O-CB 3.3Å; I303-E307 WeakPolarHBondContact O-CB 3.31Å; I303-E307 VanDerWaalsContact O-CG 3.31Å; I303-E307 WeakPolarHBondContact O-CG 3.24Å; I303-E307 PolarHBondContact O-N 3.49Å
304	K	80.4	Confident	72.2	Confident	132 Å²	132	91.8 Å²	91.8	57%	0.574	49%	0.492	S	S	*	.	H	α-helix	trans	-64.7	-38.8	-173.2	-73.1	179.6	-179.4	176.2	0	111.7	V300 M302 K308	V300-K304 HydrophobicContact CG1-CD 4.25Å; V300-K304 WeakPolarHBondContact O-CG 3.49Å; M302-K304 VanDerWaalsContact C-N 3.25Å; M302-K304 PolarHBondContact O-N 2.82Å; K304-K308 WeakPolarHBondContact O-CB 3.36Å; K304-K308 PolarHBondContact O-N 3.42Å
305	E	82.8	Confident	74.3	Confident	84 Å²	84	88.6 Å²	88.6	39%	0.393	48%	0.475	S	S	.	.	H	α-helix	trans	-72	-38.8	175.3	-166.6	60.5	-157.7	0	0	111.5	G301 M302 I303 K308 L309	G301-E305 WeakPolarHBondContact O-CB 3.19Å; G301-E305 PolarHBondContact O-N 2.93Å; M302-E305 PolarHBondContact O-N 2.84Å; I303-E305 VanDerWaalsContact C-N 3.32Å; I303-E305 PolarHBondContact O-N 3.14Å; E305-K308 WeakPolarHBondContact O-CB 3.39Å; E305-K308 PolarHBondContact O-N 2.82Å; E305-K308 IonicContact OE1-NZ 2.84Å; E305-K308 PolarHBondContact OE1-NZ 3.12Å; E305-K308 IonicContact OE2-NZ 3.08Å; E305-K308 PolarHBondContact OE2-NZ 3.4Å; E305-K308 VanDerWaalsContact OE2-NZ 3.08Å; E305-L309 HydrophobicContact CG-CD1 4.4Å; E305-L309 WeakPolarHBondContact O-CB 3.36Å; E305-L309 VanDerWaalsContact O-CG 3.24Å; E305-L309 WeakPolarHBondContact O-CG 3.35Å; E305-L309 PolarHBondContact O-N 3.03Å
306	V	85.5	Confident	76.8	Confident	30 Å²	30	87.3 Å²	87.3	18%	0.182	46%	0.463	C	S	.	.	H	α-helix	trans	-65.1	-44.6	174.9	171	0	0	0	0	111.4	V160 M302 I303 K308 L309 I310	V160-V306 HydrophobicContact CG1-CG2 4.37Å; V160-V306 HydrophobicContact CG2-CG1 4.12Å; V160-V306 HydrophobicContact CG2-CG2 4.01Å; M302-V306 HydrophobicContact CG-CG2 4.44Å; M302-V306 WeakPolarHBondContact O-CB 3.37Å; M302-V306 VanDerWaalsContact O-CG2 3.28Å; M302-V306 WeakPolarHBondContact O-CG2 3.37Å; M302-V306 PolarHBondContact O-N 2.86Å; I303-V306 PolarHBondContact O-N 2.87Å; V306-K308 VanDerWaalsContact C-N 3.3Å; V306-K308 PolarHBondContact O-N 3.48Å; V306-L309 PolarHBondContact O-N 3.31Å; V306-I310 HydrophobicContact CG1-CD1 3.77Å; V306-I310 HydrophobicContact CG1-CG1 4.33Å; V306-I310 WeakPolarHBondContact O-CB 3.33Å; V306-I310 VanDerWaalsContact O-CG1 3.23Å; V306-I310 WeakPolarHBondContact O-CG1 3.14Å; V306-I310 PolarHBondContact O-N 2.93Å
307	E	83.9	Confident	78.7	Confident	121 Å²	121	88.2 Å²	88.2	57%	0.565	45%	0.452	S	S	*	.	H	α-helix	trans	-61.7	-40.6	175.1	-76.8	-178.3	162.7	0	0	111.1	I303 I310 K311	I303-E307 VanDerWaalsContact CG2-CD 3.48Å; I303-E307 HydrophobicContact CG2-CG 3.97Å; I303-E307 VanDerWaalsContact O-CB 3.3Å; I303-E307 WeakPolarHBondContact O-CB 3.31Å; I303-E307 VanDerWaalsContact O-CG 3.31Å; I303-E307 WeakPolarHBondContact O-CG 3.24Å; I303-E307 PolarHBondContact O-N 3.49Å; E307-I310 PolarHBondContact O-N 2.91Å; E307-K311 WeakPolarHBondContact O-CB 3.46Å; E307-K311 PolarHBondContact O-N 3.41Å
308	K	89.2	Confident	80.8	Confident	111 Å²	111	87.5 Å²	87.5	48%	0.483	45%	0.449	S	S	.	.	H	α-helix	trans	-62.7	-46.4	173.4	176.5	174.7	154.5	-118.8	0	111.4	K304 E305 V306 I310 K311 E312	K304-K308 WeakPolarHBondContact O-CB 3.36Å; K304-K308 PolarHBondContact O-N 3.42Å; E305-K308 WeakPolarHBondContact O-CB 3.39Å; E305-K308 PolarHBondContact O-N 2.82Å; E305-K308 IonicContact OE1-NZ 2.84Å; E305-K308 PolarHBondContact OE1-NZ 3.12Å; E305-K308 IonicContact OE2-NZ 3.08Å; E305-K308 PolarHBondContact OE2-NZ 3.4Å; E305-K308 VanDerWaalsContact OE2-NZ 3.08Å; V306-K308 VanDerWaalsContact C-N 3.3Å; V306-K308 PolarHBondContact O-N 3.48Å; K308-I310 PolarHBondContact O-N 3.09Å; K308-K311 PolarHBondContact O-N 3.02Å; K308-E312 WeakPolarHBondContact O-CB 3.32Å; K308-E312 PolarHBondContact O-N 2.96Å
309	L	89.8	Confident	82.7	Confident	92 Å²	92	85 Å²	85	48%	0.482	43%	0.431	S	S	.	.	H	α-helix	trans	-64.4	-37.7	176.3	-72.3	172.5	0	0	0	112.2	E305 V306 N313	E305-L309 HydrophobicContact CG-CD1 4.4Å; E305-L309 WeakPolarHBondContact O-CB 3.36Å; E305-L309 VanDerWaalsContact O-CG 3.24Å; E305-L309 WeakPolarHBondContact O-CG 3.35Å; E305-L309 PolarHBondContact O-N 3.03Å; V306-L309 PolarHBondContact O-N 3.31Å; L309-N313 WeakPolarHBondContact O-CB 3.29Å; L309-N313 PolarHBondContact O-N 3.12Å
310	I	86.3	Confident	84.4	Confident	49 Å²	49	89.9 Å²	89.9	25%	0.251	45%	0.45	S	S	.	.	H	α-helix	trans	-64.5	-44.4	174.2	-71.7	166.9	0	0	0	110.2	V306 E307 K308 N313 T314	V306-I310 HydrophobicContact CG1-CD1 3.77Å; V306-I310 HydrophobicContact CG1-CG1 4.33Å; V306-I310 WeakPolarHBondContact O-CB 3.33Å; V306-I310 VanDerWaalsContact O-CG1 3.23Å; V306-I310 WeakPolarHBondContact O-CG1 3.14Å; V306-I310 PolarHBondContact O-N 2.93Å; E307-I310 PolarHBondContact O-N 2.91Å; K308-I310 PolarHBondContact O-N 3.09Å; I310-N313 PolarHBondContact O-N 3.31Å; I310-T314 WeakPolarHBondContact O-CB 3.39Å; I310-T314 PolarHBondContact O-N 3.45Å; I310-T314 PolarHBondContact O-OG1 3.17Å
311	K	89.2	Confident	86	Confident	137 Å²	137	89.3 Å²	89.3	60%	0.596	44%	0.444	S	S	*	.	H	α-helix	trans	-63.8	-48.5	178	-173.3	-175.6	175	-169.4	0	111.1	E307 K308 N313 T314 D315	E307-K311 WeakPolarHBondContact O-CB 3.46Å; E307-K311 PolarHBondContact O-N 3.41Å; K308-K311 PolarHBondContact O-N 3.02Å; K311-N313 VanDerWaalsContact C-N 3.32Å; K311-N313 PolarHBondContact O-N 3.11Å; K311-T314 WeakPolarHBondContact O-CA 3.4Å; K311-T314 WeakPolarHBondContact O-CB 3.47Å; K311-T314 PolarHBondContact O-N 3.43Å; K311-T314 VanDerWaalsContact O-N 3.1Å; K311-D315 PolarHBondContact O-N 3.47Å
312	E	91.8	Very high	87.3	Confident	98 Å²	98	89.7 Å²	89.7	46%	0.458	44%	0.443	S	S	.	.	H	α-helix	trans	-60.3	-41.7	176.4	-176.7	177.8	175.2	0	0	111.6	K308 T314 D315 L316	K308-E312 WeakPolarHBondContact O-CB 3.32Å; K308-E312 PolarHBondContact O-N 2.96Å; E312-T314 VanDerWaalsContact C-N 3.29Å; E312-T314 PolarHBondContact O-N 3.43Å; E312-D315 PolarHBondContact O-N 3.1Å; E312-L316 HydrophobicContact CG-CD1 4.24Å; E312-L316 HydrophobicContact CG-CG 4.49Å; E312-L316 WeakPolarHBondContact O-CB 3.18Å; E312-L316 VanDerWaalsContact O-CG 3.29Å; E312-L316 WeakPolarHBondContact O-CG 3.4Å; E312-L316 PolarHBondContact O-N 2.89Å
313	N	89.5	Confident	88.4	Confident	107 Å²	107	92.3 Å²	92.3	57%	0.572	46%	0.458	S	S	*	.	H	α-helix	trans	-64.9	-35.2	175.7	-159.3	-72.9	0	0	0	111.9	L309 I310 K311 L316 Y317	L309-N313 WeakPolarHBondContact O-CB 3.29Å; L309-N313 PolarHBondContact O-N 3.12Å; I310-N313 PolarHBondContact O-N 3.31Å; K311-N313 VanDerWaalsContact C-N 3.32Å; K311-N313 PolarHBondContact O-N 3.11Å; N313-L316 PolarHBondContact O-N 3.44Å; N313-Y317 VanDerWaalsContact O-CB 3.32Å; N313-Y317 WeakPolarHBondContact O-CB 3.34Å; N313-Y317 PolarHBondContact O-N 3.12Å
314	T	89.9	Confident	89.4	Confident	66 Å²	66	92.1 Å²	92.1	41%	0.405	46%	0.457	S	S	.	.	H	α-helix	trans	-64.3	-48.2	173.5	-53.2	0	0	0	0	110.5	I310 K311 E312 L316 Y317 E318	I310-T314 WeakPolarHBondContact O-CB 3.39Å; I310-T314 PolarHBondContact O-N 3.45Å; I310-T314 PolarHBondContact O-OG1 3.17Å; K311-T314 WeakPolarHBondContact O-CA 3.4Å; K311-T314 WeakPolarHBondContact O-CB 3.47Å; K311-T314 PolarHBondContact O-N 3.43Å; K311-T314 VanDerWaalsContact O-N 3.1Å; E312-T314 VanDerWaalsContact C-N 3.29Å; E312-T314 PolarHBondContact O-N 3.43Å; T314-L316 VanDerWaalsContact C-N 3.32Å; T314-L316 PolarHBondContact O-N 3.12Å; T314-Y317 WeakPolarHBondContact O-CB 3.3Å; T314-Y317 PolarHBondContact O-N 2.76Å; T314-Y317 VanDerWaalsContact O-N 3.15Å; T314-E318 WeakPolarHBondContact O-CG 3.49Å; T314-E318 PolarHBondContact O-N 2.86Å
315	D	91.5	Very high	89.9	Confident	77 Å²	77	90.9 Å²	90.9	41%	0.412	46%	0.456	S	S	.	.	H	α-helix	trans	-62.3	-38.7	176.9	-63.9	-14.6	0	0	0	111.2	K311 E312 E318 T319	K311-D315 PolarHBondContact O-N 3.47Å; E312-D315 PolarHBondContact O-N 3.1Å; D315-E318 PolarHBondContact O-N 3.43Å; D315-T319 WeakPolarHBondContact O-CG2 3.39Å; D315-T319 PolarHBondContact O-N 2.9Å; D315-T319 PolarHBondContact O-OG1 3.2Å; D315-T319 VanDerWaalsContact O-OG1 3.07Å
316	L	92.5	Very high	90.5	Very high	99 Å²	99	92.1 Å²	92.1	52%	0.518	47%	0.465	S	S	.	.	H	α-helix	trans	-66.8	-37.7	173.8	-74.3	174.7	0	0	0	112.5	E312 N313 T314 T319 K320	E312-L316 HydrophobicContact CG-CD1 4.24Å; E312-L316 HydrophobicContact CG-CG 4.49Å; E312-L316 WeakPolarHBondContact O-CB 3.18Å; E312-L316 VanDerWaalsContact O-CG 3.29Å; E312-L316 WeakPolarHBondContact O-CG 3.4Å; E312-L316 PolarHBondContact O-N 2.89Å; N313-L316 PolarHBondContact O-N 3.44Å; T314-L316 VanDerWaalsContact C-N 3.32Å; T314-L316 PolarHBondContact O-N 3.12Å; L316-T319 VanDerWaalsContact CA-OG1 3.32Å; L316-T319 WeakPolarHBondContact CA-OG1 3.45Å; L316-T319 PolarHBondContact O-OG1 3.44Å; L316-K320 WeakPolarHBondContact O-CB 3.24Å; L316-K320 PolarHBondContact O-N 2.83Å
317	Y	87.8	Confident	90.9	Very high	128 Å²	128	95.1 Å²	95.1	50%	0.502	48%	0.476	S	S	.	.	H	α-helix	trans	-67.6	-39.5	175.2	-170.6	-98.1	0	0	0	111.4	N313 T314 K320 N321	N313-Y317 VanDerWaalsContact O-CB 3.32Å; N313-Y317 WeakPolarHBondContact O-CB 3.34Å; N313-Y317 PolarHBondContact O-N 3.12Å; T314-Y317 WeakPolarHBondContact O-CB 3.3Å; T314-Y317 PolarHBondContact O-N 2.76Å; T314-Y317 VanDerWaalsContact O-N 3.15Å; Y317-K320 PolarHBondContact O-N 2.96Å; Y317-N321 WeakPolarHBondContact CD1-ND2 3.2Å; Y317-N321 WeakPolarHBondContact CE1-ND2 3.4Å; Y317-N321 WeakPolarHBondContact O-CB 3.33Å; Y317-N321 VanDerWaalsContact O-CG 3.3Å; Y317-N321 PolarHBondContact O-N 3.03Å
318	E	90.1	Very high	91.4	Very high	122 Å²	122	93.7 Å²	93.7	57%	0.57	47%	0.472	S	S	*	.	H	α-helix	trans	-64.1	-46.5	174.3	-73.1	-177.3	-173.9	0	0	111.9	T314 D315 N321 A322	T314-E318 WeakPolarHBondContact O-CG 3.49Å; T314-E318 PolarHBondContact O-N 2.86Å; D315-E318 PolarHBondContact O-N 3.43Å; E318-N321 PolarHBondContact O-N 2.91Å; E318-A322 WeakPolarHBondContact O-CB 3.4Å; E318-A322 PolarHBondContact O-N 3.48Å
319	T	92.6	Very high	91.7	Very high	78 Å²	78	92.4 Å²	92.4	48%	0.479	47%	0.47	S	S	.	.	H	α-helix	trans	-64.6	-38.8	175.5	53.5	0	0	0	0	112.1	D315 L316 A322 L323	D315-T319 WeakPolarHBondContact O-CG2 3.39Å; D315-T319 PolarHBondContact O-N 2.9Å; D315-T319 PolarHBondContact O-OG1 3.2Å; D315-T319 VanDerWaalsContact O-OG1 3.07Å; L316-T319 VanDerWaalsContact CA-OG1 3.32Å; L316-T319 WeakPolarHBondContact CA-OG1 3.45Å; L316-T319 PolarHBondContact O-OG1 3.44Å; T319-A322 PolarHBondContact O-N 2.88Å; T319-L323 WeakPolarHBondContact O-CB 3.42Å; T319-L323 WeakPolarHBondContact O-CG 3.33Å; T319-L323 PolarHBondContact O-N 3.38Å
320	K	92.7	Very high	91.9	Very high	124 Å²	124	94 Å²	94	54%	0.539	48%	0.478	S	S	.	.	H	α-helix	trans	-60.9	-44	172.3	178.6	177.8	176.6	171.1	0	111.9	L316 Y317 L323 N324	L316-K320 WeakPolarHBondContact O-CB 3.24Å; L316-K320 PolarHBondContact O-N 2.83Å; Y317-K320 PolarHBondContact O-N 2.96Å; K320-L323 PolarHBondContact O-N 2.88Å; K320-N324 PolarHBondContact O-N 3.39Å
321	N	91.3	Very high	92.2	Very high	61 Å²	61	94.9 Å²	94.9	33%	0.326	48%	0.483	S	S	.	.	H	α-helix	trans	-65.9	-41.5	176.9	-76	-16.4	0	0	0	111.8	Y317 E318 L323 N324 I325	Y317-N321 WeakPolarHBondContact CD1-ND2 3.2Å; Y317-N321 WeakPolarHBondContact CE1-ND2 3.4Å; Y317-N321 WeakPolarHBondContact O-CB 3.33Å; Y317-N321 VanDerWaalsContact O-CG 3.3Å; Y317-N321 PolarHBondContact O-N 3.03Å; E318-N321 PolarHBondContact O-N 2.91Å; N321-L323 VanDerWaalsContact C-N 3.33Å; N321-L323 PolarHBondContact O-N 2.88Å; N321-N324 PolarHBondContact O-N 3.35Å; N321-I325 WeakPolarHBondContact O-CG1 3.39Å; N321-I325 PolarHBondContact O-N 2.94Å
322	A	93	Very high	92.4	Very high	50 Å²	50	95.1 Å²	95.1	41%	0.413	48%	0.484	S	S	.	.	H	α-helix	trans	-60.7	-42.2	174.4	0	0	0	0	0	111.7	E318 T319 I325 L326	E318-A322 WeakPolarHBondContact O-CB 3.4Å; E318-A322 PolarHBondContact O-N 3.48Å; T319-A322 PolarHBondContact O-N 2.88Å; A322-I325 PolarHBondContact O-N 2.94Å; A322-L326 WeakPolarHBondContact O-CG 3.11Å; A322-L326 PolarHBondContact O-N 3.07Å
323	L	93.8	Very high	92.6	Very high	114 Å²	114	96.8 Å²	96.8	60%	0.597	49%	0.49	S	S	*	.	H	α-helix	trans	-65.1	-40.3	175	-75.8	172.6	0	0	0	112.5	T319 K320 N321 L326 K327	T319-L323 WeakPolarHBondContact O-CB 3.42Å; T319-L323 WeakPolarHBondContact O-CG 3.33Å; T319-L323 PolarHBondContact O-N 3.38Å; K320-L323 PolarHBondContact O-N 2.88Å; N321-L323 VanDerWaalsContact C-N 3.33Å; N321-L323 PolarHBondContact O-N 2.88Å; L323-L326 PolarHBondContact O-N 3.41Å; L323-K327 WeakPolarHBondContact O-CB 3.48Å; L323-K327 PolarHBondContact O-N 3.4Å
324	N	93.1	Very high	92.8	Very high	54 Å²	54	95.3 Å²	95.3	29%	0.289	48%	0.481	S	S	.	.	H	α-helix	trans	-64	-41.2	175.6	-83.8	-32.7	0	0	0	112.2	K320 N321 L326 K327 D328	K320-N324 PolarHBondContact O-N 3.39Å; N321-N324 PolarHBondContact O-N 3.35Å; N324-L326 VanDerWaalsContact C-N 3.34Å; N324-L326 PolarHBondContact O-N 3Å; N324-K327 WeakPolarHBondContact O-CB 3.4Å; N324-K327 PolarHBondContact O-N 3.26Å; N324-K327 PolarHBondContact OD1-NZ 3.4Å; N324-K327 VanDerWaalsContact OD1-NZ 3.12Å; N324-D328 WeakPolarHBondContact O-CB 3.27Å; N324-D328 PolarHBondContact O-N 2.92Å
325	I	92.2	Very high	93.1	Very high	106 Å²	106	97.1 Å²	97.1	54%	0.544	49%	0.488	S	S	.	.	H	α-helix	trans	-60.1	-46	174	-66.4	164.5	0	0	0	110.4	N321 A322 K327 D328 D329	N321-I325 WeakPolarHBondContact O-CG1 3.39Å; N321-I325 PolarHBondContact O-N 2.94Å; A322-I325 PolarHBondContact O-N 2.94Å; I325-K327 VanDerWaalsContact C-N 3.33Å; I325-K327 PolarHBondContact O-N 3.31Å; I325-D328 PolarHBondContact O-N 3.37Å; I325-D329 WeakPolarHBondContact O-CB 3.4Å; I325-D329 PolarHBondContact O-N 3.24Å
326	L	93.7	Very high	93.1	Very high	111 Å²	111	99 Å²	99	58%	0.581	50%	0.495	S	S	*	.	H	α-helix	trans	-64.4	-36.8	177.2	-71.2	174.7	0	0	0	112.7	A322 L323 N324 L330	A322-L326 WeakPolarHBondContact O-CG 3.11Å; A322-L326 PolarHBondContact O-N 3.07Å; L323-L326 PolarHBondContact O-N 3.41Å; N324-L326 VanDerWaalsContact C-N 3.34Å; N324-L326 PolarHBondContact O-N 3Å; L326-L330 VanDerWaalsContact O-CB 3.27Å; L326-L330 WeakPolarHBondContact O-CB 3.35Å; L326-L330 PolarHBondContact O-N 2.86Å
327	K	95	Very high	93.2	Very high	93 Å²	93	98.5 Å²	98.5	40%	0.404	50%	0.496	S	S	.	.	H	α-helix	trans	-62.7	-49.8	174.5	-178.5	-163.7	74	-170.1	0	110.3	L323 N324 I325 D329 L330 I331	L323-K327 WeakPolarHBondContact O-CB 3.48Å; L323-K327 PolarHBondContact O-N 3.4Å; N324-K327 WeakPolarHBondContact O-CB 3.4Å; N324-K327 PolarHBondContact O-N 3.26Å; N324-K327 PolarHBondContact OD1-NZ 3.4Å; N324-K327 VanDerWaalsContact OD1-NZ 3.12Å; I325-K327 VanDerWaalsContact C-N 3.33Å; I325-K327 PolarHBondContact O-N 3.31Å; K327-D329 VanDerWaalsContact C-N 3.34Å; K327-D329 PolarHBondContact O-N 3.27Å; K327-L330 PolarHBondContact O-N 3.18Å; K327-L330 VanDerWaalsContact O-N 3.14Å; K327-I331 HydrophobicContact CD-CD1 4.4Å; K327-I331 HydrophobicContact CG-CD1 3.91Å; K327-I331 VanDerWaalsContact O-CG1 3.27Å; K327-I331 WeakPolarHBondContact O-CG1 3.29Å; K327-I331 PolarHBondContact O-N 3.32Å
