A0A5K4FDL7_SCHMA Loading...

EF-hand domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FDL7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 558 aa.

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(Predicted Aligned Error values between residue pairs)

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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	31.5	Very low	39	Very low	222 Å²	222	113 Å²	113	100%	1.094	59%	0.587	S	S	*	*				0	127.6	0	-73.9	179.8	174.4	0	0	106.3	H3	M1-H3 PolarHBondContact O-N 3.33Å; M1-H3 VanDerWaalsContact O-N 3.07Å
2	E	25.6	Very low	40.2	Very low	199 Å²	199	103.9 Å²	103.9	93%	0.93	54%	0.54	S	S	*	.			trans	-54.9	115.9	178.1	-72.9	177.3	156.6	0	0	108.9	S4	E2-S4 PolarHBondContact O-N 3.06Å
3	H	28.2	Very low	40.8	Very low	179 Å²	179	101.5 Å²	101.5	83%	0.829	53%	0.528	S	S	*	.			trans	-66.4	86	176	-71.7	-75.2	0	0	0	108.4	M1 T5	M1-H3 PolarHBondContact O-N 3.33Å; M1-H3 VanDerWaalsContact O-N 3.07Å; H3-T5 PolarHBondContact O-N 2.92Å
4	S	34.5	Very low	41.8	Very low	102 Å²	102	103.4 Å²	103.4	71%	0.713	54%	0.539	S	S	*	.			trans	-56.2	106.8	159.6	174.7	0	0	0	0	106.4	E2 W6	E2-S4 PolarHBondContact O-N 3.06Å; S4-W6 VanDerWaalsContact C-N 3.33Å; S4-W6 PolarHBondContact O-N 3.43Å
5	T	39.4	Very low	42.4	Very low	123 Å²	123	96.9 Å²	96.9	76%	0.755	51%	0.505	S	S	*	.			trans	-63.4	92.4	-177.5	35.9	0	0	0	0	109	H3 N7	H3-T5 PolarHBondContact O-N 2.92Å; T5-N7 PolarHBondContact O-N 3.34Å
6	W	38.2	Very low	43.3	Very low	51 Å²	51	100.2 Å²	100.2	19%	0.193	51%	0.509	C	S	.	.			trans	-57	105.1	174.1	-172.7	90.2	0	0	0	108.4	S4 P8 H11 P536 V539	S4-W6 VanDerWaalsContact C-N 3.33Å; S4-W6 PolarHBondContact O-N 3.43Å; W6-P8 HydrophobicContact CE3-CB 3.94Å; W6-P8 HydrophobicContact CE3-CG 3.72Å; W6-P8 HydrophobicContact CH2-CB 3.89Å; W6-P8 HydrophobicContact CZ3-CB 3.27Å; W6-P8 HydrophobicContact CZ3-CG 3.49