328	D	94	Very high	93.5	Very high	91 Å²	91	95.9 Å²	95.9	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-64.7	-38.6	-179.7	-63.1	-16.9	0	0	0	111.2	N324 I325 I331 K332	N324-D328 WeakPolarHBondContact O-CB 3.27Å; N324-D328 PolarHBondContact O-N 2.92Å; I325-D328 PolarHBondContact O-N 3.37Å; D328-I331 PolarHBondContact O-N 3.03Å; D328-K332 WeakPolarHBondContact O-CB 3.48Å; D328-K332 PolarHBondContact O-N 3.39Å
329	D	94.7	Very high	93.6	Very high	83 Å²	83	91.7 Å²	91.7	44%	0.444	48%	0.482	S	S	.	.	H	α-helix	trans	-64.1	-39.2	172.1	-84.4	-18	0	0	0	112.5	I325 K327 K333	I325-D329 WeakPolarHBondContact O-CB 3.4Å; I325-D329 PolarHBondContact O-N 3.24Å; K327-D329 VanDerWaalsContact C-N 3.34Å; K327-D329 PolarHBondContact O-N 3.27Å; D329-K333 WeakPolarHBondContact O-CB 3.47Å; D329-K333 WeakPolarHBondContact O-CG 3.44Å; D329-K333 PolarHBondContact O-N 2.94Å
330	L	94.8	Very high	93.6	Very high	125 Å²	125	92.6 Å²	92.6	65%	0.654	48%	0.481	S	S	*	.	H	α-helix	trans	-70.1	-40	177.6	-166.6	72.1	0	0	0	111.2	L326 K327 K333 L334	L326-L330 VanDerWaalsContact O-CB 3.27Å; L326-L330 WeakPolarHBondContact O-CB 3.35Å; L326-L330 PolarHBondContact O-N 2.86Å; K327-L330 PolarHBondContact O-N 3.18Å; K327-L330 VanDerWaalsContact O-N 3.14Å; L330-K333 PolarHBondContact O-N 3.44Å; L330-L334 VanDerWaalsContact O-CB 3.3Å; L330-L334 WeakPolarHBondContact O-CB 3.47Å; L330-L334 PolarHBondContact O-N 3.44Å
331	I	92.7	Very high	93.7	Very high	68 Å²	68	91.8 Å²	91.8	35%	0.349	48%	0.478	S	S	.	.	H	α-helix	trans	-61.4	-48.3	173.2	-69.9	166.6	0	0	0	109.6	K327 D328 K333 L334 D335	K327-I331 HydrophobicContact CD-CD1 4.4Å; K327-I331 HydrophobicContact CG-CD1 3.91Å; K327-I331 VanDerWaalsContact O-CG1 3.27Å; K327-I331 WeakPolarHBondContact O-CG1 3.29Å; K327-I331 PolarHBondContact O-N 3.32Å; D328-I331 PolarHBondContact O-N 3.03Å; I331-K333 VanDerWaalsContact C-N 3.33Å; I331-K333 PolarHBondContact O-N 3.03Å; I331-L334 CarbonylContact O-C 3.58Å; I331-L334 WeakPolarHBondContact O-CA 3.39Å; I331-L334 WeakPolarHBondContact O-CB 3.37Å; I331-L334 PolarHBondContact O-N 3.18Å; I331-D335 PolarHBondContact O-N 2.94Å
332	K	93.9	Very high	93.8	Very high	143 Å²	143	92.5 Å²	92.5	62%	0.622	49%	0.487	S	S	*	.	H	α-helix	trans	-57.6	-44.3	176.8	-177.1	178.4	178.6	179.9	0	112.3	D328 D335 E336	D328-K332 WeakPolarHBondContact O-CB 3.48Å; D328-K332 PolarHBondContact O-N 3.39Å; K332-D335 PolarHBondContact O-N 2.88Å; K332-E336 WeakPolarHBondContact O-CB 3.33Å; K332-E336 PolarHBondContact O-N 3.06Å
333	K	94.6	Very high	93.7	Very high	133 Å²	133	95.8 Å²	95.8	58%	0.578	50%	0.496	S	S	*	.	H	α-helix	trans	-66.2	-37.2	174.9	-77	179.4	179.3	176.2	0	112.3	D329 L330 I331 V337	D329-K333 WeakPolarHBondContact O-CB 3.47Å; D329-K333 WeakPolarHBondContact O-CG 3.44Å; D329-K333 PolarHBondContact O-N 2.94Å; L330-K333 PolarHBondContact O-N 3.44Å; I331-K333 VanDerWaalsContact C-N 3.33Å; I331-K333 PolarHBondContact O-N 3.03Å; K333-V337 WeakPolarHBondContact O-CB 3.15Å; K333-V337 VanDerWaalsContact O-CG2 3.25Å; K333-V337 WeakPolarHBondContact O-CG2 3.41Å; K333-V337 PolarHBondContact O-N 3.33Å
334	L	95.8	Very high	93.7	Very high	75 Å²	75	94.8 Å²	94.8	39%	0.393	49%	0.491	S	S	.	.	H	α-helix	trans	-64.5	-43.6	175.9	-178.5	65	0	0	0	110.6	L330 I331 T338	L330-L334 VanDerWaalsContact O-CB 3.3Å; L330-L334 WeakPolarHBondContact O-CB 3.47Å; L330-L334 PolarHBondContact O-N 3.44Å; I331-L334 CarbonylContact O-C 3.58Å; I331-L334 WeakPolarHBondContact O-CA 3.39Å; I331-L334 WeakPolarHBondContact O-CB 3.37Å; I331-L334 PolarHBondContact O-N 3.18Å; L334-T338 WeakPolarHBondContact O-CB 3.3Å; L334-T338 PolarHBondContact O-N 2.98Å; L334-T338 PolarHBondContact O-OG1 2.67Å
335	D	94.2	Very high	93.7	Very high	104 Å²	104	97 Å²	97	56%	0.556	50%	0.501	S	S	*	.	H	α-helix	trans	-65.5	-43	177.4	-72.8	-18.2	0	0	0	111.7	I331 K332 T338 G339	I331-D335 PolarHBondContact O-N 2.94Å; K332-D335 PolarHBondContact O-N 2.88Å; D335-T338 PolarHBondContact O-N 3.35Å; D335-G339 PolarHBondContact O-N 2.83Å
336	E	92.5	Very high	93.8	Very high	116 Å²	116	98.7 Å²	98.7	54%	0.542	51%	0.507	S	S	.	.	H	α-helix	trans	-59.1	-53.4	174.5	-177.2	176.7	-168	0	0	111.1	K332 T338 G339 E340	K332-E336 WeakPolarHBondContact O-CB 3.33Å; K332-E336 PolarHBondContact O-N 3.06Å; E336-T338 VanDerWaalsContact C-N 3.3Å; E336-T338 PolarHBondContact O-N 3.41Å; E336-G339 PolarHBondContact O-N 2.93Å; E336-E340 WeakPolarHBondContact O-CG 3.34Å; E336-E340 PolarHBondContact O-N 3.45Å
337	V	93.8	Very high	93.8	Very high	89 Å²	89	99.1 Å²	99.1	54%	0.539	51%	0.506	S	S	.	.	H	α-helix	trans	-63.8	-36.4	179.1	171.8	0	0	0	0	111.6	K333 K341	K333-V337 WeakPolarHBondContact O-CB 3.15Å; K333-V337 VanDerWaalsContact O-CG2 3.25Å; K333-V337 WeakPolarHBondContact O-CG2 3.41Å; K333-V337 PolarHBondContact O-N 3.33Å; V337-K341 WeakPolarHBondContact O-CB 3.42Å; V337-K341 PolarHBondContact O-N 3.02Å
338	T	94.1	Very high	93.8	Very high	74 Å²	74	98.6 Å²	98.6	45%	0.454	51%	0.507	S	S	.	.	H	α-helix	trans	-70.5	-39.4	177.9	-60.7	0	0	0	0	111.3	L334 D335 E336 K341 S342	L334-T338 WeakPolarHBondContact O-CB 3.3Å; L334-T338 PolarHBondContact O-N 2.98Å; L334-T338 PolarHBondContact O-OG1 2.67Å; D335-T338 PolarHBondContact O-N 3.35Å; E336-T338 VanDerWaalsContact C-N 3.3Å; E336-T338 PolarHBondContact O-N 3.41Å; T338-K341 PolarHBondContact O-N 2.94Å; T338-S342 WeakPolarHBondContact O-CB 3.46Å; T338-S342 PolarHBondContact O-N 3.38Å
339	G	92.8	Very high	93.7	Very high	33 Å²	33	100 Å²	100	34%	0.34	51%	0.51	S	S	.	.	H	α-helix	trans	-63.5	-48.7	173.5	0	0	0	0	0	112.1	D335 E336 K341 S342 M343	D335-G339 PolarHBondContact O-N 2.83Å; E336-G339 PolarHBondContact O-N 2.93Å; G339-K341 PolarHBondContact O-N 3.38Å; G339-S342 WeakPolarHBondContact O-CB 3.45Å; G339-S342 PolarHBondContact O-N 3.07Å; G339-M343 WeakPolarHBondContact O-CG 3.27Å; G339-M343 PolarHBondContact O-N 3.23Å
340	E	94	Very high	93.7	Very high	98 Å²	98	98.5 Å²	98.5	46%	0.458	51%	0.509	S	S	.	.	H	α-helix	trans	-58.7	-45.7	174.1	-73.4	-172.8	164.6	0	0	112	E336 S342 M343 L344	E336-E340 WeakPolarHBondContact O-CG 3.34Å; E336-E340 PolarHBondContact O-N 3.45Å; E340-S342 VanDerWaalsContact C-N 3.31Å; E340-S342 PolarHBondContact O-N 3.22Å; E340-M343 HydrophobicContact CG-CE 4.4Å; E340-M343 PolarHBondContact O-N 3.43Å; E340-L344 WeakPolarHBondContact O-CB 3.49Å; E340-L344 VanDerWaalsContact O-CG 3.32Å; E340-L344 WeakPolarHBondContact O-CG 3.49Å; E340-L344 PolarHBondContact O-N 2.64Å
341	K	94.4	Very high	93.5	Very high	106 Å²	106	98.2 Å²	98.2	46%	0.461	51%	0.506	S	S	.	.	H	α-helix	trans	-58.5	-43.5	175.2	177.8	-175	171.9	-171	0	111.4	V337 T338 G339 L344 I345	V337-K341 WeakPolarHBondContact O-CB 3.42Å; V337-K341 PolarHBondContact O-N 3.02Å; T338-K341 PolarHBondContact O-N 2.94Å; G339-K341 PolarHBondContact O-N 3.38Å; K341-L344 PolarHBondContact O-N 2.81Å; K341-I345 HydrophobicContact CG-CD1 3.93Å; K341-I345 WeakPolarHBondContact O-CB 3.25Å; K341-I345 WeakPolarHBondContact O-CD1 3.34Å; K341-I345 WeakPolarHBondContact O-CG1 3.38Å; K341-I345 PolarHBondContact O-N 3.46Å
342	S	92.6	Very high	93.6	Very high	76 Å²	76	102.2 Å²	102.2	53%	0.531	52%	0.517	S	S	.	.	H	α-helix	trans	-63	-47.2	177.8	-171	0	0	0	0	111.7	T338 G339 E340 L344 I345 Q346	T338-S342 WeakPolarHBondContact O-CB 3.46Å; T338-S342 PolarHBondContact O-N 3.38Å; G339-S342 WeakPolarHBondContact O-CB 3.45Å; G339-S342 PolarHBondContact O-N 3.07Å; E340-S342 VanDerWaalsContact C-N 3.31Å; E340-S342 PolarHBondContact O-N 3.22Å; S342-L344 PolarHBondContact O-N 3.09Å; S342-I345 PolarHBondContact O-N 3.4Å; S342-Q346 PolarHBondContact O-N 2.92Å
343	M	90.9	Very high	93.5	Very high	120 Å²	120	98 Å²	98	59%	0.591	50%	0.503	S	S	*	.	H	α-helix	trans	-61.2	-44.5	176.5	-70.1	-168.4	-65.2	0	0	112.1	G339 E340 I345 Q346 E347	G339-M343 WeakPolarHBondContact O-CG 3.27Å; G339-M343 PolarHBondContact O-N 3.23Å; E340-M343 HydrophobicContact CG-CE 4.4Å; E340-M343 PolarHBondContact O-N 3.43Å; M343-I345 VanDerWaalsContact C-N 3.34Å; M343-I345 PolarHBondContact O-N 2.95Å; M343-Q346 PolarHBondContact O-N 3.19Å; M343-E347 WeakPolarHBondContact O-CB 3.39Å; M343-E347 PolarHBondContact O-N 3.01Å
344	L	93.7	Very high	93.5	Very high	93 Å²	93	95.2 Å²	95.2	49%	0.487	50%	0.495	S	S	.	.	H	α-helix	trans	-64.4	-37.4	177.3	-74.7	171.4	0	0	0	112.1	E340 K341 S342 E347 I348	E340-L344 WeakPolarHBondContact O-CB 3.49Å; E340-L344 VanDerWaalsContact O-CG 3.32Å; E340-L344 WeakPolarHBondContact O-CG 3.49Å; E340-L344 PolarHBondContact O-N 2.64Å; K341-L344 PolarHBondContact O-N 2.81Å; S342-L344 PolarHBondContact O-N 3.09Å; L344-E347 PolarHBondContact O-N 3.33Å; L344-I348 WeakPolarHBondContact O-CB 3.48Å; L344-I348 WeakPolarHBondContact O-CD1 3.48Å; L344-I348 WeakPolarHBondContact O-CG1 3.29Å; L344-I348 PolarHBondContact O-N 2.77Å
345	I	94.3	Very high	93.5	Very high	99 Å²	99	97.6 Å²	97.6	51%	0.508	50%	0.498	S	S	.	.	H	α-helix	trans	-63.5	-44	174	-72.5	166.7	0	0	0	110.4	K341 S342 M343 I348 H349	K341-I345 HydrophobicContact CG-CD1 3.93Å; K341-I345 WeakPolarHBondContact O-CB 3.25Å; K341-I345 WeakPolarHBondContact O-CD1 3.34Å; K341-I345 WeakPolarHBondContact O-CG1 3.38Å; K341-I345 PolarHBondContact O-N 3.46Å; S342-I345 PolarHBondContact O-N 3.4Å; M343-I345 VanDerWaalsContact C-N 3.34Å; M343-I345 PolarHBondContact O-N 2.95Å; I345-I348 PolarHBondContact O-N 3.43Å; I345-H349 WeakPolarHBondContact O-CB 3.48Å; I345-H349 PolarHBondContact O-N 2.88Å
346	Q	93	Very high	93.5	Very high	143 Å²	143	96.2 Å²	96.2	67%	0.668	49%	0.491	S	S	*	.	H	α-helix	trans	-64.2	-42.8	176.7	-171.3	179.3	17.1	0	0	111.8	S342 M343 H349 A350	S342-Q346 PolarHBondContact O-N 2.92Å; M343-Q346 PolarHBondContact O-N 3.19Å; Q346-H349 WeakPolarHBondContact O-CB 3.46Å; Q346-H349 PolarHBondContact O-N 2.86Å; Q346-A350 WeakPolarHBondContact O-CB 3.39Å; Q346-A350 PolarHBondContact O-N 3.1Å
347	E	94.1	Very high	93.6	Very high	119 Å²	119	96.4 Å²	96.4	56%	0.556	49%	0.492	S	S	*	.	H	α-helix	trans	-63.2	-44.3	175.9	-173.3	177.8	-177.3	0	0	111.3	M343 L344 H349 A350 M351	M343-E347 WeakPolarHBondContact O-CB 3.39Å; M343-E347 PolarHBondContact O-N 3.01Å; L344-E347 PolarHBondContact O-N 3.33Å; E347-H349 VanDerWaalsContact C-N 3.3Å; E347-H349 PolarHBondContact O-N 3.27Å; E347-A350 PolarHBondContact O-N 2.87Å; E347-M351 HydrophobicContact CG-CG 4.4Å; E347-M351 WeakPolarHBondContact O-CB 3.37Å; E347-M351 VanDerWaalsContact O-CG 3.24Å; E347-M351 WeakPolarHBondContact O-CG 3.5Å; E347-M351 PolarHBondContact O-N 3.43Å
348	I	94	Very high	93.7	Very high	82 Å²	82	97.1 Å²	97.1	42%	0.421	49%	0.491	S	S	.	.	H	α-helix	trans	-60.4	-40.8	174	-72.6	166.8	0	0	0	110.8	L344 I345 R352	L344-I348 WeakPolarHBondContact O-CB 3.48Å; L344-I348 WeakPolarHBondContact O-CD1 3.48Å; L344-I348 WeakPolarHBondContact O-CG1 3.29Å; L344-I348 PolarHBondContact O-N 2.77Å; I345-I348 PolarHBondContact O-N 3.43Å; I348-R352 HydrophobicContact CG2-CG 4.46Å; I348-R352 WeakPolarHBondContact O-CB 3.43Å; I348-R352 WeakPolarHBondContact O-CG 3.38Å; I348-R352 PolarHBondContact O-N 3.34Å
349	H	93.4	Very high	93.8	Very high	122 Å²	122	98.5 Å²	98.5	57%	0.565	49%	0.491	S	S	*	.	H	α-helix	trans	-63.6	-49.2	176.5	-175.3	-85.8	0	0	0	111.3	I345 Q346 E347 M351 R352 T353	I345-H349 WeakPolarHBondContact O-CB 3.48Å; I345-H349 PolarHBondContact O-N 2.88Å; Q346-H349 WeakPolarHBondContact O-CB 3.46Å; Q346-H349 PolarHBondContact O-N 2.86Å; E347-H349 VanDerWaalsContact C-N 3.3Å; E347-H349 PolarHBondContact O-N 3.27Å; H349-M351 VanDerWaalsContact C-N 3.34Å; H349-M351 PolarHBondContact O-N 2.95Å; H349-R352 WeakPolarHBondContact O-CB 3.18Å; H349-R352 PolarHBondContact O-N 2.99Å; H349-R352 VanDerWaalsContact O-N 3.12Å; H349-T353 PolarHBondContact O-N 2.94Å; H349-T353 PolarHBondContact O-OG1 3.49Å
350	A	93.6	Very high	93.8	Very high	51 Å²	51	100.3 Å²	100.3	42%	0.421	50%	0.498	S	S	.	.	H	α-helix	trans	-61.6	-38.9	177.2	0	0	0	0	0	112.7	Q346 E347 R352 T353 N354	Q346-A350 WeakPolarHBondContact O-CB 3.39Å; Q346-A350 PolarHBondContact O-N 3.1Å; E347-A350 PolarHBondContact O-N 2.87Å; A350-R352 VanDerWaalsContact C-N 3.34Å; A350-T353 WeakPolarHBondContact CA-OG1 3.4Å; A350-T353 PolarHBondContact O-N 2.72Å; A350-T353 PolarHBondContact O-OG1 2.91Å; A350-N354 WeakPolarHBondContact O-CB 3.3Å; A350-N354 PolarHBondContact O-N 3.03Å
351	M	91.4	Very high	93.8	Very high	119 Å²	119	99.2 Å²	99.2	59%	0.586	49%	0.494	S	S	*	.	H	α-helix	trans	-68.2	-34	174.8	-72.5	-62.4	-71	0	0	112.1	E347 H349 R355	E347-M351 HydrophobicContact CG-CG 4.4Å; E347-M351 WeakPolarHBondContact O-CB 3.37Å; E347-M351 VanDerWaalsContact O-CG 3.24Å; E347-M351 WeakPolarHBondContact O-CG 3.5Å; E347-M351 PolarHBondContact O-N 3.43Å; H349-M351 VanDerWaalsContact C-N 3.34Å; H349-M351 PolarHBondContact O-N 2.95Å; M351-R355 WeakPolarHBondContact O-CB 3.42Å; M351-R355 PolarHBondContact O-N 2.96Å
352	R	94	Very high	93.7	Very high	151 Å²	151	96.5 Å²	96.5	57%	0.57	49%	0.491	S	S	*	.	H	α-helix	trans	-68.1	-44.7	174.2	-77	170.9	-177	178.3	3.8	111.7	I348 H349 A350 R355 D356	I348-R352 HydrophobicContact CG2-CG 4.46Å; I348-R352 WeakPolarHBondContact O-CB 3.43Å; I348-R352 WeakPolarHBondContact O-CG 3.38Å; I348-R352 PolarHBondContact O-N 3.34Å; H349-R352 WeakPolarHBondContact O-CB 3.18Å; H349-R352 PolarHBondContact O-N 2.99Å; H349-R352 VanDerWaalsContact O-N 3.12Å; A350-R352 VanDerWaalsContact C-N 3.34Å; R352-R355 PolarHBondContact O-N 2.87Å; R352-D356 WeakPolarHBondContact O-CB 3.43Å; R352-D356 PolarHBondContact O-N 3.3Å
353	T	93	Very high	93.8	Very high	56 Å²	56	96 Å²	96	34%	0.344	49%	0.487	S	S	.	.	H	α-helix	trans	-62.1	-49.2	177.4	56.5	0	0	0	0	110.9	H349 A350 R355 D356 E357	H349-T353 PolarHBondContact O-N 2.94Å; H349-T353 PolarHBondContact O-OG1 3.49Å; A350-T353 WeakPolarHBondContact CA-OG1 3.4Å; A350-T353 PolarHBondContact O-N 2.72Å; A350-T353 PolarHBondContact O-OG1 2.91Å; T353-R355 VanDerWaalsContact C-N 3.34Å; T353-R355 PolarHBondContact O-N 2.9Å; T353-D356 PolarHBondContact O-N 3.48Å; T353-E357 WeakPolarHBondContact O-CG 3.47Å; T353-E357 PolarHBondContact O-N 3.31Å
354	N	93.7	Very high	94.1	Very high	74 Å²	74	95 Å²	95	40%	0.396	48%	0.477	S	S	.	.	H	α-helix	trans	-61	-40.9	176.8	-172.6	13.7	0	0	0	112.1	A350 D356 E357 I358	A350-N354 WeakPolarHBondContact O-CB 3.3Å; A350-N354 PolarHBondContact O-N 3.03Å; N354-D356 VanDerWaalsContact C-N 3.3Å; N354-D356 PolarHBondContact O-N 3.49Å; N354-E357 PolarHBondContact O-N 3.22Å; N354-I358 WeakPolarHBondContact O-CB 3.39Å; N354-I358 VanDerWaalsContact O-CG1 3.29Å; N354-I358 WeakPolarHBondContact O-CG1 3.23Å; N354-I358 PolarHBondContact O-N 3.5Å; N354-I358 WeakPolarHBondContact OD1-CD1 3.44Å
355	R	96	Very high	94.1	Very high	125 Å²	125	94.6 Å²	94.6	47%	0.472	47%	0.474	S	S	.	.	H	α-helix	trans	-59.8	-41.6	174	-176.8	-160.2	71.7	167.7	-3.7	111.6	M351 R352 T353 K359	M351-R355 WeakPolarHBondContact O-CB 3.42Å; M351-R355 PolarHBondContact O-N 2.96Å; R352-R355 PolarHBondContact O-N 2.87Å; T353-R355 VanDerWaalsContact C-N 3.34Å; T353-R355 PolarHBondContact O-N 2.9Å; R355-K359 HydrophobicContact CG-CD 4.38Å; R355-K359 WeakPolarHBondContact O-CB 3.47Å; R355-K359 VanDerWaalsContact O-CG 3.25Å; R355-K359 WeakPolarHBondContact O-CG 3.49Å; R355-K359 PolarHBondContact O-N 2.93Å
356	D	94.3	Very high	94.1	Very high	75 Å²	75	92.8 Å²	92.8	40%	0.401	47%	0.471	S	S	.	.	H	α-helix	trans	-73.2	-35	-178.4	-65.1	-15.1	0	0	0	111.1	R352 T353 N354 K359 S360	R352-D356 WeakPolarHBondContact O-CB 3.43Å; R352-D356 PolarHBondContact O-N 3.3Å; T353-D356 PolarHBondContact O-N 3.48Å; N354-D356 VanDerWaalsContact C-N 3.3Å; N354-D356 PolarHBondContact O-N 3.49Å; D356-K359 PolarHBondContact O-N 3.01Å; D356-S360 WeakPolarHBondContact O-CB 3.4Å; D356-S360 PolarHBondContact O-N 3.13Å
357	E	95.7	Very high	94.2	Very high	120 Å²	120	93.8 Å²	93.8	56%	0.561	47%	0.468	S	S	*	.	H	α-helix	trans	-60.4	-52.3	168.6	-72.6	170.2	-158.4	0	0	111.7	T353 N354 K359 S360 E361	T353-E357 WeakPolarHBondContact O-CG 3.47Å; T353-E357 PolarHBondContact O-N 3.31Å; N354-E357 PolarHBondContact O-N 3.22Å; E357-K359 VanDerWaalsContact C-N 3.29Å; E357-K359 PolarHBondContact O-N 3.19Å; E357-S360 WeakPolarHBondContact O-CB 3.37Å; E357-S360 PolarHBondContact O-N 3.39Å; E357-S360 PolarHBondContact O-OG 3.23Å; E357-E361 PolarHBondContact O-N 3.45Å
358	I	94.2	Very high	94.2	Very high	103 Å²	103	91.5 Å²	91.5	53%	0.528	46%	0.46	S	S	.	.	H	α-helix	trans	-59.2	-40.5	176.9	-68.7	167.3	0	0	0	111.1	N354 S360 E361 A362	N354-I358 WeakPolarHBondContact O-CB 3.39Å; N354-I358 VanDerWaalsContact O-CG1 3.29Å; N354-I358 WeakPolarHBondContact O-CG1 3.23Å; N354-I358 PolarHBondContact O-N 3.5Å; N354-I358 WeakPolarHBondContact OD1-CD1 3.44Å; I358-S360 VanDerWaalsContact C-N 3.35Å; I358-E361 PolarHBondContact O-N 3.35Å; I358-A362 VanDerWaalsContact O-CB 3.27Å; I358-A362 WeakPolarHBondContact O-CB 3Å; I358-A362 PolarHBondContact O-N 3.34Å
359	K	96.1	Very high	94.2	Very high	103 Å²	103	92.3 Å²	92.3	45%	0.448	47%	0.468	S	S	.	.	H	α-helix	trans	-63.7	-40.1	175.2	-80.2	174.9	177.6	-178.9	0	112.2	R355 D356 E357 E361 S363	R355-K359 HydrophobicContact CG-CD 4.38Å; R355-K359 WeakPolarHBondContact O-CB 3.47Å; R355-K359 VanDerWaalsContact O-CG 3.25Å; R355-K359 WeakPolarHBondContact O-CG 3.49Å; R355-K359 PolarHBondContact O-N 2.93Å; D356-K359 PolarHBondContact O-N 3.01Å; E357-K359 VanDerWaalsContact C-N 3.29Å; E357-K359 PolarHBondContact O-N 3.19Å; K359-E361 VanDerWaalsContact C-N 3.34Å; K359-S363 WeakPolarHBondContact O-CB 3.22Å; K359-S363 PolarHBondContact O-N 3.14Å; K359-S363 PolarHBondContact O-OG 3.02Å
360	S	93.5	Very high	94.2	Very high	71 Å²	71	94.4 Å²	94.4	50%	0.497	47%	0.472	S	S	.	.	H	α-helix	trans	-64.5	-41.6	177.1	80.3	0	0	0	0	111.2	D356 E357 I358 S363 R364	D356-S360 WeakPolarHBondContact O-CB 3.4Å; D356-S360 PolarHBondContact O-N 3.13Å; E357-S360 WeakPolarHBondContact O-CB 3.37Å; E357-S360 PolarHBondContact O-N 3.39Å; E357-S360 PolarHBondContact O-OG 3.23Å; I358-S360 VanDerWaalsContact C-N 3.35Å; S360-S363 WeakPolarHBondContact O-CB 3.46Å; S360-S363 PolarHBondContact O-N 3.48Å; S360-R364 PolarHBondContact O-N 3.06Å
361	E	94.7	Very high	94.2	Very high	76 Å²	76	97 Å²	97	36%	0.355	48%	0.476	S	S	.	.	H	α-helix	trans	-70.8	-42.3	179.4	-176.8	56.1	-161.4	0	0	111.9	E357 I358 K359 S363 R364 L365	E357-E361 PolarHBondContact O-N 3.45Å; I358-E361 PolarHBondContact O-N 3.35Å; K359-E361 VanDerWaalsContact C-N 3.34Å; E361-S363 VanDerWaalsContact C-N 3.25Å; E361-S363 PolarHBondContact O-N 3.27Å; E361-R364 VanDerWaalsContact CD-NE 3.32Å; E361-R364 WeakPolarHBondContact O-CB 3.33Å; E361-R364 PolarHBondContact O-N 3.21Å; E361-R364 VanDerWaalsContact O-N 3.1Å; E361-R364 IonicContact OE1-CZ 3.17Å; E361-R364 VanDerWaalsContact OE1-CZ 3.27Å; E361-R364 IonicContact OE1-NE 3.95Å; E361-R364 PolarHBondContact OE1-NE 3.4Å; E361-R364 VanDerWaalsContact OE1-NE 3.09Å; E361-R364 IonicContact OE1-NH2 2.84Å; E361-R364 PolarHBondContact OE1-NH2 3.44Å; E361-R364 WeakPolarHBondContact OE2-CD 3.41Å; E361-R364 IonicContact OE2-CZ 3.94Å; E361-R364 IonicContact OE2-NE 2.97Å; E361-R364 PolarHBondContact OE2-NE 3.45Å; E361-R364 IonicContact OE2-NH2 2.68Å; E361-L365 HydrophobicContact CG-CD1 4.41Å; E361-L365 WeakPolarHBondContact O-CG 3.34Å; E361-L365 PolarHBondContact O-N 3.41Å
362	A	92.3	Very high	94.2	Very high	48 Å²	48	94.5 Å²	94.5	40%	0.397	47%	0.469	S	S	.	.	H	α-helix	trans	-59.5	-37.5	171.7	0	0	0	0	0	111.8	I358 S366	I358-A362 VanDerWaalsContact O-CB 3.27Å; I358-A362 WeakPolarHBondContact O-CB 3Å; I358-A362 PolarHBondContact O-N 3.34Å; A362-S366 VanDerWaalsContact O-CB 3.29Å; A362-S366 WeakPolarHBondContact O-CB 3.46Å; A362-S366 PolarHBondContact O-N 3.08Å; A362-S366 PolarHBondContact O-OG 3.02Å
363	S	94.9	Very high	94.3	Very high	65 Å²	65	95.5 Å²	95.5	46%	0.455	47%	0.473	S	S	.	.	H	α-helix	trans	-69.3	-34.8	175.4	-58.7	0	0	0	0	112.3	K359 S360 E361 R367	K359-S363 WeakPolarHBondContact O-CB 3.22Å; K359-S363 PolarHBondContact O-N 3.14Å; K359-S363 PolarHBondContact O-OG 3.02Å; S360-S363 WeakPolarHBondContact O-CB 3.46Å; S360-S363 PolarHBondContact O-N 3.48Å; E361-S363 VanDerWaalsContact C-N 3.25Å; E361-S363 PolarHBondContact O-N 3.27Å; S363-R367 PolarHBondContact O-N 3.35Å; S363-R367 PolarHBondContact O-NE 2.97Å
364	R	95.8	Very high	94.3	Very high	100 Å²	100	98.3 Å²	98.3	38%	0.377	49%	0.486	S	S	.	.	H	α-helix	trans	-67.1	-49.9	174.1	-171.4	-167.7	73.3	81.4	1.2	111.2	S360 E361 S366 R367 L368	S360-R364 PolarHBondContact O-N 3.06Å; E361-R364 VanDerWaalsContact CD-NE 3.32Å; E361-R364 WeakPolarHBondContact O-CB 3.33Å; E361-R364 PolarHBondContact O-N 3.21Å; E361-R364 VanDerWaalsContact O-N 3.1Å; E361-R364 IonicContact OE1-CZ 3.17Å; E361-R364 VanDerWaalsContact OE1-CZ 3.27Å; E361-R364 IonicContact OE1-NE 3.95Å; E361-R364 PolarHBondContact OE1-NE 3.4Å; E361-R364 VanDerWaalsContact OE1-NE 3.09Å; E361-R364 IonicContact OE1-NH2 2.84Å; E361-R364 PolarHBondContact OE1-NH2 3.44Å; E361-R364 WeakPolarHBondContact OE2-CD 3.41Å; E361-R364 IonicContact OE2-CZ 3.94Å; E361-R364 IonicContact OE2-NE 2.97Å; E361-R364 PolarHBondContact OE2-NE 3.45Å; E361-R364 IonicContact OE2-NH2 2.68Å; R364-S366 VanDerWaalsContact C-N 3.33Å; R364-S366 PolarHBondContact O-N 2.9Å; R364-R367 WeakPolarHBondContact O-CB 3.27Å; R364-R367 PolarHBondContact O-N 2.97Å; R364-L368 VanDerWaalsContact NH1-CD1 3.26Å; R364-L368 PolarHBondContact O-N 3.45Å; R364-L368 VanDerWaalsContact O-N 3.13Å
365	L	94.8	Very high	94.3	Very high	84 Å²	84	99.8 Å²	99.8	44%	0.44	49%	0.49	S	S	.	.	H	α-helix	trans	-61.9	-40.5	177.3	-70.9	174.3	0	0	0	111.8	E361 R367 L368 V369	E361-L365 HydrophobicContact CG-CD1 4.41Å; E361-L365 WeakPolarHBondContact O-CG 3.34Å; E361-L365 PolarHBondContact O-N 3.41Å; L365-R367 VanDerWaalsContact C-N 3.31Å; L365-R367 PolarHBondContact O-N 3.24Å; L365-L368 PolarHBondContact O-N 2.91Å; L365-V369 WeakPolarHBondContact O-CG2 3.43Å; L365-V369 PolarHBondContact O-N 3.35Å
366	S	94.4	Very high	94.1	Very high	62 Å²	62	98.9 Å²	98.9	43%	0.434	49%	0.494	S	S	.	.	H	α-helix	trans	-58.2	-43.6	174.9	-62.5	0	0	0	0	111.6	A362 R364 V369 Y370	A362-S366 VanDerWaalsContact O-CB 3.29Å; A362-S366 WeakPolarHBondContact O-CB 3.46Å; A362-S366 PolarHBondContact O-N 3.08Å; A362-S366 PolarHBondContact O-OG 3.02Å; R364-S366 VanDerWaalsContact C-N 3.33Å; R364-S366 PolarHBondContact O-N 2.9Å; S366-V369 PolarHBondContact O-N 2.9Å; S366-Y370 WeakPolarHBondContact O-CD2 3.44Å; S366-Y370 PolarHBondContact O-N 2.89Å
367	R	94.3	Very high	94	Very high	163 Å²	163	98.2 Å²	98.2	62%	0.615	50%	0.495	S	S	*	.	H	α-helix	trans	-60.1	-46.1	175.5	-82.4	-179.7	-86.1	130.4	-8.9	112.3	S363 R364 L365 V369 Y370 E371	S363-R367 PolarHBondContact O-N 3.35Å; S363-R367 PolarHBondContact O-NE 2.97Å; R364-R367 WeakPolarHBondContact O-CB 3.27Å; R364-R367 PolarHBondContact O-N 2.97Å; L365-R367 VanDerWaalsContact C-N 3.31Å; L365-R367 PolarHBondContact O-N 3.24Å; R367-V369 VanDerWaalsContact C-N 3.34Å; R367-V369 PolarHBondContact O-N 2.88Å; R367-Y370 PolarHBondContact O-N 3.31Å; R367-E371 PolarHBondContact O-N 3.21Å
368	L	94.9	Very high	93.9	Very high	72 Å²	72	96 Å²	96	38%	0.377	49%	0.493	S	S	.	.	H	α-helix	trans	-63.8	-38	177.8	-70.3	177	0	0	0	112.7	R364 L365 E371 C372	R364-L368 VanDerWaalsContact NH1-CD1 3.26Å; R364-L368 PolarHBondContact O-N 3.45Å; R364-L368 VanDerWaalsContact O-N 3.13Å; L365-L368 PolarHBondContact O-N 2.91Å; L368-E371 PolarHBondContact O-N 3.37Å; L368-C372 WeakPolarHBondContact O-CB 3.32Å; L368-C372 PolarHBondContact O-N 3.35Å; L368-C372 PolarHBondContact O-SG 3.38Å
369	V	92.9	Very high	93.8	Very high	99 Å²	99	95 Å²	95	60%	0.6	49%	0.488	S	S	*	.	H	α-helix	trans	-64.1	-41.5	174.6	170	0	0	0	0	111	L365 S366 R367 E371 R373	L365-V369 WeakPolarHBondContact O-CG2 3.43Å; L365-V369 PolarHBondContact O-N 3.35Å; S366-V369 PolarHBondContact O-N 2.9Å; R367-V369 VanDerWaalsContact C-N 3.34Å; R367-V369 PolarHBondContact O-N 2.88Å; V369-E371 VanDerWaalsContact C-N 3.34Å; V369-R373 VanDerWaalsContact O-CB 3.22Å; V369-R373 WeakPolarHBondContact O-CB 3.4Å; V369-R373 PolarHBondContact O-N 2.99Å
370	Y	94	Very high	93.6	Very high	165 Å²	165	94 Å²	94	65%	0.647	49%	0.491	S	S	*	.	H	α-helix	trans	-62.4	-41.9	174.3	-77.3	-63.9	0	0	0	111.9	S366 R367 R373 D374	S366-Y370 WeakPolarHBondContact O-CD2 3.44Å; S366-Y370 PolarHBondContact O-N 2.89Å; R367-Y370 PolarHBondContact O-N 3.31Å; Y370-R373 PolarHBondContact O-N 3.27Å; Y370-D374 WeakPolarHBondContact O-CB 3.29Å; Y370-D374 PolarHBondContact O-N 3.27Å
371	E	94.5	Very high	93.4	Very high	107 Å²	107	93.5 Å²	93.5	50%	0.5	49%	0.491	S	S	.	.	H	α-helix	trans	-64.7	-47.6	177.4	-173.8	171.1	-172.9	0	0	112.1	R367 L368 V369 R373 D374 Q375	R367-E371 PolarHBondContact O-N 3.21Å; L368-E371 PolarHBondContact O-N 3.37Å; V369-E371 VanDerWaalsContact C-N 3.34Å; E371-R373 VanDerWaalsContact C-N 3.29Å; E371-R373 PolarHBondContact O-N 2.96Å; E371-D374 PolarHBondContact O-N 3.01Å; E371-Q375 WeakPolarHBondContact O-CG 3.3Å; E371-Q375 PolarHBondContact O-N 3.03Å
372	C	91.2	Very high	93.2	Very high	65 Å²	65	96.8 Å²	96.8	44%	0.439	50%	0.5	S	S	.	.	H	α-helix	trans	-60.5	-39.9	175	-67.6	0	0	0	0	111.5	L368 Q375 I376	L368-C372 WeakPolarHBondContact O-CB 3.32Å; L368-C372 PolarHBondContact O-N 3.35Å; L368-C372 PolarHBondContact O-SG 3.38Å; C372-Q375 PolarHBondContact O-N 3.45Å; C372-I376 VanDerWaalsContact O-CG1 3.25Å; C372-I376 WeakPolarHBondContact O-CG1 3.05Å; C372-I376 PolarHBondContact O-N 2.96Å
373	R	95	Very high	92.9	Very high	173 Å²	173	100.1 Å²	100.1	65%	0.653	51%	0.51	S	S	*	.	H	α-helix	trans	-64.6	-39.9	176.8	-178.8	177.9	180	159.2	1.1	111.9	V369 Y370 E371 S377	V369-R373 VanDerWaalsContact O-CB 3.22Å; V369-R373 WeakPolarHBondContact O-CB 3.4Å; V369-R373 PolarHBondContact O-N 2.99Å; Y370-R373 PolarHBondContact O-N 3.27Å; E371-R373 VanDerWaalsContact C-N 3.29Å; E371-R373 PolarHBondContact O-N 2.96Å; R373-S377 WeakPolarHBondContact O-CB 3.25Å; R373-S377 PolarHBondContact O-N 2.9Å; R373-S377 PolarHBondContact O-OG 3.47Å
374	D	92.7	Very high	92.6	Very high	115 Å²	115	103.2 Å²	103.2	62%	0.615	52%	0.516	S	S	*	.	H	α-helix	trans	-67.1	-43.1	176.8	-166.5	57	0	0	0	111.1	Y370 E371 I376 S377 S378	Y370-D374 WeakPolarHBondContact O-CB 3.29Å; Y370-D374 PolarHBondContact O-N 3.27Å; E371-D374 PolarHBondContact O-N 3.01Å; D374-I376 PolarHBondContact O-N 3.29Å; D374-S377 PolarHBondContact O-N 3.21Å; D374-S377 VanDerWaalsContact O-N 3.15Å; D374-S378 WeakPolarHBondContact O-CB 3.25Å; D374-S378 PolarHBondContact O-N 3.4Å
375	Q	94.6	Very high	92	Very high	104 Å²	104	104 Å²	104	49%	0.486	53%	0.525	S	S	.	.	H	α-helix	trans	-59.1	-46.7	173.5	-70.3	176.4	3.2	0	0	112.2	E371 C372 S377 S378 L379	E371-Q375 WeakPolarHBondContact O-CG 3.3Å; E371-Q375 PolarHBondContact O-N 3.03Å; C372-Q375 PolarHBondContact O-N 3.45Å; Q375-S377 VanDerWaalsContact C-N 3.32Å; Q375-S377 PolarHBondContact O-N 2.95Å; Q375-S378 PolarHBondContact O-N 3.09Å; Q375-L379 WeakPolarHBondContact O-CB 3.45Å; Q375-L379 VanDerWaalsContact O-CG 3.29Å; Q375-L379 WeakPolarHBondContact O-CG 3.48Å; Q375-L379 PolarHBondContact O-N 2.91Å
376	I	91.7	Very high	91.3	Very high	106 Å²	106	107.1 Å²	107.1	54%	0.544	53%	0.532	S	S	.	.	H	α-helix	trans	-60.4	-42.7	174.6	-69.3	165	0	0	0	110.6	C372 D374 L379 T380	C372-I376 VanDerWaalsContact O-CG1 3.25Å; C372-I376 WeakPolarHBondContact O-CG1 3.05Å; C372-I376 PolarHBondContact O-N 2.96Å; D374-I376 PolarHBondContact O-N 3.29Å; I376-L379 PolarHBondContact O-N 3.41Å; I376-T380 VanDerWaalsContact O-CB 3.3Å; I376-T380 WeakPolarHBondContact O-CB 3.41Å; I376-T380 PolarHBondContact O-N 2.93Å; I376-T380 PolarHBondContact O-OG1 2.77Å
377	S	92.4	Very high	90.5	Very high	61 Å²	61	110.3 Å²	110.3	43%	0.427	54%	0.54	S	S	.	.	H	α-helix	trans	-64.5	-42	179.4	-56.8	0	0	0	0	111.6	R373 D374 Q375 T380 A381	R373-S377 WeakPolarHBondContact O-CB 3.25Å; R373-S377 PolarHBondContact O-N 2.9Å; R373-S377 PolarHBondContact O-OG 3.47Å; D374-S377 PolarHBondContact O-N 3.21Å; D374-S377 VanDerWaalsContact O-N 3.15Å; Q375-S377 VanDerWaalsContact C-N 3.32Å; Q375-S377 PolarHBondContact O-N 2.95Å; S377-T380 PolarHBondContact O-N 2.92Å; S377-A381 WeakPolarHBondContact O-CB 3.43Å; S377-A381 PolarHBondContact O-N 2.74Å
378	S	92.5	Very high	89.6	Confident	74 Å²	74	106.2 Å²	106.2	52%	0.517	53%	0.53	S	S	.	.	H	α-helix	trans	-62.5	-47.4	174.6	177	0	0	0	0	112.2	D374 Q375 T380 A381 R382	D374-S378 WeakPolarHBondContact O-CB 3.25Å; D374-S378 PolarHBondContact O-N 3.4Å; Q375-S378 PolarHBondContact O-N 3.09Å; S378-T380 VanDerWaalsContact C-N 3.33Å; S378-T380 PolarHBondContact O-N 2.9Å; S378-A381 PolarHBondContact O-N 3.34Å; S378-R382 WeakPolarHBondContact O-CB 3.27Å; S378-R382 PolarHBondContact O-N 3.44Å
379	L	92.3	Very high	88.5	Confident	83 Å²	83	107 Å²	107	44%	0.435	54%	0.538	S	S	.	.	H	α-helix	trans	-62.8	-39.6	176	-70.7	175	0	0	0	112	Q375 I376 R382 L383	Q375-L379 WeakPolarHBondContact O-CB 3.45Å; Q375-L379 VanDerWaalsContact O-CG 3.29Å; Q375-L379 WeakPolarHBondContact O-CG 3.48Å; Q375-L379 PolarHBondContact O-N 2.91Å; I376-L379 PolarHBondContact O-N 3.41Å; L379-R382 PolarHBondContact O-N 2.91Å; L379-L383 WeakPolarHBondContact O-CG 3.49Å; L379-L383 PolarHBondContact O-N 3.19Å
380	T	91.6	Very high	86.9	Confident	82 Å²	82	107.7 Å²	107.7	50%	0.503	54%	0.538	S	S	.	.	H	α-helix	trans	-65.3	-44.5	176.9	-56.5	0	0	0	0	111.3	I376 S377 S378 R382 L383 K384	I376-T380 VanDerWaalsContact O-CB 3.3Å; I376-T380 WeakPolarHBondContact O-CB 3.41Å; I376-T380 PolarHBondContact O-N 2.93Å; I376-T380 PolarHBondContact O-OG1 2.77Å; S377-T380 PolarHBondContact O-N 2.92Å; S378-T380 VanDerWaalsContact C-N 3.33Å; S378-T380 PolarHBondContact O-N 2.9Å; T380-R382 VanDerWaalsContact C-N 3.3Å; T380-R382 PolarHBondContact O-N 2.94Å; T380-L383 PolarHBondContact O-N 2.69Å; T380-K384 PolarHBondContact O-N 2.85Å
381	A	90.8	Very high	85.2	Confident	59 Å²	59	106.4 Å²	106.4	49%	0.488	54%	0.538	S	S	.	.	H	α-helix	trans	-61.4	-40.4	174.9	0	0	0	0	0	111.6	S377 S378 K384 M385	S377-A381 WeakPolarHBondContact O-CB 3.43Å; S377-A381 PolarHBondContact O-N 2.74Å; S378-A381 PolarHBondContact O-N 3.34Å; A381-K384 PolarHBondContact O-N 3.09Å; A381-M385 WeakPolarHBondContact O-CG 3.5Å; A381-M385 PolarHBondContact O-N 3.31Å; A381-M385 VanDerWaalsContact O-N 3.14Å
382	R	90.3	Very high	83.5	Confident	145 Å²	145	105 Å²	105	55%	0.547	55%	0.545	S	S	.	.	H	α-helix	trans	-65.2	-40.4	175.7	-169.4	175.1	67	171.9	3	112.4	S378 L379 T380 M385 Y386	S378-R382 WeakPolarHBondContact O-CB 3.27Å; S378-R382 PolarHBondContact O-N 3.44Å; L379-R382 PolarHBondContact O-N 2.91Å; T380-R382 VanDerWaalsContact C-N 3.3Å; T380-R382 PolarHBondContact O-N 2.94Å; R382-M385 WeakPolarHBondContact O-CB 3.44Å; R382-M385 PolarHBondContact O-N 3.38Å; R382-Y386 HydrophobicContact CG-CD2 4.36Å; R382-Y386 HydrophobicContact CG-CE2 3.83Å; R382-Y386 WeakPolarHBondContact O-CD2 3.44Å; R382-Y386 PolarHBondContact O-N 3.24Å
383	L	86	Confident	81.5	Confident	118 Å²	118	109 Å²	109	62%	0.618	56%	0.562	S	S	*	*	H	α-helix	trans	-62.2	-44	174.2	-80.4	170.5	0	0	0	111.7	L379 T380 M385 Y386 E387	L379-L383 WeakPolarHBondContact O-CG 3.49Å; L379-L383 PolarHBondContact O-N 3.19Å; T380-L383 PolarHBondContact O-N 2.69Å; L383-M385 VanDerWaalsContact C-N 3.28Å; L383-M385 PolarHBondContact O-N 2.92Å; L383-Y386 WeakPolarHBondContact O-CB 3.49Å; L383-Y386 PolarHBondContact O-N 2.68Å; L383-E387 PolarHBondContact O-N 2.9Å
384	K	88.4	Confident	79	Confident	130 Å²	130	108.7 Å²	108.7	57%	0.565	57%	0.568	S	S	*	*	H	α-helix	trans	-58.9	-39.5	177	-168	178	-179.2	-179	0	112.4	T380 A381 Y386 E387 D388	T380-K384 PolarHBondContact O-N 2.85Å; A381-K384 PolarHBondContact O-N 3.09Å; K384-Y386 VanDerWaalsContact C-N 3.3Å; K384-Y386 PolarHBondContact O-N 2.87Å; K384-E387 PolarHBondContact O-N 3.44Å; K384-D388 PolarHBondContact O-N 2.93Å
385	M	83.4	Confident	76.5	Confident	116 Å²	116	114.1 Å²	114.1	57%	0.571	58%	0.58	S	S	*	*	H	α-helix	trans	-61.6	-35.3	174	-72.6	-60.2	-42.2	0	0	113.2	A381 R382 L383 V389	A381-M385 WeakPolarHBondContact O-CG 3.5Å; A381-M385 PolarHBondContact O-N 3.31Å; A381-M385 VanDerWaalsContact O-N 3.14Å; R382-M385 WeakPolarHBondContact O-CB 3.44Å; R382-M385 PolarHBondContact O-N 3.38Å; L383-M385 VanDerWaalsContact C-N 3.28Å; L383-M385 PolarHBondContact O-N 2.92Å; M385-V389 VanDerWaalsContact O-CG2 3.26Å; M385-V389 WeakPolarHBondContact O-CG2 3.34Å; M385-V389 PolarHBondContact O-N 3.41Å
386	Y	79.2	Confident	74.2	Confident	150 Å²	150	114.6 Å²	114.6	59%	0.588	59%	0.592	S	S	*	*	H	α-helix	trans	-72.6	-35.2	174.7	-72.6	-65.8	0	0	0	112.2	R382 L383 K384 V389 N390	R382-Y386 HydrophobicContact CG-CD2 4.36Å; R382-Y386 HydrophobicContact CG-CE2 3.83Å; R382-Y386 WeakPolarHBondContact O-CD2 3.44Å; R382-Y386 PolarHBondContact O-N 3.24Å; L383-Y386 WeakPolarHBondContact O-CB 3.49Å; L383-Y386 PolarHBondContact O-N 2.68Å; K384-Y386 VanDerWaalsContact C-N 3.3Å; K384-Y386 PolarHBondContact O-N 2.87Å; Y386-V389 PolarHBondContact O-N 3.33Å; Y386-N390 PolarHBondContact O-N 3.4Å
387	E	77.6	Confident	71.6	Confident	130 Å²	130	115.3 Å²	115.3	61%	0.607	61%	0.606	S	S	*	*	H	α-helix	trans	-66.9	-42.9	177	-157.8	165.3	-156.7	0	0	111.4	L383 K384 V389 N390 E391	L383-E387 PolarHBondContact O-N 2.9Å; K384-E387 PolarHBondContact O-N 3.44Å; E387-V389 VanDerWaalsContact C-N 3.28Å; E387-V389 PolarHBondContact O-N 2.93Å; E387-N390 PolarHBondContact O-N 2.96Å; E387-N390 VanDerWaalsContact O-N 3.14Å; E387-E391 PolarHBondContact O-N 3.35Å
388	D	75.8	Confident	69	Low	77 Å²	77	123.1 Å²	123.1	41%	0.412	63%	0.626	S	S	.	*	H	α-helix	trans	-63	-32.6	174.9	-68.5	-19.5	0	0	0	112.2	K384 A392	K384-D388 PolarHBondContact O-N 2.93Å; D388-A392 WeakPolarHBondContact O-CB 3.4Å; D388-A392 PolarHBondContact O-N 2.93Å; D388-A392 VanDerWaalsContact O-N 3.11Å
389	V	72	Confident	66.7	Low	88 Å²	88	127.6 Å²	127.6	53%	0.533	64%	0.643	S	S	.	*	H	α-helix	trans	-73.5	-36.7	174.5	172.8	0	0	0	0	111.4	M385 Y386 E387 A392	M385-V389 VanDerWaalsContact O-CG2 3.26Å; M385-V389 WeakPolarHBondContact O-CG2 3.34Å; M385-V389 PolarHBondContact O-N 3.41Å; Y386-V389 PolarHBondContact O-N 3.33Å; E387-V389 VanDerWaalsContact C-N 3.28Å; E387-V389 PolarHBondContact O-N 2.93Å; V389-A392 PolarHBondContact O-N 3.33Å
390	N	59.3	Low	64.1	Low	113 Å²	113	128.9 Å²	128.9	60%	0.604	66%	0.657	S	S	*	*	H	α-helix	trans	-71	-33.4	174.8	-88.2	3.8	0	0	0	112.8	Y386 E387	Y386-N390 PolarHBondContact O-N 3.4Å; E387-N390 PolarHBondContact O-N 2.96Å; E387-N390 VanDerWaalsContact O-N 3.14Å
391	E	58.9	Low	61.5	Low	138 Å²	138	133.3 Å²	133.3	65%	0.645	68%	0.676	S	S	*	*	H	α-helix	trans	-72.1	-28.3	171.9	-82.1	-162.4	156.2	0	0	112.4	E387 D393 Q394	E387-E391 PolarHBondContact O-N 3.35Å; E391-D393 VanDerWaalsContact C-N 3.31Å; E391-D393 PolarHBondContact O-N 3.45Å; E391-Q394 CarbonylContact O-C 3.45Å; E391-Q394 PolarHBondContact O-N 2.83Å; E391-Q394 VanDerWaalsContact O-N 3.13Å
392	A	57.6	Low	58.9	Low	78 Å²	78	136 Å²	136	65%	0.645	69%	0.687	S	S	*	*	H	α-helix	trans	-67.6	-28.2	177.6	0	0	0	0	0	113.5	D388 V389 Q394	D388-A392 WeakPolarHBondContact O-CB 3.4Å; D388-A392 PolarHBondContact O-N 2.93Å; D388-A392 VanDerWaalsContact O-N 3.11Å; V389-A392 PolarHBondContact O-N 3.33Å; A392-Q394 VanDerWaalsContact C-N 3.29Å
393	D	49.9	Very low	56.2	Low	150 Å²	150	134 Å²	134	80%	0.802	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-7.1	173.3	-94.1	-10.8	0	0	0	113.3	E391	E391-D393 VanDerWaalsContact C-N 3.31Å; E391-D393 PolarHBondContact O-N 3.45Å
394	Q	42.3	Very low	54	Low	165 Å²	165	136.8 Å²	136.8	77%	0.771	71%	0.709	S	S	*	*	S	Bend	trans	-121.2	86.4	177.5	-68.5	-171.8	63.4	0	0	111.6	E391 A392	E391-Q394 CarbonylContact O-C 3.45Å; E391-Q394 PolarHBondContact O-N 2.83Å; E391-Q394 VanDerWaalsContact O-N 3.13Å; A392-Q394 VanDerWaalsContact C-N 3.29Å
395	R	40.2	Very low	51.3	Low	229 Å²	229	138 Å²	138	86%	0.864	72%	0.717	S	S	*	*			trans	-142.6	154.5	161	-111.1	-166.4	176.7	163.2	3.8	111.2
396	P	45.6	Very low	48.8	Very low	115 Å²	115	140 Å²	140	75%	0.747	73%	0.725	S	S	*	*			cis	-142.3	151.9	-4	33.4	-12.7	0	0	0	115.9
397	S	38.7	Very low	46.7	Very low	120 Å²	120	138.7 Å²	138.7	84%	0.839	74%	0.737	S	S	*	*			trans	-157.1	95	155.7	174	0	0	0	0	112.3
398	R	37	Very low	44.7	Very low	226 Å²	226	142.3 Å²	142.3	85%	0.853	75%	0.751	S	S	*	*			trans	1.8	131.3	157	-60	178	174.1	-164.2	-2.9	118.6
399	L	43.4	Very low	42.7	Very low	167 Å²	167	143.9 Å²	143.9	87%	0.874	77%	0.768	S	S	*	*				-178.8	143.4	101.7	-88.7	167.4	0	0	0	110.5
400	P	38.1	Very low	40.9	Very low	110 Å²	110	143.9 Å²	143.9	71%	0.714	77%	0.771	S	S	*	*			trans	-94.5	136.1	-178	35.4	-27.5	0	0	0	110.5
401	L	36.9	Very low	39.7	Very low	175 Å²	175	151.1 Å²	151.1	92%	0.916	79%	0.79	S	S	*	*			trans	-140.6	144.6	158	-137	77.6	0	0	0	110.8
402	T	37.3	Very low	38.5	Very low	116 Å²	116	149.3 Å²	149.3	71%	0.712	79%	0.789	S	S	*	*			trans	-93.6	149.7	-147.7	47.7	0	0	0	0	113.2
403	S	32.5	Very low	37.2	Very low	103 Å²	103	152.8 Å²	152.8	72%	0.72	80%	0.795	S	S	*	*			trans	37.6	109.5	147.5	65.4	0	0	0	0	118.1
404	I	39	Very low	36.6	Very low	176 Å²	176	152.5 Å²	152.5	90%	0.903	79%	0.794	S	S	*	*				-143	125.5	129.8	-92	137.4	0	0	0	108.4
405	Q	32.9	Very low	36.2	Very low	156 Å²	156	150.3 Å²	150.3	73%	0.729	79%	0.791	S	S	*	*			trans	-85.1	141.8	-175.7	-176.5	165.1	-52.3	0	0	108.3
406	Q	30.7	Very low	36.2	Very low	159 Å²	159	147.4 Å²	147.4	74%	0.743	79%	0.788	S	S	*	*			trans	64.5	117	160.2	-64.6	164.9	11.2	0	0	117.2
407	S	34.3	Very low	35.6	Very low	121 Å²	121	148.4 Å²	148.4	85%	0.846	79%	0.787	S	S	*	*				-166.8	105.6	129.2	-80.9	0	0	0	0	110.8
408	K	35.8	Very low	35.6	Very low	206 Å²	206	148 Å²	148	90%	0.896	78%	0.779	S	S	*	*			trans	-66.6	158.5	144.7	-63.2	173.6	176	177.2	0	107.3
409	S	34.2	Very low	35.1	Very low	111 Å²	111	142.7 Å²	142.7	78%	0.776	78%	0.776	S	S	*	*			trans	94	129.9	-176.5	-163.2	0	0	0	0	111.1
410	C	35.4	Very low	34.7	Very low	87 Å²	87	142.8 Å²	142.8	59%	0.588	77%	0.771	S	S	*	*			cis	-171.9	129	40.5	-167.7	0	0	0	0	108.7	T412	C410-T412 PolarHBondContact SG-OG1 3.15Å
411	W	34	Very low	34.3	Very low	265 Å²	265	144 Å²	144	100%	1.004	78%	0.777	S	S	*	*			trans	-109.8	88.8	156.3	-80	101.7	0	0	0	106.9
412	T	33.2	Very low	34.2	Very low	101 Å²	101	140.4 Å²	140.4	62%	0.62	77%	0.766	S	S	*	*			trans	-147.6	123.9	162.7	47.2	0	0	0	0	109.9	C410	C410-T412 PolarHBondContact SG-OG1 3.15Å
413	L	30.1	Very low	34	Very low	150 Å²	150	143.7 Å²	143.7	79%	0.785	77%	0.771	S	S	*	*			trans	69.6	115.9	148.1	-55.6	171.2	0	0	0	118.5
414	N	36.5	Very low	34.1	Very low	145 Å²	145	150.6 Å²	150.6	78%	0.775	78%	0.783	S	S	*	*				-148.8	93.4	125.7	-115.8	20.6	0	0	0	109.6
415	V	33.8	Very low	33.7	Very low	118 Å²	118	153.2 Å²	153.2	72%	0.715	78%	0.781	S	S	*	*			trans	-84.4	111.6	155.9	171.3	0	0	0	0	104.6
416	E	40	Very low	33.5	Very low	168 Å²	168	153.2 Å²	153.2	79%	0.785	79%	0.786	S	S	*	*			trans	-97.7	108.6	164.9	-81.4	-178.3	172.1	0	0	108.4
417	D	34.7	Very low	33.8	Very low	136 Å²	136	155.3 Å²	155.3	73%	0.727	79%	0.793	S	S	*	*			trans	-56.1	126.2	163.3	-73	-45.5	0	0	0	110.2
418	T	37	Very low	34.1	Very low	111 Å²	111	154.3 Å²	154.3	68%	0.681	79%	0.786	S	S	*	*			trans	-148.6	98.9	144.5	-63.5	0	0	0	0	109.4	H420	T418-H420 PolarHBondContact O-N 2.89Å
419	C	27.7	Very low	34.2	Very low	115 Å²	115	150 Å²	150	78%	0.777	78%	0.776	S	S	*	*			trans	-72.9	111	166.5	-66.4	0	0	0	0	109.8
420	H	34.4	Very low	34.3	Very low	170 Å²	170	150.8 Å²	150.8	79%	0.787	77%	0.772	S	S	*	*			trans	-127.7	103.6	157.7	-71.7	-38.4	0	0	0	110.9	T418	T418-H420 PolarHBondContact O-N 2.89Å
421	T	29.3	Very low	34.2	Very low	136 Å²	136	153.4 Å²	153.4	83%	0.834	78%	0.78	S	S	*	*			trans	-50.4	133.9	161.2	55.7	0	0	0	0	111.5
422	S	34.7	Very low	34.5	Very low	98 Å²	98	148.6 Å²	148.6	69%	0.685	77%	0.773	S	S	*	*			trans	174.7	106.2	134.8	176.8	0	0	0	0	112.4
423	K	33.3	Very low	34.8	Very low	186 Å²	186	150.8 Å²	150.8	81%	0.809	78%	0.781	S	S	*	*			trans	40.8	105.3	130	-56.5	172	-178.7	171.2	0	117.3
424	Y	34.9	Very low	35	Very low	247 Å²	247	150.8 Å²	150.8	97%	0.969	78%	0.782	S	S	*	*			trans	-132	137.1	134.8	-95.5	-84.3	0	0	0	110.6
425	R	31.1	Very low	35.2	Very low	231 Å²	231	150.2 Å²	150.2	87%	0.872	78%	0.783	S	S	*	*			trans	-116	139.3	-151.9	-172.3	-172.1	-152.4	-177.5	4.6	108.3
426	N	28.5	Very low	35.6	Very low	156 Å²	156	149.7 Å²	149.7	83%	0.834	79%	0.785	S	S	*	*			trans	-38.3	139.7	170.9	-57	-23.1	0	0	0	114.3
427	K	37.8	Very low	35.7	Very low	203 Å²	203	147.5 Å²	147.5	88%	0.883	79%	0.785	S	S	*	*			trans	-147.9	141.2	153.5	-73.7	-169	-179.8	176.9	0	111.6
428	S	38.8	Very low	35.8	Very low	101 Å²	101	148.4 Å²	148.4	71%	0.706	79%	0.789	S	S	*	*			trans	94.7	91.1	164.3	-141.9	0	0	0	0	115.4
429	V	39.7	Very low	35.9	Very low	114 Å²	114	149.4 Å²	149.4	69%	0.691	79%	0.791	S	S	*	*				57.1	137.9	67.1	-48.7	0	0	0	0	111.7
430	D	34.7	Very low	36	Very low	128 Å²	128	150.5 Å²	150.5	68%	0.684	79%	0.789	S	S	*	*			cis	-175.6	161.9	-14.6	-94.4	-32.7	0	0	0	103.2
431	N	34.3	Very low	36.4	Very low	143 Å²	143	150.2 Å²	150.2	77%	0.765	79%	0.79	S	S	*	*			trans	82.4	108.8	155.3	-54.4	-41.9	0	0	0	120.2
432	L	40	Very low	36.8	Very low	163 Å²	163	148.8 Å²	148.8	85%	0.853	78%	0.781	S	S	*	*				170.4	99.1	103.6	-113.5	86.2	0	0	0	105.9
433	N	39.1	Very low	36.8	Very low	148 Å²	148	153.3 Å²	153.3	79%	0.791	79%	0.788	S	S	*	*				41.8	103.4	91.9	-84.8	6.8	0	0	0	115.6
434	D	35.3	Very low	37.1	Very low	150 Å²	150	151.6 Å²	151.6	80%	0.802	79%	0.793	S	S	*	*				96.1	150	117.8	-129.2	-10.6	0	0	0	119.9
435	V	41.2	Very low	37.3	Very low	132 Å²	132	148 Å²	148	80%	0.8	79%	0.786	S	S	*	*			trans	97.1	92.8	171.9	-163.1	0	0	0	0	117
436	S	41.3	Very low	37.7	Very low	108 Å²	108	144.5 Å²	144.5	76%	0.755	78%	0.784	S	S	*	*			trans	-88.4	-173.9	155.8	-53.2	0	0	0	0	110.6
437	P	43	Very low	38.1	Very low	121 Å²	121	140.7 Å²	140.7	79%	0.786	78%	0.782	S	S	*	*				-125.6	173.2	-106.3	29.8	-6.5	0	0	0	113.5
438	L	36.1	Very low	38.1	Very low	155 Å²	155	137.3 Å²	137.3	81%	0.812	78%	0.782	S	S	*	*			trans	-153.8	128.6	164.1	-150.5	69.9	0	0	0	114.7
439	N	38	Very low	37.8	Very low	132 Å²	132	139.5 Å²	139.5	71%	0.706	79%	0.786	S	S	*	*			trans	46.4	120.4	148.8	-67.1	6.1	0	0	0	120.6
440	D	30.9	Very low	37.8	Very low	138 Å²	138	140 Å²	140	74%	0.738	80%	0.795	S	S	*	*				81.2	139.9	64.8	-157	14.3	0	0	0	112.8
441	M	42.1	Very low	37.8	Very low	165 Å²	165	143 Å²	143	81%	0.813	81%	0.805	S	S	*	*			trans	142	81.9	168.1	-73.3	-66	169.6	0	0	113.2
442	T	37.5	Very low	37.8	Very low	106 Å²	106	141.2 Å²	141.2	65%	0.65	80%	0.803	S	S	*	*				44.2	117.1	123.6	61.5	0	0	0	0	123.3
443	K	35.3	Very low	37.7	Very low	193 Å²	193	139.9 Å²	139.9	84%	0.839	80%	0.802	S	S	*	*				31.3	130.1	125	-69	-179.2	175.2	-177.4	0	120.6
444	T	40.5	Very low	37.5	Very low	149 Å²	149	140.3 Å²	140.3	91%	0.914	80%	0.804	S	S	*	*				-163.9	147.3	125.1	16.5	0	0	0	0	110.6
445	E	38.1	Very low	37.7	Very low	172 Å²	172	140.7 Å²	140.7	80%	0.804	81%	0.806	S	S	*	*			trans	-91.3	-178.4	-166.5	-62.8	176.9	153.3	0	0	112.7
446	D	40.3	Very low	37.6	Very low	157 Å²	157	143.8 Å²	143.8	84%	0.84	81%	0.809	S	S	*	*			trans	89.4	100.8	162.8	-58.8	-24	0	0	0	119.9
447	G	37	Very low	37.6	Very low	77 Å²	77	144.9 Å²	144.9	79%	0.794	81%	0.81	S	S	*	*				92.6	125.2	99.6	0	0	0	0	0	119.7
448	C	36.9	Very low	37.7	Very low	131 Å²	131	143.7 Å²	143.7	89%	0.885	80%	0.803	S	S	*	*			trans	98.5	118.9	152.6	-152.6	0	0	0	0	118.8
449	D	33.4	Very low	38.4	Very low	148 Å²	148	145.4 Å²	145.4	79%	0.791	80%	0.804	S	S	*	*			trans	-55.7	144.9	174.7	-55	-66.8	0	0	0	114
450	S	38.7	Very low	38.4	Very low	125 Å²	125	149.5 Å²	149.5	87%	0.874	82%	0.815	S	S	*	*			trans	-176.7	133.5	132.8	-80.8	0	0	0	0	111.2
451	Q	35	Very low	39.2	Very low	190 Å²	190	146.8 Å²	146.8	89%	0.888	82%	0.82	S	S	*	*			trans	-57.3	162.5	176.2	-76.1	166.9	-33	0	0	114.2
452	S	35	Very low	39.3	Very low	105 Å²	105	146 Å²	146	73%	0.734	81%	0.814	S	S	*	*			trans	101.8	148.3	159.9	86	0	0	0	0	115.7
453	T	37.4	Very low	40.2	Very low	135 Å²	135	145.9 Å²	145.9	83%	0.828	82%	0.824	S	S	*	*			trans	78.4	129.2	-173.6	83	0	0	0	0	112.5
454	L	33.7	Very low	41.6	Very low	157 Å²	157	142.9 Å²	142.9	82%	0.822	81%	0.811	S	S	*	*			cis	-170.6	141	-3.3	-175.2	73.1	0	0	0	104	K456	L454-K456 PolarHBondContact O-N 3.33Å; L454-K456 VanDerWaalsContact O-N 3.12Å
455	N	39.8	Very low	42.9	Very low	158 Å²	158	142.1 Å²	142.1	85%	0.845	80%	0.795	S	S	*	*			trans	-48.1	117.5	167.5	-67.3	-39	0	0	0	110.9
456	K	38.9	Very low	45.1	Very low	198 Å²	198	137.8 Å²	137.8	86%	0.861	78%	0.781	S	S	*	*			trans	-129	96.7	164.2	-146	169.7	-173.6	-180	0	107.7	L454 P458	L454-K456 PolarHBondContact O-N 3.33Å; L454-K456 VanDerWaalsContact O-N 3.12Å; K456-P458 WeakPolarHBondContact O-CD 3.48Å
457	V	42	Very low	47.3	Very low	130 Å²	130	139.4 Å²	139.4	79%	0.788	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-59.6	121.3	172.5	176.3	0	0	0	0	108
458	P	45.8	Very low	49.6	Very low	97 Å²	97	144.2 Å²	144.2	63%	0.63	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-70.4	133.1	175.1	-13.6	28.7	0	0	0	109.7	K456 F464	K456-P458 WeakPolarHBondContact O-CD 3.48Å; P458-F464 HydrophobicContact CB-CE2 4.42Å
459	K	49.4	Very low	52	Low	191 Å²	191	141.6 Å²	141.6	83%	0.83	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-65.5	135.8	176.8	-68.8	178.1	175.7	179.4	0	109.8
460	F	39	Very low	54.6	Low	218 Å²	218	139.9 Å²	139.9	96%	0.956	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-39.8	129.5	168.6	-88.9	-102.7	0	0	0	112.5
461	G	46.7	Very low	56.9	Low	81 Å²	81	136.5 Å²	136.5	84%	0.835	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	142.7	-29.4	159.5	0	0	0	0	0	116.3
462	E	44.7	Very low	59.6	Low	148 Å²	148	134.2 Å²	134.2	69%	0.692	70%	0.701	S	S	*	*			trans	-100.5	120	178.8	-76.3	170.9	174	0	0	109.7	F464	E462-F464 HydrophobicContact CB-CD2 4.33Å; E462-F464 HydrophobicContact CB-CE1 4.31Å; E462-F464 HydrophobicContact CB-CE2 3.74Å; E462-F464 HydrophobicContact CB-CZ 3.72Å; E462-F464 WeakPolarHBondContact O-CD2 3.42Å; E462-F464 PolarHBondContact O-N 2.91Å; E462-F464 VanDerWaalsContact OE2-CZ 3.3Å; E462-F464 WeakPolarHBondContact OE2-CZ 3.46Å
463	A	57.3	Low	62.3	Low	103 Å²	103	132.5 Å²	132.5	85%	0.851	69%	0.686	S	S	*	*			trans	-68.9	85.4	173.2	0	0	0	0	0	109	F465	A463-F465 PolarHBondContact O-N 3.44Å
464	F	63.1	Low	64.8	Low	130 Å²	130	130.1 Å²	130.1	57%	0.57	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-69.3	125.9	169.4	-61.4	-75.8	0	0	0	108.5	P458 E462 T466	P458-F464 HydrophobicContact CB-CE2 4.42Å; E462-F464 HydrophobicContact CB-CD2 4.33Å; E462-F464 HydrophobicContact CB-CE1 4.31Å; E462-F464 HydrophobicContact CB-CE2 3.74Å; E462-F464 HydrophobicContact CB-CZ 3.72Å; E462-F464 WeakPolarHBondContact O-CD2 3.42Å; E462-F464 PolarHBondContact O-N 2.91Å; E462-F464 VanDerWaalsContact OE2-CZ 3.3Å; E462-F464 WeakPolarHBondContact OE2-CZ 3.46Å; F464-T466 PolarHBondContact O-N 2.98Å
465	F	69.4	Low	67.6	Low	133 Å²	133	125.5 Å²	125.5	58%	0.583	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-55	124.2	169.7	-87.3	-92.1	0	0	0	109.5	A463 E469 M470 V473	A463-F465 PolarHBondContact O-N 3.44Å; F465-E469 HydrophobicContact CD1-CB 3.62Å; F465-E469 HydrophobicContact CE1-CB 4.33Å; F465-M470 HydrophobicContact CB-CB 4.36Å; F465-V473 HydrophobicContact CD1-CG2 4.26Å; F465-V473 HydrophobicContact CE1-CG2 3.64Å; F465-V473 HydrophobicContact CZ-CG2 4.39Å
466	T	84.1	Confident	70.1	Confident	82 Å²	82	123.3 Å²	123.3	50%	0.503	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-58.6	145.7	168.3	-54.4	0	0	0	0	108.2	F464 R468 E469 M470	F464-T466 PolarHBondContact O-N 2.98Å; T466-R468 HydrophobicContact CG2-CB 4.07Å; T466-R468 CarbonylContact O-C 3.58Å; T466-R468 PolarHBondContact O-N 2.99Å; T466-E469 WeakPolarHBondContact CB-OE2 3.31Å; T466-E469 PolarHBondContact N-OE2 3.27Å; T466-E469 CarbonylContact O-C 3.6Å; T466-E469 WeakPolarHBondContact O-CA 3.48Å; T466-E469 WeakPolarHBondContact O-CB 3.26Å; T466-E469 PolarHBondContact O-N 2.78Å; T466-E469 PolarHBondContact OG1-OE2 3.39Å; T466-E469 VanDerWaalsContact OG1-OE2 3.1Å; T466-M470 PolarHBondContact O-N 3.18Å
467	K	85.9	Confident	72.6	Confident	190 Å²	190	121.4 Å²	121.4	83%	0.826	62%	0.624	S	S	*	*	H	α-helix	trans	-48.2	-34.8	173.8	-172.4	176	-178.6	177.5	0	112.5	A471	K467-A471 WeakPolarHBondContact O-CB 3.46Å; K467-A471 PolarHBondContact O-N 3.43Å
468	R	85.4	Confident	75	Confident	179 Å²	179	119 Å²	119	68%	0.675	61%	0.606	S	S	*	*	H	α-helix	trans	-66.9	-41.6	173	-178.6	179.3	-71.9	-172.1	-2.1	113.4	T466 R472	T466-R468 HydrophobicContact CG2-CB 4.07Å; T466-R468 CarbonylContact O-C 3.58Å; T466-R468 PolarHBondContact O-N 2.99Å; R468-R472 PolarHBondContact O-N 2.98Å
469	E	86.3	Confident	77.2	Confident	75 Å²	75	116.5 Å²	116.5	35%	0.35	59%	0.591	S	S	.	*	H	α-helix	trans	-70.5	-42.2	177.2	-66.5	168.2	151.2	0	0	110.7	F465 T466 A471 R472 V473	F465-E469 HydrophobicContact CD1-CB 3.62Å; F465-E469 HydrophobicContact CE1-CB 4.33Å; T466-E469 WeakPolarHBondContact CB-OE2 3.31Å; T466-E469 PolarHBondContact N-OE2 3.27Å; T466-E469 CarbonylContact O-C 3.6Å; T466-E469 WeakPolarHBondContact O-CA 3.48Å; T466-E469 WeakPolarHBondContact O-CB 3.26Å; T466-E469 PolarHBondContact O-N 2.78Å; T466-E469 PolarHBondContact OG1-OE2 3.39Å; T466-E469 VanDerWaalsContact OG1-OE2 3.1Å; E469-A471 VanDerWaalsContact C-N 3.31Å; E469-A471 PolarHBondContact O-N 2.9Å; E469-R472 PolarHBondContact O-N 2.96Å; E469-R472 VanDerWaalsContact O-N 3.14Å; E469-V473 WeakPolarHBondContact O-CG2 3.47Å; E469-V473 PolarHBondContact O-N 3.11Å
470	M	88	Confident	79.4	Confident	112 Å²	112	114.3 Å²	114.3	55%	0.552	58%	0.579	S	S	*	*	H	α-helix	trans	-60	-41.7	173	-171.5	132	100.9	0	0	111.5	F465 T466 R472 V473 I474	F465-M470 HydrophobicContact CB-CB 4.36Å; T466-M470 PolarHBondContact O-N 3.18Å; M470-R472 PolarHBondContact O-N 3.49Å; M470-V473 PolarHBondContact O-N 2.93Å; M470-I474 HydrophobicContact CG-CD1 3.76Å; M470-I474 HydrophobicContact CG-CG1 4.37Å; M470-I474 WeakPolarHBondContact O-CB 3.13Å; M470-I474 WeakPolarHBondContact O-CD1 3.49Å; M470-I474 WeakPolarHBondContact O-CG1 3.5Å; M470-I474 PolarHBondContact O-N 3.25Å
471	A	88.5	Confident	82.1	Confident	55 Å²	55	108.6 Å²	108.6	46%	0.455	55%	0.553	S	S	.	*	H	α-helix	trans	-62.2	-40.1	174.5	0	0	0	0	0	112.6	K467 E469 I474 A475	K467-A471 WeakPolarHBondContact O-CB 3.46Å; K467-A471 PolarHBondContact O-N 3.43Å; E469-A471 VanDerWaalsContact C-N 3.31Å; E469-A471 PolarHBondContact O-N 2.9Å; A471-I474 PolarHBondContact O-N 2.91Å; A471-A475 VanDerWaalsContact O-CB 3.29Å; A471-A475 WeakPolarHBondContact O-CB 3.37Å; A471-A475 PolarHBondContact O-N 3.3Å
472	R	91.4	Very high	84.2	Confident	141 Å²	141	110.3 Å²	110.3	53%	0.532	54%	0.54	S	S	.	.	H	α-helix	trans	-64.2	-46.5	174	-80.4	-170.3	-69.6	-122.3	3.2	112.1	R468 E469 M470 I474 A475 E476	R468-R472 PolarHBondContact O-N 2.98Å; E469-R472 PolarHBondContact O-N 2.96Å; E469-R472 VanDerWaalsContact O-N 3.14Å; M470-R472 PolarHBondContact O-N 3.49Å; R472-I474 VanDerWaalsContact C-N 3.31Å; R472-I474 PolarHBondContact O-N 3.14Å; R472-A475 PolarHBondContact O-N 3.09Å; R472-E476 VanDerWaalsContact O-CB 3.3Å; R472-E476 WeakPolarHBondContact O-CB 3.4Å; R472-E476 PolarHBondContact O-N 3.4Å
473	V	90.6	Very high	86.5	Confident	69 Å²	69	109 Å²	109	42%	0.418	53%	0.532	S	S	.	.	H	α-helix	trans	-62	-40.3	177.4	171.6	0	0	0	0	111.2	F465 E469 M470 R477	F465-V473 HydrophobicContact CD1-CG2 4.26Å; F465-V473 HydrophobicContact CE1-CG2 3.64Å; F465-V473 HydrophobicContact CZ-CG2 4.39Å; E469-V473 WeakPolarHBondContact O-CG2 3.47Å; E469-V473 PolarHBondContact O-N 3.11Å; M470-V473 PolarHBondContact O-N 2.93Å; V473-R477 WeakPolarHBondContact O-CB 3.25Å; V473-R477 PolarHBondContact O-N 2.83Å
474	I	91.1	Very high	88.3	Confident	86 Å²	86	110.3 Å²	110.3	44%	0.441	52%	0.519	S	S	.	.	H	α-helix	trans	-65.6	-44.5	175.5	-69.1	165.3	0	0	0	110.6	M470 A471 R472 R477 N478	M470-I474 HydrophobicContact CG-CD1 3.76Å; M470-I474 HydrophobicContact CG-CG1 4.37Å; M470-I474 WeakPolarHBondContact O-CB 3.13Å; M470-I474 WeakPolarHBondContact O-CD1 3.49Å; M470-I474 WeakPolarHBondContact O-CG1 3.5Å; M470-I474 PolarHBondContact O-N 3.25Å; A471-I474 PolarHBondContact O-N 2.91Å; R472-I474 VanDerWaalsContact C-N 3.31Å; R472-I474 PolarHBondContact O-N 3.14Å; I474-R477 PolarHBondContact O-N 3.37Å; I474-N478 VanDerWaalsContact O-CB 3.3Å; I474-N478 WeakPolarHBondContact O-CB 3.48Å; I474-N478 PolarHBondContact O-N 2.98Å; I474-N478 PolarHBondContact O-OD1 3.37Å
475	A	91.5	Very high	89.6	Confident	59 Å²	59	108.8 Å²	108.8	49%	0.488	52%	0.516	S	S	.	.	H	α-helix	trans	-63.8	-44.1	178.2	0	0	0	0	0	112	A471 R472 N478 S479	A471-A475 VanDerWaalsContact O-CB 3.29Å; A471-A475 WeakPolarHBondContact O-CB 3.37Å; A471-A475 PolarHBondContact O-N 3.3Å; R472-A475 PolarHBondContact O-N 3.09Å; A475-N478 PolarHBondContact O-N 2.92Å; A475-S479 PolarHBondContact O-N 3.14Å
476	E	93.1	Very high	90.6	Very high	112 Å²	112	107.8 Å²	107.8	52%	0.523	51%	0.513	S	S	.	.	H	α-helix	trans	-64.4	-45.8	176.5	-176.2	168	-154	0	0	111.2	R472 N478 S479 Y480	R472-E476 VanDerWaalsContact O-CB 3.3Å; R472-E476 WeakPolarHBondContact O-CB 3.4Å; R472-E476 PolarHBondContact O-N 3.4Å; E476-N478 VanDerWaalsContact C-N 3.3Å; E476-N478 PolarHBondContact O-N 3.33Å; E476-S479 WeakPolarHBondContact O-CB 3.46Å; E476-S479 PolarHBondContact O-N 3.46Å; E476-Y480 HydrophobicContact CG-CD2 4.12Å; E476-Y480 HydrophobicContact CG-CE2 3.65Å; E476-Y480 WeakPolarHBondContact O-CD2 3.4Å; E476-Y480 PolarHBondContact O-N 2.87Å
477	R	91.8	Very high	91.2	Very high	159 Å²	159	109 Å²	109	60%	0.6	52%	0.516	S	S	*	.	H	α-helix	trans	-58.3	-41	172.5	-179.2	-176.1	168.3	-177.6	-5.8	112	V473 I474 Y480 K481	V473-R477 WeakPolarHBondContact O-CB 3.25Å; V473-R477 PolarHBondContact O-N 2.83Å; I474-R477 PolarHBondContact O-N 3.37Å; R477-Y480 PolarHBondContact O-N 3.13Å; R477-K481 WeakPolarHBondContact O-CG 3.36Å; R477-K481 PolarHBondContact O-N 3.01Å; R477-K481 VanDerWaalsContact O-N 3.12Å
478	N	92.1	Very high	91.5	Very high	79 Å²	79	104.9 Å²	104.9	42%	0.422	50%	0.5	S	S	.	.	H	α-helix	trans	-69.7	-38.1	178.2	-73.7	-8.7	0	0	0	111.6	I474 A475 E476 Y480 K481 E482	I474-N478 VanDerWaalsContact O-CB 3.3Å; I474-N478 WeakPolarHBondContact O-CB 3.48Å; I474-N478 PolarHBondContact O-N 2.98Å; I474-N478 PolarHBondContact O-OD1 3.37Å; A475-N478 PolarHBondContact O-N 2.92Å; E476-N478 VanDerWaalsContact C-N 3.3Å; E476-N478 PolarHBondContact O-N 3.33Å; N478-Y480 VanDerWaalsContact C-N 3.32Å; N478-Y480 PolarHBondContact O-N 3.38Å; N478-K481 WeakPolarHBondContact O-CB 3.32Å; N478-K481 PolarHBondContact O-N 3.01Å; N478-K481 VanDerWaalsContact O-N 3.11Å; N478-E482 PolarHBondContact O-N 3.2Å
479	S	92.8	Very high	91.7	Very high	45 Å²	45	101.3 Å²	101.3	32%	0.315	49%	0.494	S	S	.	.	H	α-helix	trans	-59.3	-42	173.3	-178.9	0	0	0	0	111.9	A475 E476 E482 K483	A475-S479 PolarHBondContact O-N 3.14Å; E476-S479 WeakPolarHBondContact O-CB 3.46Å; E476-S479 PolarHBondContact O-N 3.46Å; S479-E482 PolarHBondContact O-N 2.94Å; S479-K483 WeakPolarHBondContact O-CG 3.27Å; S479-K483 PolarHBondContact O-N 3.4Å
480	Y	95.3	Very high	92	Very high	145 Å²	145	100.2 Å²	100.2	57%	0.569	50%	0.498	S	S	*	.	H	α-helix	trans	-67	-34.9	174.5	-73.4	-64.5	0	0	0	113.1	E476 R477 N478 F484	E476-Y480 HydrophobicContact CG-CD2 4.12Å; E476-Y480 HydrophobicContact CG-CE2 3.65Å; E476-Y480 WeakPolarHBondContact O-CD2 3.4Å; E476-Y480 PolarHBondContact O-N 2.87Å; R477-Y480 PolarHBondContact O-N 3.13Å; N478-Y480 VanDerWaalsContact C-N 3.32Å; N478-Y480 PolarHBondContact O-N 3.38Å; Y480-F484 WeakPolarHBondContact O-CB 3.49Å; Y480-F484 PolarHBondContact O-N 2.71Å
481	K	95	Very high	92	Very high	97 Å²	97	99.7 Å²	99.7	42%	0.422	50%	0.497	S	S	.	.	H	α-helix	trans	-66.2	-41.6	174.4	-75.1	177.7	176	-179.3	0	112.3	R477 N478 F484 L485	R477-K481 WeakPolarHBondContact O-CG 3.36Å; R477-K481 PolarHBondContact O-N 3.01Å; R477-K481 VanDerWaalsContact O-N 3.12Å; N478-K481 WeakPolarHBondContact O-CB 3.32Å; N478-K481 PolarHBondContact O-N 3.01Å; N478-K481 VanDerWaalsContact O-N 3.11Å; K481-F484 PolarHBondContact O-N 3.32Å; K481-L485 WeakPolarHBondContact O-CG 3.34Å; K481-L485 PolarHBondContact O-N 2.86Å
482	E	91.4	Very high	92.1	Very high	118 Å²	118	105 Å²	105	55%	0.551	51%	0.505	S	S	*	.	H	α-helix	trans	-62.2	-49.8	176.4	-174.2	171.8	-154.1	0	0	110.6	N478 S479 F484 L485 E486	N478-E482 PolarHBondContact O-N 3.2Å; S479-E482 PolarHBondContact O-N 2.94Å; E482-F484 VanDerWaalsContact C-N 3.27Å; E482-F484 PolarHBondContact O-N 3.42Å; E482-L485 WeakPolarHBondContact O-CB 3.42Å; E482-L485 PolarHBondContact O-N 3.32Å; E482-L485 VanDerWaalsContact O-N 3.08Å; E482-E486 WeakPolarHBondContact O-CG 3.39Å; E482-E486 PolarHBondContact O-N 3.16Å
483	K	93.1	Very high	91.9	Very high	119 Å²	119	103 Å²	103	52%	0.517	50%	0.504	S	S	.	.	H	α-helix	trans	-58.3	-36.2	174.5	-71.5	176	-178.3	174.8	0	113.4	S479 L487	S479-K483 WeakPolarHBondContact O-CG 3.27Å; S479-K483 PolarHBondContact O-N 3.4Å; K483-L487 VanDerWaalsContact O-CB 3.32Å; K483-L487 WeakPolarHBondContact O-CB 3.41Å; K483-L487 PolarHBondContact O-N 2.87Å
484	F	93.8	Very high	91.6	Very high	132 Å²	132	104.4 Å²	104.4	58%	0.579	51%	0.507	S	S	*	.	H	α-helix	trans	-68.6	-42.1	175.8	178.6	-95.3	0	0	0	111.9	Y480 K481 E482 L487 Q488	Y480-F484 WeakPolarHBondContact O-CB 3.49Å; Y480-F484 PolarHBondContact O-N 2.71Å; K481-F484 PolarHBondContact O-N 3.32Å; E482-F484 VanDerWaalsContact C-N 3.27Å; E482-F484 PolarHBondContact O-N 3.42Å; F484-L487 PolarHBondContact O-N 2.93Å; F484-Q488 WeakPolarHBondContact O-CB 3.26Å; F484-Q488 PolarHBondContact O-N 3.14Å
485	L	90.1	Very high	91.1	Very high	98 Å²	98	105.9 Å²	105.9	51%	0.513	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-46.6	174.5	-79	158.8	0	0	0	111.3	K481 E482 L487 Q488 D489	K481-L485 WeakPolarHBondContact O-CG 3.34Å; K481-L485 PolarHBondContact O-N 2.86Å; E482-L485 WeakPolarHBondContact O-CB 3.42Å; E482-L485 PolarHBondContact O-N 3.32Å; E482-L485 VanDerWaalsContact O-N 3.08Å; L485-L487 VanDerWaalsContact C-N 3.31Å; L485-L487 PolarHBondContact O-N 3.41Å; L485-Q488 PolarHBondContact O-N 3.1Å; L485-Q488 VanDerWaalsContact O-N 3.17Å; L485-D489 PolarHBondContact O-N 3.34Å
486	E	92.2	Very high	90.8	Very high	112 Å²	112	110.9 Å²	110.9	52%	0.523	52%	0.519	S	S	.	.	H	α-helix	trans	-56.8	-43.9	174.4	-72.2	173.7	-177.3	0	0	111.9	E482 D489 A490	E482-E486 WeakPolarHBondContact O-CG 3.39Å; E482-E486 PolarHBondContact O-N 3.16Å; E486-D489 PolarHBondContact O-N 3.09Å; E486-A490 VanDerWaalsContact O-CB 3.31Å; E486-A490 WeakPolarHBondContact O-CB 3.38Å; E486-A490 PolarHBondContact O-N 3.49Å
487	L	95.2	Very high	90.2	Very high	107 Å²	107	109.9 Å²	109.9	56%	0.56	52%	0.516	S	S	*	.	H	α-helix	trans	-66.1	-39.7	177.7	-174.3	64.8	0	0	0	111.9	K483 F484 L485 A490 L491	K483-L487 VanDerWaalsContact O-CB 3.32Å; K483-L487 WeakPolarHBondContact O-CB 3.41Å; K483-L487 PolarHBondContact O-N 2.87Å; F484-L487 PolarHBondContact O-N 2.93Å; L485-L487 VanDerWaalsContact C-N 3.31Å; L485-L487 PolarHBondContact O-N 3.41Å; L487-A490 PolarHBondContact O-N 2.82Å; L487-L491 WeakPolarHBondContact O-CB 3.47Å; L487-L491 WeakPolarHBondContact O-CG 3.46Å; L487-L491 PolarHBondContact O-N 3.06Å
488	Q	91.9	Very high	89.6	Confident	104 Å²	104	108.2 Å²	108.2	49%	0.486	51%	0.51	S	S	.	.	H	α-helix	trans	-66	-41.2	176.6	-171.2	176.1	3.9	0	0	111.5	F484 L485 L491 R492	F484-Q488 WeakPolarHBondContact O-CB 3.26Å; F484-Q488 PolarHBondContact O-N 3.14Å; L485-Q488 PolarHBondContact O-N 3.1Å; L485-Q488 VanDerWaalsContact O-N 3.17Å; Q488-L491 PolarHBondContact O-N 3.28Å; Q488-R492 WeakPolarHBondContact O-CB 3.25Å; Q488-R492 PolarHBondContact O-N 2.92Å
489	D	90	Very high	88.8	Confident	104 Å²	104	107.2 Å²	107.2	56%	0.556	51%	0.513	S	S	*	.	H	α-helix	trans	-67	-40.3	175.7	-77.7	-16.8	0	0	0	111.7	L485 E486 R492 L493	L485-D489 PolarHBondContact O-N 3.34Å; E486-D489 PolarHBondContact O-N 3.09Å; D489-R492 PolarHBondContact O-N 3.48Å; D489-L493 WeakPolarHBondContact O-CB 3.44Å; D489-L493 PolarHBondContact O-N 2.91Å
490	A	92.5	Very high	88.1	Confident	52 Å²	52	109.5 Å²	109.5	43%	0.43	52%	0.522	S	S	.	.	H	α-helix	trans	-63.3	-42.4	173.8	0	0	0	0	0	112.3	E486 L487 L493 M494	E486-A490 VanDerWaalsContact O-CB 3.31Å; E486-A490 WeakPolarHBondContact O-CB 3.38Å; E486-A490 PolarHBondContact O-N 3.49Å; L487-A490 PolarHBondContact O-N 2.82Å; A490-L493 PolarHBondContact O-N 3.47Å; A490-M494 WeakPolarHBondContact O-CB 3.47Å; A490-M494 PolarHBondContact O-N 3.43Å
491	L	88.1	Confident	86.8	Confident	101 Å²	101	108.1 Å²	108.1	53%	0.529	52%	0.52	S	S	.	.	H	α-helix	trans	-63.4	-43.4	173.5	-79.5	173	0	0	0	111.4	L487 Q488 L493 M494 E495	L487-L491 WeakPolarHBondContact O-CB 3.47Å; L487-L491 WeakPolarHBondContact O-CG 3.46Å; L487-L491 PolarHBondContact O-N 3.06Å; Q488-L491 PolarHBondContact O-N 3.28Å; L491-L493 VanDerWaalsContact C-N 3.32Å; L491-L493 PolarHBondContact O-N 3.4Å; L491-M494 PolarHBondContact O-N 2.82Å; L491-E495 WeakPolarHBondContact O-CB 3.29Å; L491-E495 PolarHBondContact O-N 3.34Å
492	R	91.1	Very high	85	Confident	167 Å²	167	106.8 Å²	106.8	63%	0.63	52%	0.523	S	S	*	.	H	α-helix	trans	-64.8	-36.4	177	-171	178.8	-178.7	136.5	1.7	112.2	Q488 D489 E495 R496	Q488-R492 WeakPolarHBondContact O-CB 3.25Å; Q488-R492 PolarHBondContact O-N 2.92Å; D489-R492 PolarHBondContact O-N 3.48Å; R492-E495 PolarHBondContact O-N 2.94Å; R492-R496 WeakPolarHBondContact O-CB 3.45Å; R492-R496 PolarHBondContact O-N 2.79Å
493	L	87.7	Confident	83.1	Confident	99 Å²	99	104.1 Å²	104.1	52%	0.518	52%	0.518	S	S	.	.	H	α-helix	trans	-67.2	-43.9	174.3	-172.6	149.2	0	0	0	110.7	D489 A490 L491 E495 R496 L497	D489-L493 WeakPolarHBondContact O-CB 3.44Å; D489-L493 PolarHBondContact O-N 2.91Å; A490-L493 PolarHBondContact O-N 3.47Å; L491-L493 VanDerWaalsContact C-N 3.32Å; L491-L493 PolarHBondContact O-N 3.4Å; L493-E495 VanDerWaalsContact C-N 3.32Å; L493-E495 PolarHBondContact O-N 3.39Å; L493-R496 WeakPolarHBondContact O-CB 3.46Å; L493-R496 PolarHBondContact O-N 3.39Å; L493-L497 HydrophobicContact CD2-CD1 3.64Å; L493-L497 HydrophobicContact CD2-CG 4.19Å; L493-L497 WeakPolarHBondContact O-CG 3.4Å; L493-L497 PolarHBondContact O-N 2.87Å
494	M	84.6	Confident	81	Confident	98 Å²	98	106.9 Å²	106.9	48%	0.483	53%	0.525	S	S	.	.	H	α-helix	trans	-61.9	-39	174.1	-171.6	-176.7	-59.8	0	0	112.1	A490 L491 L497 R498	A490-M494 WeakPolarHBondContact O-CB 3.47Å; A490-M494 PolarHBondContact O-N 3.43Å; L491-M494 PolarHBondContact O-N 2.82Å; M494-L497 PolarHBondContact O-N 3.06Å; M494-R498 WeakPolarHBondContact O-CB 3.29Å; M494-R498 PolarHBondContact O-N 3.48Å
495	E	80.5	Confident	78.8	Confident	117 Å²	117	106.6 Å²	106.6	55%	0.547	53%	0.529	S	S	.	.	H	α-helix	trans	-65	-40.6	174.7	-156.9	71.1	-171.9	0	0	111.1	L491 R492 L493 R498 A499	L491-E495 WeakPolarHBondContact O-CB 3.29Å; L491-E495 PolarHBondContact O-N 3.34Å; R492-E495 PolarHBondContact O-N 2.94Å; L493-E495 VanDerWaalsContact C-N 3.32Å; L493-E495 PolarHBondContact O-N 3.39Å; E495-R498 PolarHBondContact O-N 3.31Å; E495-R498 IonicContact OE2-NH1 2.81Å; E495-R498 PolarHBondContact OE2-NH1 3.16Å; E495-A499 WeakPolarHBondContact O-CB 3.44Å; E495-A499 PolarHBondContact O-N 3.35Å
496	R	84.9	Confident	76.7	Confident	163 Å²	163	110 Å²	110	62%	0.615	54%	0.542	S	S	*	.	H	α-helix	trans	-60.9	-45	172.9	-117.2	180	-79	173.7	-5	111.8	R492 L493 R498 A499 D500	R492-R496 WeakPolarHBondContact O-CB 3.45Å; R492-R496 PolarHBondContact O-N 2.79Å; L493-R496 WeakPolarHBondContact O-CB 3.46Å; L493-R496 PolarHBondContact O-N 3.39Å; R496-R498 VanDerWaalsContact C-N 3.34Å; R496-A499 PolarHBondContact O-N 3.37Å; R496-D500 WeakPolarHBondContact O-CB 3.4Å; R496-D500 PolarHBondContact O-N 3Å
497	L	79.1	Confident	74.4	Confident	91 Å²	91	110.6 Å²	110.6	48%	0.476	55%	0.553	S	S	.	*	H	α-helix	trans	-64.3	-38.2	175.3	-71.4	173.5	0	0	0	112	L493 M494 D500 H501	L493-L497 HydrophobicContact CD2-CD1 3.64Å; L493-L497 HydrophobicContact CD2-CG 4.19Å; L493-L497 WeakPolarHBondContact O-CG 3.4Å; L493-L497 PolarHBondContact O-N 2.87Å; M494-L497 PolarHBondContact O-N 3.06Å; L497-D500 PolarHBondContact O-N 3.21Å; L497-H501 WeakPolarHBondContact O-CB 3.17Å; L497-H501 PolarHBondContact O-CD2 3.14Å; L497-H501 PolarHBondContact O-N 2.93Å
498	R	80.5	Confident	71.9	Confident	124 Å²	124	109.3 Å²	109.3	47%	0.468	55%	0.553	S	S	.	*	H	α-helix	trans	-67.3	-39.7	175.8	-176.6	178.1	-69	104.3	6	112.1	M494 E495 R496 S502	M494-R498 WeakPolarHBondContact O-CB 3.29Å; M494-R498 PolarHBondContact O-N 3.48Å; E495-R498 PolarHBondContact O-N 3.31Å; E495-R498 IonicContact OE2-NH1 2.81Å; E495-R498 PolarHBondContact OE2-NH1 3.16Å; R496-R498 VanDerWaalsContact C-N 3.34Å; R498-S502 PolarHBondContact O-N 3.01Å; R498-S502 PolarHBondContact O-OG 3.19Å
499	A	75.2	Confident	69.5	Low	59 Å²	59	110.6 Å²	110.6	49%	0.488	57%	0.568	S	S	.	*	H	α-helix	trans	-65.2	-43.3	175	0	0	0	0	0	111.2	E495 R496 S502 S503	E495-A499 WeakPolarHBondContact O-CB 3.44Å; E495-A499 PolarHBondContact O-N 3.35Å; R496-A499 PolarHBondContact O-N 3.37Å; A499-S502 PolarHBondContact O-N 3.11Å; A499-S503 PolarHBondContact O-N 2.9Å; A499-S503 PolarHBondContact O-OG 2.91Å; A499-S503 VanDerWaalsContact O-OG 3.06Å
500	D	77.6	Confident	67.1	Low	93 Å²	93	109.4 Å²	109.4	50%	0.497	57%	0.572	S	S	.	*	H	α-helix	trans	-65.6	-37.4	177.4	-164.9	41.8	0	0	0	112.2	R496 L497 S503 R504	R496-D500 WeakPolarHBondContact O-CB 3.4Å; R496-D500 PolarHBondContact O-N 3Å; L497-D500 PolarHBondContact O-N 3.21Å; D500-S503 WeakPolarHBondContact CA-OG 3.25Å; D500-S503 PolarHBondContact O-OG 3.06Å; D500-S503 VanDerWaalsContact O-OG 3.07Å; D500-R504 WeakPolarHBondContact O-CB 3.22Å; D500-R504 PolarHBondContact O-N 3.28Å
501	H	68.1	Low	64.4	Low	116 Å²	116	115 Å²	115	54%	0.537	60%	0.595	S	S	.	*	H	α-helix	trans	-67.5	-36.4	171	-82.6	-59.5	0	0	0	113.1	L497 L505	L497-H501 WeakPolarHBondContact O-CB 3.17Å; L497-H501 PolarHBondContact O-CD2 3.14Å; L497-H501 PolarHBondContact O-N 2.93Å; H501-L505 WeakPolarHBondContact O-CB 3.37Å; H501-L505 WeakPolarHBondContact O-CD1 3.48Å; H501-L505 WeakPolarHBondContact O-CG 3.17Å; H501-L505 PolarHBondContact O-N 2.85Å
502	S	58	Low	61.7	Low	68 Å²	68	113.9 Å²	113.9	48%	0.476	61%	0.608	S	S	.	*	H	α-helix	trans	-74.4	-40.6	178.7	-67.2	0	0	0	0	112.7	R498 A499 R504 L505 Q506	R498-S502 PolarHBondContact O-N 3.01Å; R498-S502 PolarHBondContact O-OG 3.19Å; A499-S502 PolarHBondContact O-N 3.11Å; S502-R504 VanDerWaalsContact C-N 3.33Å; S502-L505 PolarHBondContact O-N 3.33Å; S502-Q506 PolarHBondContact O-N 2.81Å; S502-Q506 VanDerWaalsContact O-N 3.11Å
503	S	51.8	Low	59.1	Low	63 Å²	63	113.8 Å²	113.8	44%	0.441	61%	0.612	S	S	.	*	H	α-helix	trans	-65.2	-38.6	175.1	55.3	0	0	0	0	111.2	A499 D500 V507	A499-S503 PolarHBondContact O-N 2.9Å; A499-S503 PolarHBondContact O-OG 2.91Å; A499-S503 VanDerWaalsContact O-OG 3.06Å; D500-S503 WeakPolarHBondContact CA-OG 3.25Å; D500-S503 PolarHBondContact O-OG 3.06Å; D500-S503 VanDerWaalsContact O-OG 3.07Å; S503-V507 WeakPolarHBondContact O-CG2 3.17Å; S503-V507 PolarHBondContact O-N 2.8Å
504	R	48.4	Very low	56.7	Low	177 Å²	177	117.4 Å²	117.4	67%	0.668	63%	0.627	S	S	*	*	H	α-helix	trans	-74	-27.1	178.3	-167	168.8	153.1	-169.5	-5.5	113.1	D500 S502 S508	D500-R504 WeakPolarHBondContact O-CB 3.22Å; D500-R504 PolarHBondContact O-N 3.28Å; S502-R504 VanDerWaalsContact C-N 3.33Å; R504-S508 WeakPolarHBondContact O-CB 3.42Å; R504-S508 PolarHBondContact O-OG 3.47Å
505	L	47	Very low	54.7	Low	126 Å²	126	122.7 Å²	122.7	66%	0.66	64%	0.641	S	S	*	*	H	α-helix	trans	-81.9	-25.1	175.2	-74.9	165.3	0	0	0	113.7	H501 S502	H501-L505 WeakPolarHBondContact O-CB 3.37Å; H501-L505 WeakPolarHBondContact O-CD1 3.48Å; H501-L505 WeakPolarHBondContact O-CG 3.17Å; H501-L505 PolarHBondContact O-N 2.85Å; S502-L505 PolarHBondContact O-N 3.33Å
506	Q	45.6	Very low	53	Low	169 Å²	169	127 Å²	127	79%	0.79	65%	0.652	S	S	*	*	H	α-helix	trans	-82.3	-21.7	176.1	-80.8	-168.9	-20.2	0	0	114.4	S502	S502-Q506 PolarHBondContact O-N 2.81Å; S502-Q506 VanDerWaalsContact O-N 3.11Å
507	V	45.7	Very low	51.8	Low	125 Å²	125	124.7 Å²	124.7	76%	0.758	66%	0.656	S	S	*	*	S	Bend	trans	-88.2	-10.6	177.2	178.4	0	0	0	0	112.7	S503	S503-V507 WeakPolarHBondContact O-CG2 3.17Å; S503-V507 PolarHBondContact O-N 2.8Å
508	S	42.3	Very low	50.6	Low	79 Å²	79	123.2 Å²	123.2	55%	0.552	65%	0.652	S	S	*	*			trans	-106.7	20.7	-168.1	-48.8	0	0	0	0	115.5	R504	R504-S508 WeakPolarHBondContact O-CB 3.42Å; R504-S508 PolarHBondContact O-OG 3.47Å
509	T	40.7	Very low	49.3	Very low	132 Å²	132	128.4 Å²	128.4	81%	0.81	67%	0.672	S	S	*	*	S	Bend	trans	-98.7	18.6	176.1	39.8	0	0	0	0	114.2
510	A	39.3	Very low	48.7	Very low	78 Å²	78	128.9 Å²	128.9	65%	0.645	67%	0.671	S	S	*	*	S	Bend	trans	-132.9	119.4	165.1	0	0	0	0	0	108.3
511	D	36.5	Very low	47.7	Very low	170 Å²	170	131.2 Å²	131.2	91%	0.909	68%	0.677	S	S	*	*	S	Bend	trans	60.9	94.1	168.5	-67	-20.9	0	0	0	119.5
512	G	32.2	Very low	46.9	Very low	77 Å²	77	132.9 Å²	132.9	79%	0.794	68%	0.683	S	S	*	*				68.3	73.5	121.8	0	0	0	0	0	119.8
513	F	35.4	Very low	46.9	Very low	165 Å²	165	132.6 Å²	132.6	72%	0.724	68%	0.681	S	S	*	*			trans	-167.2	89.2	135.9	-139.6	-88.9	0	0	0	111.5	R515	F513-R515 HydrophobicContact CD1-CG 3.97Å; F513-R515 HydrophobicContact CE1-CG 3.84Å; F513-R515 VanDerWaalsContact CE1-NE 3.33Å; F513-R515 PolarHBondContact O-N 3Å
514	E	38.2	Very low	47.1	Very low	176 Å²	176	134.2 Å²	134.2	82%	0.822	69%	0.688	S	S	*	*			trans	-76.9	100.8	169.9	-72.6	-146.5	163.8	0	0	110.7
515	R	42.6	Very low	47.8	Very low	208 Å²	208	129.1 Å²	129.1	79%	0.785	68%	0.677	S	S	*	*			trans	-101.2	98.8	153.8	-78.9	-170.8	-154.6	-123	-2.1	109.4	F513 V517	F513-R515 HydrophobicContact CD1-CG 3.97Å; F513-R515 HydrophobicContact CE1-CG 3.84Å; F513-R515 VanDerWaalsContact CE1-NE 3.33Å; F513-R515 PolarHBondContact O-N 3Å; R515-V517 PolarHBondContact O-N 3.31Å
516	W	45.1	Very low	48.4	Very low	208 Å²	208	129.5 Å²	129.5	79%	0.788	68%	0.675	S	S	*	*			trans	-49.1	118.4	161.9	-110.6	52.2	0	0	0	110.7	P518	W516-P518 WeakPolarHBondContact O-CD 3.3Å
517	V	57.7	Low	49	Very low	115 Å²	115	125.1 Å²	125.1	70%	0.697	66%	0.663	S	S	*	*			trans	-90.4	110.4	153.9	177.5	0	0	0	0	106.1	R515 R519	R515-V517 PolarHBondContact O-N 3.31Å; V517-R519 PolarHBondContact O-N 3.34Å
518	P	55.5	Low	49.3	Very low	59 Å²	59	121.1 Å²	121.1	38%	0.383	65%	0.647	S	S	.	*			trans	-60	130.6	-177.7	-25.4	35.8	0	0	0	111.4	W516 S520 F521	W516-P518 WeakPolarHBondContact O-CD 3.3Å; P518-S520 VanDerWaalsContact CB-OG 3.31Å; P518-S520 WeakPolarHBondContact CB-OG 3.29Å; P518-S520 PolarHBondContact O-N 2.88Å; P518-F521 PolarHBondContact O-N 3.36Å
519	R	51.8	Low	49.8	Very low	234 Å²	234	121.4 Å²	121.4	88%	0.883	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.4	-18.6	171.4	-86.7	179.8	169.7	160.3	-2.3	113.7	V517 F521 F522 S523	V517-R519 PolarHBondContact O-N 3.34Å; R519-F521 PolarHBondContact O-N 3.27Å; R519-F522 PolarHBondContact O-N 2.93Å; R519-S523 PolarHBondContact O-N 3.44Å
520	S	63	Low	50.4	Low	69 Å²	69	119 Å²	119	48%	0.483	63%	0.627	S	S	.	*	H	α-helix	trans	-65.8	-20.9	176.1	55.3	0	0	0	0	114.3	P518 S523 T524	P518-S520 VanDerWaalsContact CB-OG 3.31Å; P518-S520 WeakPolarHBondContact CB-OG 3.29Å; P518-S520 PolarHBondContact O-N 2.88Å; S520-S523 VanDerWaalsContact CA-OG 3.31Å; S520-S523 WeakPolarHBondContact CA-OG 3.5Å; S520-S523 PolarHBondContact O-OG 2.71Å; S520-T524 WeakPolarHBondContact O-CB 3.42Å; S520-T524 PolarHBondContact O-N 3.27Å; S520-T524 VanDerWaalsContact O-N 3.1Å; S520-T524 PolarHBondContact O-OG1 3.43Å
521	F	57.1	Low	51	Low	141 Å²	141	116.9 Å²	116.9	62%	0.618	61%	0.613	S	S	*	*	H	α-helix	trans	-69.1	-44.2	176.4	-158.9	-93.8	0	0	0	110.8	P518 R519 T524 V525	P518-F521 PolarHBondContact O-N 3.36Å; R519-F521 PolarHBondContact O-N 3.27Å; F521-T524 PolarHBondContact O-N 3.13Å; F521-V525 HydrophobicContact CD1-CG2 4.2Å; F521-V525 HydrophobicContact CE1-CG2 4.07Å; F521-V525 WeakPolarHBondContact O-CG2 3.43Å; F521-V525 PolarHBondContact O-N 3.05Å
522	F	52	Low	51.5	Low	152 Å²	152	114.2 Å²	114.2	67%	0.667	60%	0.598	S	S	*	*	H	α-helix	trans	-70.5	-35	178.4	-84.1	-84.1	0	0	0	112.9	R519 T524 Q526	R519-F522 PolarHBondContact O-N 2.93Å; F522-T524 VanDerWaalsContact C-N 3.33Å; F522-Q526 VanDerWaalsContact O-CB 3.22Å; F522-Q526 WeakPolarHBondContact O-CB 3.46Å; F522-Q526 PolarHBondContact O-N 3.21Å
523	S	57.3	Low	52	Low	61 Å²	61	117.7 Å²	117.7	43%	0.427	59%	0.592	S	S	.	*	H	α-helix	trans	-65.8	-37.4	172.4	58.9	0	0	0	0	111.9	R519 S520 Q526 S527	R519-S523 PolarHBondContact O-N 3.44Å; S520-S523 VanDerWaalsContact CA-OG 3.31Å; S520-S523 WeakPolarHBondContact CA-OG 3.5Å; S520-S523 PolarHBondContact O-OG 2.71Å; S523-Q526 PolarHBondContact O-N 3.19Å; S523-S527 VanDerWaalsContact O-CB 3.24Å; S523-S527 WeakPolarHBondContact O-CB 3.24Å; S523-S527 PolarHBondContact O-N 3.3Å; S523-S527 PolarHBondContact O-OG 2.93Å
524	T	56.8	Low	52.5	Low	97 Å²	97	113.4 Å²	113.4	60%	0.595	58%	0.582	S	S	*	*	H	α-helix	trans	-69.5	-38.9	179.5	-55.6	0	0	0	0	112.1	S520 F521 F522 G528	S520-T524 WeakPolarHBondContact O-CB 3.42Å; S520-T524 PolarHBondContact O-N 3.27Å; S520-T524 VanDerWaalsContact O-N 3.1Å; S520-T524 PolarHBondContact O-OG1 3.43Å; F521-T524 PolarHBondContact O-N 3.13Å; F522-T524 VanDerWaalsContact C-N 3.33Å; T524-G528 PolarHBondContact O-N 2.82Å
525	V	62.2	Low	52.9	Low	70 Å²	70	109.3 Å²	109.3	42%	0.424	57%	0.569	S	S	.	*	H	α-helix	trans	-71.3	-38.9	175.8	179.9	0	0	0	0	111.1	F521 G528 L529	F521-V525 HydrophobicContact CD1-CG2 4.2Å; F521-V525 HydrophobicContact CE1-CG2 4.07Å; F521-V525 WeakPolarHBondContact O-CG2 3.43Å; F521-V525 PolarHBondContact O-N 3.05Å; V525-G528 PolarHBondContact O-N 3.33Å; V525-L529 HydrophobicContact CG1-CD1 3.98Å; V525-L529 WeakPolarHBondContact O-CB 3.38Å; V525-L529 WeakPolarHBondContact O-CG 3.24Å; V525-L529 PolarHBondContact O-N 2.83Å
526	Q	59.6	Low	52.7	Low	135 Å²	135	107.8 Å²	107.8	63%	0.631	57%	0.569	S	S	*	*	H	α-helix	trans	-68.1	-40.2	176	-171.4	163.5	-13	0	0	111.7	F522 S523 L529 T530	F522-Q526 VanDerWaalsContact O-CB 3.22Å; F522-Q526 WeakPolarHBondContact O-CB 3.46Å; F522-Q526 PolarHBondContact O-N 3.21Å; S523-Q526 PolarHBondContact O-N 3.19Å; Q526-L529 PolarHBondContact O-N 3.11Å; Q526-T530 VanDerWaalsContact O-CG2 3.31Å; Q526-T530 WeakPolarHBondContact O-CG2 3.39Å; Q526-T530 PolarHBondContact O-N 3.35Å; Q526-T530 PolarHBondContact O-OG1 3.48Å; Q526-T530 VanDerWaalsContact O-OG1 3.09Å
527	S	57.6	Low	52.4	Low	77 Å²	77	105.5 Å²	105.5	54%	0.538	57%	0.572	S	S	.	*	H	α-helix	trans	-65.4	-39.8	172.2	-66.6	0	0	0	0	112.3	S523 T530 G531	S523-S527 VanDerWaalsContact O-CB 3.24Å; S523-S527 WeakPolarHBondContact O-CB 3.24Å; S523-S527 PolarHBondContact O-N 3.3Å; S523-S527 PolarHBondContact O-OG 2.93Å; S527-T530 VanDerWaalsContact CA-OG1 3.32Å; S527-T530 WeakPolarHBondContact CA-OG1 3.11Å; S527-T530 PolarHBondContact O-N 3.46Å; S527-T530 PolarHBondContact O-OG1 3Å; S527-G531 PolarHBondContact O-N 3.46Å
528	G	53.4	Low	51.7	Low	40 Å²	40	108.4 Å²	108.4	41%	0.412	58%	0.578	S	S	.	*	H	α-helix	trans	-63.9	-41.3	174.8	0	0	0	0	0	112.8	T524 V525 G531 L532	T524-G528 PolarHBondContact O-N 2.82Å; V525-G528 PolarHBondContact O-N 3.33Å; G528-G531 PolarHBondContact O-N 3.43Å; G528-L532 WeakPolarHBondContact O-CG 3.49Å; G528-L532 PolarHBondContact O-N 3.03Å; G528-L532 VanDerWaalsContact O-N 3.12Å
529	L	51.9	Low	50.8	Low	86 Å²	86	107.8 Å²	107.8	45%	0.45	58%	0.577	S	S	.	*	H	α-helix	trans	-69.3	-41.9	175.1	-76.5	166.3	0	0	0	111.7	V525 Q526 G531 L532 F533	V525-L529 HydrophobicContact CG1-CD1 3.98Å; V525-L529 WeakPolarHBondContact O-CB 3.38Å; V525-L529 WeakPolarHBondContact O-CG 3.24Å; V525-L529 PolarHBondContact O-N 2.83Å; Q526-L529 PolarHBondContact O-N 3.11Å; L529-G531 PolarHBondContact O-N 3.31Å; L529-L532 PolarHBondContact O-N 2.97Å; L529-L532 VanDerWaalsContact O-N 3.09Å; L529-F533 HydrophobicContact CB-CD2 4.49Å; L529-F533 HydrophobicContact CB-CE2 4.48Å; L529-F533 HydrophobicContact CD2-CE2 4.41Å; L529-F533 WeakPolarHBondContact O-CD2 3.46Å; L529-F533 PolarHBondContact O-N 3.03Å
530	T	54.1	Low	50.4	Low	81 Å²	81	102.7 Å²	102.7	50%	0.497	57%	0.572	S	S	.	*	H	α-helix	trans	-64.1	-29.3	175.7	53.5	0	0	0	0	113.1	Q526 S527 S534	Q526-T530 VanDerWaalsContact O-CG2 3.31Å; Q526-T530 WeakPolarHBondContact O-CG2 3.39Å; Q526-T530 PolarHBondContact O-N 3.35Å; Q526-T530 PolarHBondContact O-OG1 3.48Å; Q526-T530 VanDerWaalsContact O-OG1 3.09Å; S527-T530 VanDerWaalsContact CA-OG1 3.32Å; S527-T530 WeakPolarHBondContact CA-OG1 3.11Å; S527-T530 PolarHBondContact O-N 3.46Å; S527-T530 PolarHBondContact O-OG1 3Å; T530-S534 PolarHBondContact O-N 2.97Å; T530-S534 VanDerWaalsContact O-N 3.11Å; T530-S534 PolarHBondContact O-OG 2.84Å; T530-S534 VanDerWaalsContact O-OG 3.12Å
531	G	51	Low	49.2	Very low	33 Å²	33	104.7 Å²	104.7	34%	0.34	58%	0.583	S	S	.	*	H	α-helix	trans	-73.9	-29.5	172.4	0	0	0	0	0	113.8	S527 G528 L529 S534 T535	S527-G531 PolarHBondContact O-N 3.46Å; G528-G531 PolarHBondContact O-N 3.43Å; L529-G531 PolarHBondContact O-N 3.31Å; G531-S534 PolarHBondContact O-OG 2.98Å; G531-T535 VanDerWaalsContact O-CG2 3.3Å; G531-T535 WeakPolarHBondContact O-CG2 3.41Å; G531-T535 PolarHBondContact O-N 3.15Å; G531-T535 PolarHBondContact O-OG1 2.8Å
532	L	46.9	Very low	48.1	Very low	115 Å²	115	104.9 Å²	104.9	60%	0.602	59%	0.59	S	S	*	*	H	α-helix	trans	-77.7	-31.6	173.1	-69.5	172.5	0	0	0	112.3	G528 L529 T535 F536	G528-L532 WeakPolarHBondContact O-CG 3.49Å; G528-L532 PolarHBondContact O-N 3.03Å; G528-L532 VanDerWaalsContact O-N 3.12Å; L529-L532 PolarHBondContact O-N 2.97Å; L529-L532 VanDerWaalsContact O-N 3.09Å; L532-T535 WeakPolarHBondContact CA-OG1 3.47Å; L532-T535 PolarHBondContact O-OG1 3.27Å; L532-F536 PolarHBondContact O-N 3.2Å
533	F	43.8	Very low	47.3	Very low	150 Å²	150	102.2 Å²	102.2	66%	0.658	60%	0.596	S	S	*	*	H	α-helix	trans	-75.9	-34.8	175.6	-79.9	-70.3	0	0	0	112.9	L529 F536	L529-F533 HydrophobicContact CB-CD2 4.49Å; L529-F533 HydrophobicContact CB-CE2 4.48Å; L529-F533 HydrophobicContact CD2-CE2 4.41Å; L529-F533 WeakPolarHBondContact O-CD2 3.46Å; L529-F533 PolarHBondContact O-N 3.03Å; F533-F536 PolarHBondContact O-N 3.06Å
534	S	44.3	Very low	46.4	Very low	75 Å²	75	104.2 Å²	104.2	52%	0.524	61%	0.61	S	S	.	*	H	α-helix	trans	-73.9	-25.6	176.3	59.9	0	0	0	0	113.6	T530 G531 F536	T530-S534 PolarHBondContact O-N 2.97Å; T530-S534 VanDerWaalsContact O-N 3.11Å; T530-S534 PolarHBondContact O-OG 2.84Å; T530-S534 VanDerWaalsContact O-OG 3.12Å; G531-S534 PolarHBondContact O-OG 2.98Å; S534-F536 VanDerWaalsContact C-N 3.35Å
535	T	46.7	Very low	45.3	Very low	89 Å²	89	105.5 Å²	105.5	55%	0.546	62%	0.618	S	S	.	*	H	α-helix	trans	-77.9	-21	173.4	45.8	0	0	0	0	112.8	G531 L532	G531-T535 VanDerWaalsContact O-CG2 3.3Å; G531-T535 WeakPolarHBondContact O-CG2 3.41Å; G531-T535 PolarHBondContact O-N 3.15Å; G531-T535 PolarHBondContact O-OG1 2.8Å; L532-T535 WeakPolarHBondContact CA-OG1 3.47Å; L532-T535 PolarHBondContact O-OG1 3.27Å
536	F	38.7	Very low	44.1	Very low	177 Å²	177	110.2 Å²	110.2	78%	0.776	64%	0.64	S	S	*	*	H	α-helix	trans	-80.6	-28.5	179	-137.6	-95.6	0	0	0	113.4	L532 F533 S534	L532-F536 PolarHBondContact O-N 3.2Å; F533-F536 PolarHBondContact O-N 3.06Å; S534-F536 VanDerWaalsContact C-N 3.35Å
537	D	39.8	Very low	42.9	Very low	159 Å²	159	109.5 Å²	109.5	85%	0.85	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-8.8	-176.7	-122.3	-5.8	0	0	0	113.9
538	Q	41.4	Very low	41.8	Very low	177 Å²	177	111.5 Å²	111.5	83%	0.827	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	3.9	178.9	-157.3	157.2	19.2	0	0	113.5	V540	Q538-V540 PolarHBondContact O-N 2.83Å
539	A	37.6	Very low	40.7	Very low	45 Å²	45	119 Å²	119	37%	0.372	69%	0.685	S	S	.	*			trans	-94.4	97.8	-179.9	0	0	0	0	0	111.9	L542	A539-L542 HydrophobicContact CB-CD1 3.88Å; A539-L542 HydrophobicContact CB-CG 4.18Å
540	V	43.4	Very low	40.1	Very low	127 Å²	127	119.8 Å²	119.8	77%	0.77	70%	0.704	S	S	*	*	S	Bend	trans	-45.1	142.9	151.3	173.6	0	0	0	0	108.6	Q538 L542	Q538-V540 PolarHBondContact O-N 2.83Å; V540-L542 PolarHBondContact O-N 3.36Å
541	P	37.6	Very low	38.9	Very low	112 Å²	112	125 Å²	125	73%	0.727	72%	0.723	S	S	*	*			trans	-51.9	105.2	-157.6	-23.6	31.5	0	0	0	113	A543	P541-A543 PolarHBondContact O-N 3.36Å
542	L	33.5	Very low	38.1	Very low	145 Å²	145	129.2 Å²	129.2	76%	0.759	75%	0.745	S	S	*	*			trans	-74	79.4	172	-73.3	172.7	0	0	0	108.4	A539 V540	A539-L542 HydrophobicContact CB-CD1 3.88Å; A539-L542 HydrophobicContact CB-CG 4.18Å; V540-L542 PolarHBondContact O-N 3.36Å
543	A	36.6	Very low	37.4	Very low	96 Å²	96	131.7 Å²	131.7	79%	0.793	76%	0.758	S	S	*	*			trans	-118.4	17	169.1	0	0	0	0	0	112.1	P541	P541-A543 PolarHBondContact O-N 3.36Å
544	S	37.4	Very low	36.9	Very low	102 Å²	102	130.2 Å²	130.2	71%	0.713	77%	0.767	S	S	*	*	S	Bend	trans	-126.3	8.4	-170.7	50.6	0	0	0	0	116
545	V	34.3	Very low	36.3	Very low	125 Å²	125	131.2 Å²	131.2	76%	0.758	77%	0.771	S	S	*	*			trans	-140.6	86.6	179	-170	0	0	0	0	111.1
546	L	37	Very low	35.8	Very low	169 Å²	169	138.3 Å²	138.3	89%	0.885	79%	0.79	S	S	*	*			trans	-142.5	141.1	155.5	-102.8	139.9	0	0	0	108.6
547	P	34.2	Very low	35.3	Very low	120 Å²	120	138.2 Å²	138.2	78%	0.779	79%	0.792	S	S	*	*			trans	-75.7	148.6	-163.5	-7.6	24.9	0	0	0	112.7
548	S	33.5	Very low	34.9	Very low	119 Å²	119	138.7 Å²	138.7	83%	0.832	79%	0.793	S	S	*	*			trans	-39.8	127.6	170	-55.8	0	0	0	0	115.2
549	E	31	Very low	34.3	Very low	196 Å²	196	136.7 Å²	136.7	92%	0.916	79%	0.789	S	S	*	*			trans	-170	93.4	141.2	-108.3	177.8	-164.5	0	0	109.6
550	A	38.9	Very low	34	Very low	103 Å²	103	141 Å²	141	85%	0.851	81%	0.805	S	S	*	*			trans	171.4	127.6	145.6	0	0	0	0	0	110.5
551	Q	30.2	Very low	33.5	Very low	192 Å²	192	139 Å²	139	90%	0.897	80%	0.797	S	S	*	*			trans	-70.2	134.4	-173.3	-61.5	150.1	2.6	0	0	112
552	C	32.9	Very low	33.1	Very low	120 Å²	120	141 Å²	141	81%	0.811	80%	0.801	S	S	*	*			trans	-172.2	98.7	140.8	-99.1	0	0	0	0	112.6
553	L	33.6	Very low	33.2	Very low	167 Å²	167	142.3 Å²	142.3	87%	0.874	80%	0.797	S	S	*	*			trans	50	111.6	133.3	-64.1	163.7	0	0	0	121.3
554	S	32.3	Very low	32.9	Very low	120 Å²	120	142.9 Å²	142.9	84%	0.839	80%	0.796	S	S	*	*			trans	109.7	138.4	131.3	-159	0	0	0	0	118.3
555	P	32	Very low	32.8	Very low	96 Å²	96	145.1 Å²	145.1	62%	0.623	80%	0.799	S	S	*	*			trans	-112.2	138.1	-148	37.1	-23.6	0	0	0	113.9
556	Y	35.4	Very low	32.8	Very low	238 Å²	238	143.3 Å²	143.3	93%	0.933	79%	0.792	S	S	*	*			trans	-140.4	107.5	149.1	-83.3	-75.6	0	0	0	110
557	Q	28.3	Very low	32.6	Very low	174 Å²	174	144.3 Å²	144.3	81%	0.813	79%	0.792	S	S	*	*			trans	-62.6	127	164.8	-66.6	-103.2	31.6	0	0	108.9
558	L	31.4	Very low	32.6	Very low	169 Å²	169	140.7 Å²	140.7	89%	0.885	78%	0.777	S	S	*	*			trans	-151	124.8	151.2	-106.6	168.8	0	0	0	109.5
559	N	30	Very low	32.9	Very low	136 Å²	136	138.7 Å²	138.7	73%	0.727	76%	0.763	S	S	*	*			trans	-44.7	123.7	-173.9	-72.7	-14.7	0	0	0	115	S561	N559-S561 PolarHBondContact O-N 2.88Å
560	D	29.5	Very low	33.2	Very low	135 Å²	135	137.7 Å²	137.7	72%	0.722	76%	0.757	S	S	*	*			trans	-83.4	89.4	158.2	-78.1	-39.7	0	0	0	109.5	Y563	D560-Y563 WeakPolarHBondContact OD1-CE2 3.27Å
561	S	33.3	Very low	33	Very low	86 Å²	86	138.4 Å²	138.4	60%	0.601	75%	0.747	S	S	*	*			trans	-148	76.6	161.1	52.5	0	0	0	0	108.9	N559	N559-S561 PolarHBondContact O-N 2.88Å
562	N	30.6	Very low	33.5	Very low	152 Å²	152	134.4 Å²	134.4	81%	0.813	73%	0.731	S	S	*	*			trans	172.6	71.7	153.6	-83.5	-30.2	0	0	0	109.7
563	Y	34.4	Very low	33.7	Very low	173 Å²	173	133.2 Å²	133.2	68%	0.678	72%	0.724	S	S	*	*			trans	-111.4	66.1	161.9	-76.8	-83.2	0	0	0	109.1	D560	D560-Y563 WeakPolarHBondContact OD1-CE2 3.27Å
564	S	30.3	Very low	34.2	Very low	109 Å²	109	130.3 Å²	130.3	76%	0.762	71%	0.713	S	S	*	*			trans	-87.8	94.6	152.4	49.3	0	0	0	0	107.1	S566	S564-S566 PolarHBondContact O-N 3.1Å
565	L	35	Very low	34.5	Very low	148 Å²	148	131.8 Å²	131.8	78%	0.775	71%	0.706	S	S	*	*			trans	-54.6	98.3	179.3	-170.9	70.2	0	0	0	110.8	Q567	L565-Q567 PolarHBondContact O-N 3.02Å
566	S	34.2	Very low	34.8	Very low	87 Å²	87	133.4 Å²	133.4	61%	0.608	70%	0.701	S	S	*	*			trans	21.4	72.3	131.5	-159.2	0	0	0	0	116	S564	S564-S566 PolarHBondContact O-N 3.1Å
567	Q	34.3	Very low	34.9	Very low	191 Å²	191	130 Å²	130	89%	0.893	70%	0.696	S	S	*	*			trans	-112.5	9.2	156.4	-77	-166.5	3.2	0	0	112.2	L565	L565-Q567 PolarHBondContact O-N 3.02Å
568	G	33.6	Very low	35.3	Very low	44 Å²	44	128.5 Å²	128.5	45%	0.454	69%	0.693	S	S	.	*	S	Bend	trans	-95.2	-17.2	-175.9	0	0	0	0	0	116.1	H570 N571	G568-H570 PolarHBondContact O-N 2.74Å; G568-N571 PolarHBondContact O-N 2.97Å
569	S	39.6	Very low	35.6	Very low	77 Å²	77	123.8 Å²	123.8	54%	0.538	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.6	-6.2	-160.5	-51.9	0	0	0	0	115.5
570	H	36.7	Very low	35.9	Very low	174 Å²	174	122 Å²	122	81%	0.806	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-4.8	172.3	-67.9	-51	0	0	0	114.1	G568	G568-H570 PolarHBondContact O-N 2.74Å
571	N	35.7	Very low	36.3	Very low	118 Å²	118	122.2 Å²	122.2	63%	0.631	68%	0.678	S	S	*	*	S	Bend	trans	-98.6	-12.5	177.5	-79.1	-31.5	0	0	0	114.3	G568	G568-N571 PolarHBondContact O-N 2.97Å
572	I	40.6	Very low	36.9	Very low	108 Å²	108	124.2 Å²	124.2	55%	0.554	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-25.2	179.8	-80	160.7	0	0	0	112.3	Y576	I572-Y576 HydrophobicContact CG2-CE2 4.38Å; I572-Y576 WeakPolarHBondContact O-CD2 3.16Å
573	S	37.4	Very low	37.7	Very low	96 Å²	96	125.7 Å²	125.7	67%	0.671	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-26	176.6	-165.7	0	0	0	0	112.9
574	V	43.2	Very low	38.7	Very low	106 Å²	106	127.9 Å²	127.9	64%	0.642	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-84	-20.5	-176	-177.2	0	0	0	0	112.8	Y576	V574-Y576 VanDerWaalsContact C-N 3.31Å; V574-Y576 PolarHBondContact O-N 3.06Å
575	Q	38.3	Very low	39.9	Very low	150 Å²	150	130.5 Å²	130.5	70%	0.701	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-76.6	-12.3	173.7	-84	-177.2	-12.9	0	0	114.3
576	Y	39.8	Very low	41.4	Very low	131 Å²	131	129.3 Å²	129.3	51%	0.514	67%	0.669	S	S	.	*	G	3₁₀ helix	trans	-100.2	-0.8	-170.1	-78.9	-101.4	0	0	0	115.5	I572 V574	I572-Y576 HydrophobicContact CG2-CE2 4.38Å; I572-Y576 WeakPolarHBondContact O-CD2 3.16Å; V574-Y576 VanDerWaalsContact C-N 3.31Å; V574-Y576 PolarHBondContact O-N 3.06Å
577	M	37.2	Very low	43.1	Very low	166 Å²	166	125.4 Å²	125.4	82%	0.818	64%	0.642	S	S	*	*	S	Bend	trans	-86.6	-10	169.1	-72.2	-67	177	0	0	113.4
578	N	36.6	Very low	44.8	Very low	143 Å²	143	120 Å²	120	77%	0.765	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	8.1	-178.7	-79.3	-19.2	0	0	0	114.8
579	A	37	Very low	46.8	Very low	69 Å²	69	119.3 Å²	119.3	57%	0.57	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	4.3	178.7	0	0	0	0	0	114.3	N581	A579-N581 PolarHBondContact O-N 2.91Å
580	S	37.4	Very low	48.8	Very low	98 Å²	98	115.6 Å²	115.6	69%	0.685	59%	0.589	S	S	*	*			trans	-83.1	54.6	175.2	-153.8	0	0	0	0	111.7
581	N	38.2	Very low	50.9	Low	141 Å²	141	110.9 Å²	110.9	75%	0.754	56%	0.564	S	S	*	*			trans	-107.8	73.6	163.6	-90.8	-35.7	0	0	0	107.7	A579 K583	A579-N581 PolarHBondContact O-N 2.91Å; N581-K583 PolarHBondContact O-N 3.28Å
582	N	44.1	Very low	53.1	Low	127 Å²	127	109.7 Å²	109.7	68%	0.679	56%	0.558	S	S	*	*			trans	-68.1	55.2	171.5	-88.3	-17.8	0	0	0	111.7	R584	N582-R584 PolarHBondContact O-N 3.4Å
583	K	49	Very low	55	Low	184 Å²	184	106.2 Å²	106.2	80%	0.8	54%	0.54	S	S	*	.			trans	-67.6	101.3	161.8	-92.8	179.6	177.3	173.8	0	106.7	N581 R585	N581-K583 PolarHBondContact O-N 3.28Å; K583-R585 PolarHBondContact O-N 3.4Å
584	R	54.4	Low	57.2	Low	219 Å²	219	101.9 Å²	101.9	83%	0.826	51%	0.509	S	S	*	.			trans	-17.8	95.2	172.8	-67.9	-177.1	-173.7	175	2.6	111.2	N582 K586	N582-R584 PolarHBondContact O-N 3.4Å; R584-K586 VanDerWaalsContact C-N 3.28Å; R584-K586 PolarHBondContact O-N 3.47Å
585	R	56.5	Low	58.8	Low	164 Å²	164	98.8 Å²	98.8	62%	0.619	49%	0.492	S	S	*	.			trans	-69.6	95.9	171.7	-74.9	-177.5	171.6	163.1	-1.3	106.3	L52 K583 S587	L52-R585 HydrophobicContact CD1-CB 3.93Å; K583-R585 PolarHBondContact O-N 3.4Å; R585-S587 PolarHBondContact O-N 2.84Å
586	K	65	Low	60.4	Low	122 Å²	122	101 Å²	101	53%	0.53	49%	0.494	S	S	.	.			trans	-71.1	119.5	173.6	-68.8	179.5	-176.3	174.7	0	107.4	E48 R584 V588	E48-K586 VanDerWaalsContact OE1-CA 3.22Å; E48-K586 WeakPolarHBondContact OE1-CA 3.5Å; R584-K586 VanDerWaalsContact C-N 3.28Å; R584-K586 PolarHBondContact O-N 3.47Å; K586-V588 PolarHBondContact O-N 3.21Å
587	S	69.6	Low	61.8	Low	6 Å²	6	94.9 Å²	94.9	4%	0.042	47%	0.47	C	S	.	.			trans	-77	111	179.6	175.3	0	0	0	0	108.6	I9 E48 R585 G589 L590 R591	I9-S587 WeakPolarHBondContact CG1-OG 3.43Å; E48-S587 PolarHBondContact OE1-N 2.92Å; R585-S587 PolarHBondContact O-N 2.84Å; S587-G589 PolarHBondContact O-N 3.29Å; S587-L590 PolarHBondContact O-N 3.23Å; S587-L590 PolarHBondContact OG-N 3.01Å; S587-R591 WeakPolarHBondContact O-CG 3.45Å; S587-R591 PolarHBondContact O-N 3.08Å
588	V	71.2	Confident	62.9	Low	77 Å²	77	89.9 Å²	89.9	47%	0.467	44%	0.444	S	S	.	.	H	α-helix	trans	-60	-37	177	179.6	0	0	0	0	110.1	K586 N592	K586-V588 PolarHBondContact O-N 3.21Å; V588-N592 VanDerWaalsContact O-CB 3.24Å; V588-N592 WeakPolarHBondContact O-CB 3.44Å; V588-N592 VanDerWaalsContact O-CG 3.22Å; V588-N592 PolarHBondContact O-N 3.45Å
589	G	76.3	Confident	63.8	Low	29 Å²	29	86.2 Å²	86.2	30%	0.299	44%	0.44	S	S	.	.	H	α-helix	trans	-66.6	-42.6	178.5	0	0	0	0	0	113.6	S587 M593	S587-G589 PolarHBondContact O-N 3.29Å; G589-M593 PolarHBondContact O-N 3.21Å
590	L	80.4	Confident	64.1	Low	0 Å²	0	91.2 Å²	91.2	0%	0	45%	0.445	C	S	.	.	H	α-helix	trans	-67.3	-47.1	176.2	-71.2	172.9	0	0	0	110.2	I9 V13 A17 V44 L47 E48 S587 N592 M593 F594	I9-L590 HydrophobicContact CD1-CD2 4.09Å; I9-L590 HydrophobicContact CD1-CG 3.81Å; I9-L590 HydrophobicContact CG1-CG 4.37Å; V13-L590 HydrophobicContact CG1-CD1 4.34Å; V13-L590 HydrophobicContact CG1-CD2 4.4Å; A17-L590 HydrophobicContact CB-CD2 3.68Å; V44-L590 HydrophobicContact CG1-CB 4.4Å; L47-L590 VanDerWaalsContact C-CD1 3.45Å; L47-L590 HydrophobicContact CB-CD1 3.53Å; L47-L590 HydrophobicContact CB-CD2 4.13Å; L47-L590 HydrophobicContact CB-CG 4.44Å; L47-L590 HydrophobicContact CD1-CD2 4.2Å; E48-L590 HydrophobicContact CG-CD1 3.94Å; S587-L590 PolarHBondContact O-N 3.23Å; S587-L590 PolarHBondContact OG-N 3.01Å; L590-N592 VanDerWaalsContact C-N 3.32Å; L590-N592 PolarHBondContact O-N 2.82Å; L590-M593 WeakPolarHBondContact O-CB 3.13Å; L590-M593 PolarHBondContact O-N 3.04Å; L590-M593 VanDerWaalsContact O-N 3.1Å; L590-F594 VanDerWaalsContact O-CD2 3.29Å; L590-F594 WeakPolarHBondContact O-CD2 3.47Å; L590-F594 PolarHBondContact O-N 3.05Å
591	R	82.1	Confident	64.1	Low	74 Å²	74	93.1 Å²	93.1	28%	0.279	45%	0.453	S	S	.	.	H	α-helix	trans	-57.9	-46.2	177.5	-70.6	-178.9	-175.5	-89.1	-10.7	111.3	V44 E48 S587 M593 F594 S595	V44-R591 HydrophobicContact CG1-CG 3.98Å; E48-R591 IonicContact OE1-CZ 3.31Å; E48-R591 VanDerWaalsContact OE1-CZ 3.31Å; E48-R591 IonicContact OE1-NE 2.71Å; E48-R591 PolarHBondContact OE1-NE 3.5Å; E48-R591 IonicContact OE1-NH2 3.72Å; E48-R591 PolarHBondContact OE1-NH2 3.12Å; E48-R591 VanDerWaalsContact OE1-NH2 3.16Å; E48-R591 IonicContact OE2-CZ 3.72Å; E48-R591 IonicContact OE2-NE 3.85Å; E48-R591 IonicContact OE2-NH2 2.92Å; E48-R591 PolarHBondContact OE2-NH2 3.27Å; S587-R591 WeakPolarHBondContact O-CG 3.45Å; S587-R591 PolarHBondContact O-N 3.08Å; R591-M593 VanDerWaalsContact C-N 3.33Å; R591-M593 PolarHBondContact O-N 3.42Å; R591-F594 PolarHBondContact O-N 2.7Å; R591-S595 WeakPolarHBondContact O-CB 3.45Å; R591-S595 PolarHBondContact O-N 2.82Å; R591-S595 PolarHBondContact O-OG 3.43Å
592	N	80.8	Confident	64.2	Low	93 Å²	93	90.7 Å²	90.7	50%	0.497	44%	0.443	S	S	.	.	H	α-helix	trans	-61.2	-37	175.9	-78.4	-11.6	0	0	0	113.7	V588 L590	V588-N592 VanDerWaalsContact O-CB 3.24Å; V588-N592 WeakPolarHBondContact O-CB 3.44Å; V588-N592 VanDerWaalsContact O-CG 3.22Å; V588-N592 PolarHBondContact O-N 3.45Å; L590-N592 VanDerWaalsContact C-N 3.32Å; L590-N592 PolarHBondContact O-N 2.82Å
593	M	81.5	Confident	63.8	Low	35 Å²	35	89.2 Å²	89.2	17%	0.172	45%	0.449	C	S	.	.	H	α-helix	trans	-62.4	-45.9	175.8	-170.9	-173.4	-62.8	0	0	110.9	Y14 A17 Y21 G589 L590 R591	Y14-M593 HydrophobicContact CD2-CE 3.58Å; Y14-M593 HydrophobicContact CE2-CE 3.39Å; A17-M593 HydrophobicContact CB-CE 3.99Å; A17-M593 HydrophobicContact CB-SD 3.64Å; Y21-M593 HydrophobicContact CD2-CG 4.2Å; Y21-M593 WeakPolarHBondContact CE2-O 3.25Å; G589-M593 PolarHBondContact O-N 3.21Å; L590-M593 WeakPolarHBondContact O-CB 3.13Å; L590-M593 PolarHBondContact O-N 3.04Å; L590-M593 VanDerWaalsContact O-N 3.1Å; R591-M593 VanDerWaalsContact C-N 3.33Å; R591-M593 PolarHBondContact O-N 3.42Å
594	F	82.9	Confident	63.3	Low	5 Å²	5	87.4 Å²	87.4	2%	0.022	44%	0.442	C	S	.	.	H	α-helix	trans	-84.6	-17.6	-176.9	-74	-87.7	0	0	0	114.2	A17 I20 Y21 F24 V40 V44 L47 L590 R591 R596 L597	A17-F594 HydrophobicContact CB-CE2 4.14Å; I20-F594 HydrophobicContact CB-CZ 4.3Å; I20-F594 HydrophobicContact CG2-CE1 3.79Å; I20-F594 HydrophobicContact CG2-CZ 3.69Å; Y21-F594 HydrophobicContact CD2-CD1 4.45Å; F24-F594 HydrophobicContact CD2-CD1 4.32Å; F24-F594 AromaticContact CD2-CE1 3.72Å; F24-F594 HydrophobicContact CD2-CE1 3.72Å; F24-F594 AromaticContact CE2-CE1 3.89Å; F24-F594 HydrophobicContact CE2-CE1 3.89Å; V40-F594 HydrophobicContact CG1-CB 3.86Å; V40-F594 HydrophobicContact CG1-CD1 3.6Å; V40-F594 HydrophobicContact CG1-CG 4.01Å; V44-F594 HydrophobicContact CG2-CB 3.74Å; V44-F594 HydrophobicContact CG2-CD1 4.2Å; V44-F594 HydrophobicContact CG2-CD2 3.53Å; V44-F594 HydrophobicContact CG2-CE2 4.19Å; V44-F594 HydrophobicContact CG2-CG 3.54Å; L47-F594 HydrophobicContact CD1-CE2 3.63Å; L47-F594 HydrophobicContact CD1-CZ 3.8Å; L590-F594 VanDerWaalsContact O-CD2 3.29Å; L590-F594 WeakPolarHBondContact O-CD2 3.47Å; L590-F594 PolarHBondContact O-N 3.05Å; R591-F594 PolarHBondContact O-N 2.7Å; F594-R596 PolarHBondContact O-N 3.24Å; F594-R596 VanDerWaalsContact O-N 3.15Å; F594-L597 HydrophobicContact CD1-CD1 3.7Å; F594-L597 HydrophobicContact CE1-CD1 4.26Å; F594-L597 WeakPolarHBondContact O-CB 3.38Å; F594-L597 PolarHBondContact O-N 3.3Å
595	S	76.1	Confident	62.2	Low	41 Å²	41	79.9 Å²	79.9	29%	0.287	43%	0.434	S	S	.	.	H	α-helix	trans	-57.2	-29.4	175.6	-68.9	0	0	0	0	112.9	R591 L597 F598	R591-S595 WeakPolarHBondContact O-CB 3.45Å; R591-S595 PolarHBondContact O-N 2.82Å; R591-S595 PolarHBondContact O-OG 3.43Å; S595-L597 PolarHBondContact O-N 2.9Å; S595-F598 PolarHBondContact O-N 3.39Å
596	R	72.9	Confident	61.2	Low	198 Å²	198	77.2 Å²	77.2	75%	0.747	44%	0.437	S	S	*	.	H	α-helix	trans	-64.9	-24.6	176.4	-66.4	-175.5	179.2	-163.6	-0.9	113.5	Y21 F594	Y21-R596 HydrophobicContact CE2-CB 4.37Å; F594-R596 PolarHBondContact O-N 3.24Å; F594-R596 VanDerWaalsContact O-N 3.15Å
597	L	68.5	Low	59.5	Low	2 Å²	2	78.7 Å²	78.7	1%	0.01	45%	0.451	C	S	.	.	H	α-helix	trans	-78.7	-22.4	178.6	-72.7	162.1	0	0	0	113	Y21 F24 E25 Y36 F594 S595	Y21-L597 HydrophobicContact CD2-CD1 3.58Å; Y21-L597 HydrophobicContact CD2-CG 4.05Å; Y21-L597 HydrophobicContact CE2-CD1 3.73Å; Y21-L597 HydrophobicContact CE2-CD2 4.29Å; Y21-L597 HydrophobicContact CE2-CG 3.64Å; Y21-L597 HydrophobicContact CG-CD1 4.45Å; F24-L597 HydrophobicContact CB-CD1 3.54Å; F24-L597 HydrophobicContact CB-CD2 4.03Å; F24-L597 HydrophobicContact CB-CG 4.43Å; F24-L597 HydrophobicContact CD2-CD1 4.31Å; F24-L597 HydrophobicContact CG-CD1 4.14Å; E25-L597 HydrophobicContact CG-CD2 4.06Å; Y36-L597 HydrophobicContact CE2-CB 4.27Å; Y36-L597 PolarHBondContact OH-O 3Å; Y36-L597 VanDerWaalsContact OH-O 3.05Å; F594-L597 HydrophobicContact CD1-CD1 3.7Å; F594-L597 HydrophobicContact CE1-CD1 4.26Å; F594-L597 WeakPolarHBondContact O-CB 3.38Å; F594-L597 PolarHBondContact O-N 3.3Å; S595-L597 PolarHBondContact O-N 2.9Å
598	F	60.6	Low	58	Low	60 Å²	60	83.6 Å²	83.6	26%	0.263	49%	0.485	S	S	.	.	H	α-helix	trans	-96.8	-11.2	-174.9	-85	-70.1	0	0	0	115.3	G37 V40 P41 S595 Y600	G37-F598 WeakPolarHBondContact O-CZ 3.3Å; V40-F598 HydrophobicContact CB-CE2 3.47Å; V40-F598 VanDerWaalsContact CB-CE2 3.47Å; V40-F598 HydrophobicContact CB-CZ 3.75Å; V40-F598 HydrophobicContact CG1-CD2 4.26Å; V40-F598 HydrophobicContact CG1-CE2 3.45Å; V40-F598 VanDerWaalsContact CG1-CE2 3.45Å; V40-F598 HydrophobicContact CG1-CZ 4.26Å; V40-F598 HydrophobicContact CG2-CE2 4.12Å; V40-F598 HydrophobicContact CG2-CZ 4.27Å; P41-F598 HydrophobicContact CG-CZ 4.35Å; S595-F598 PolarHBondContact O-N 3.39Å; F598-Y600 HydrophobicContact CB-CD2 4.45Å; F598-Y600 WeakPolarHBondContact O-CD2 3.07Å; F598-Y600 PolarHBondContact O-N 3.44Å
599	G	55.4	Low	56.1	Low	67 Å²	67	88.2 Å²	88.2	69%	0.691	51%	0.507	S	S	*	.			trans	60.8	0.7	-175	0	0	0	0	0	114.5
600	Y	44.3	Very low	54.2	Low	174 Å²	174	93.7 Å²	93.7	68%	0.682	53%	0.528	S	S	*	.			trans	-97.2	108.3	178.1	-79.1	-77.4	0	0	0	109.2	F598 V602	F598-Y600 HydrophobicContact CB-CD2 4.45Å; F598-Y600 WeakPolarHBondContact O-CD2 3.07Å; F598-Y600 PolarHBondContact O-N 3.44Å; Y600-V602 PolarHBondContact O-N 3.15Å
601	T	36.9	Very low	51.9	Low	138 Å²	138	99.3 Å²	99.3	85%	0.847	56%	0.563	S	S	*	*			trans	-58.6	89.7	153.3	52	0	0	0	0	107.8	A603	T601-A603 VanDerWaalsContact C-N 3.29Å; T601-A603 PolarHBondContact O-N 3.07Å
602	V	39.8	Very low	49.6	Very low	90 Å²	90	103.8 Å²	103.8	55%	0.545	59%	0.592	S	S	.	*			trans	-72.6	93.9	168.3	175.1	0	0	0	0	106.5	Y600 H604	Y600-V602 PolarHBondContact O-N 3.15Å; V602-H604 PolarHBondContact O-N 3.31Å
603	A	34.8	Very low	47.5	Very low	96 Å²	96	103.9 Å²	103.9	79%	0.793	61%	0.606	S	S	*	*			trans	-60.5	104.5	162.5	0	0	0	0	0	107.4	T601 G605	T601-A603 VanDerWaalsContact C-N 3.29Å; T601-A603 PolarHBondContact O-N 3.07Å; A603-G605 VanDerWaalsContact C-N 3.35Å; A603-G605 PolarHBondContact O-N 3.4Å
604	H	39.6	Very low	45.3	Very low	145 Å²	145	105.4 Å²	105.4	67%	0.671	63%	0.63	S	S	*	*			trans	-74.2	89.5	170.8	-76.7	-66.7	0	0	0	108.9	V602	V602-H604 PolarHBondContact O-N 3.31Å
605	G	30.5	Very low	43.1	Very low	62 Å²	62	113.6 Å²	113.6	64%	0.639	67%	0.668	S	S	*	*			trans	-86.7	137.2	154.9	0	0	0	0	0	108.9	A603	A603-G605 VanDerWaalsContact C-N 3.35Å; A603-G605 PolarHBondContact O-N 3.4Å
606	P	35.6	Very low	41.2	Very low	108 Å²	108	117.1 Å²	117.1	70%	0.701	68%	0.684	S	S	*	*			trans	-66.9	161.5	173	34.1	-32.7	0	0	0	108.4
607	D	31	Very low	39.6	Very low	153 Å²	153	115.2 Å²	115.2	82%	0.818	69%	0.687	S	S	*	*			trans	94.4	83.8	167.6	-42.6	-29	0	0	0	116.6
608	S	37.1	Very low	38	Very low	109 Å²	109	119.1 Å²	119.1	76%	0.762	72%	0.72	S	S	*	*			trans	-163.1	75.1	145.6	41.7	0	0	0	0	110.8	I610	S608-I610 PolarHBondContact O-N 3.14Å
609	N	32	Very low	37	Very low	173 Å²	173	121 Å²	121	93%	0.925	75%	0.746	S	S	*	*			trans	-83.7	91.2	154.5	-82.1	-19.2	0	0	0	107.3
610	I	35.4	Very low	36	Very low	145 Å²	145	124.8 Å²	124.8	74%	0.744	75%	0.751	S	S	*	*			trans	-131.4	106.9	168.3	-67.3	-177.8	0	0	0	108	S608	S608-I610 PolarHBondContact O-N 3.14Å
611	V	33.2	Very low	35.8	Very low	118 Å²	118	122 Å²	122	72%	0.715	75%	0.752	S	S	*	*			trans	58.1	108.6	136.1	-173.4	0	0	0	0	116.8
612	N	32.9	Very low	35.8	Very low	168 Å²	168	122.7 Å²	122.7	90%	0.898	75%	0.75	S	S	*	*				-147.1	101.1	127.3	-117.1	13.7	0	0	0	109.7
613	A	37.5	Very low	35.9	Very low	95 Å²	95	122.2 Å²	122.2	79%	0.785	75%	0.751	S	S	*	*			trans	-74	147.1	160.7	0	0	0	0	0	109
614	G	33.6	Very low	36.1	Very low	66 Å²	66	126.6 Å²	126.6	68%	0.68	76%	0.755	S	S	*	*			trans	165	99.8	166	0	0	0	0	0	114.4
615	H	38.4	Very low	36	Very low	177 Å²	177	124 Å²	124	82%	0.819	75%	0.753	S	S	*	*			trans	68.3	142.7	153.2	-84.2	-84.2	0	0	0	118.6
616	D	35.5	Very low	36.4	Very low	116 Å²	116	129.2 Å²	129.2	62%	0.62	77%	0.765	S	S	*	*			cis	175.7	153.2	-19.7	-135.4	-17.2	0	0	0	105.4
617	L	38.4	Very low	36.4	Very low	157 Å²	157	127.1 Å²	127.1	82%	0.822	76%	0.764	S	S	*	*			trans	67	131.4	158.9	-64.9	152.2	0	0	0	116.9
618	A	35.9	Very low	36.6	Very low	84 Å²	84	128.9 Å²	128.9	69%	0.694	77%	0.767	S	S	*	*			cis	-171.7	156.6	7.6	0	0	0	0	0	109.3
619	A	40.4	Very low	36.7	Very low	99 Å²	99	129 Å²	129	82%	0.818	77%	0.768	S	S	*	*			trans	61.9	135.3	157.5	0	0	0	0	0	116.9
620	D	34	Very low	37.1	Very low	147 Å²	147	126.9 Å²	126.9	79%	0.786	76%	0.761	S	S	*	*			cis	-164.9	135.4	34.1	-155	13.6	0	0	0	109.4
621	V	39.9	Very low	37	Very low	116 Å²	116	125.2 Å²	125.2	70%	0.703	76%	0.762	S	S	*	*			trans	15	116.5	147.8	-176.8	0	0	0	0	119.2
622	D	36.6	Very low	37.2	Very low	153 Å²	153	129 Å²	129	82%	0.818	77%	0.769	S	S	*	*				-152	141.6	123.8	-124.8	-24.4	0	0	0	114.6
623	S	41.4	Very low	37.5	Very low	80 Å²	80	126 Å²	126	56%	0.559	76%	0.762	S	S	*	*			trans	-59.6	137.8	-171.1	-18.3	0	0	0	0	115.6
624	H	39	Very low	37.6	Very low	187 Å²	187	128.6 Å²	128.6	87%	0.866	76%	0.761	S	S	*	*				57.6	138.5	98.4	-69.2	-72.5	0	0	0	116
625	S	37.2	Very low	37.7	Very low	92 Å²	92	134.7 Å²	134.7	64%	0.643	77%	0.772	S	S	*	*			cis	177.3	162.7	1.5	-175.5	0	0	0	0	109.1
626	L	39	Very low	37.9	Very low	170 Å²	170	130.5 Å²	130.5	89%	0.89	76%	0.762	S	S	*	*			trans	80.6	120.9	164.3	-54.2	171.6	0	0	0	116.4
627	G	36	Very low	38.4	Very low	65 Å²	65	132.7 Å²	132.7	67%	0.67	77%	0.774	S	S	*	*			cis	133.8	97.3	22.1	0	0	0	0	0	106.2
628	E	36	Very low	38.4	Very low	190 Å²	190	133.4 Å²	133.4	89%	0.888	78%	0.778	S	S	*	*				74.6	106	97.4	-162.5	170.9	-145.5	0	0	113.6
629	S	38.8	Very low	38.8	Very low	112 Å²	112	140.3 Å²	140.3	78%	0.783	80%	0.803	S	S	*	*			trans	-174.7	100.9	142	-81.6	0	0	0	0	109.6
630	V	39.5	Very low	38.7	Very low	127 Å²	127	142.4 Å²	142.4	77%	0.77	80%	0.802	S	S	*	*				95.3	102	90.6	171.5	0	0	0	0	111.5
631	S	34.8	Very low	39	Very low	111 Å²	111	142.1 Å²	142.1	78%	0.776	80%	0.803	S	S	*	*			trans	-60.1	129.8	153	-43.6	0	0	0	0	109.7
632	K	37.5	Very low	38.9	Very low	196 Å²	196	143.6 Å²	143.6	85%	0.852	81%	0.809	S	S	*	*			trans	157.5	107.2	145.5	-89.2	161.1	-176.1	-177.9	0	109.4
633	S	37.9	Very low	39	Very low	107 Å²	107	143 Å²	143	75%	0.748	81%	0.808	S	S	*	*			trans	174.5	125.9	133	-85.1	0	0	0	0	112.1
634	L	40.3	Very low	38.9	Very low	148 Å²	148	146.9 Å²	146.9	78%	0.775	82%	0.824	S	S	*	*			trans	67.3	110.5	142.6	-61.5	159.6	0	0	0	115.6
635	E	35.5	Very low	38.9	Very low	194 Å²	194	144.3 Å²	144.3	91%	0.907	82%	0.821	S	S	*	*			cis	48.6	65.2	30.7	-147.3	150.3	-145.9	0	0	113.2
636	S	42.6	Very low	39	Very low	89 Å²	89	148 Å²	148	62%	0.622	83%	0.834	S	S	*	*			trans	175.3	109.9	139	58.1	0	0	0	0	109.1
637	N	45.7	Very low	39	Very low	162 Å²	162	146.3 Å²	146.3	87%	0.866	83%	0.829	S	S	*	*			trans	-167.9	82.2	142.9	-89.5	-25	0	0	0	107.8
638	L	38.1	Very low	39.3	Very low	173 Å²	173	153.1 Å²	153.1	91%	0.906	84%	0.843	S	S	*	*			trans	-87.9	97.3	146.1	-105.7	142.3	0	0	0	105
639	D	44.6	Very low	39.6	Very low	228 Å²	228	149.7 Å²	149.7	100%	1.219	84%	0.839	S	S	*	*			trans	163	0	145	-91.8	-11.7	0	0	0	110.8

Retrieved 639 of 639 residues in 774.2 ms (Link to these results)

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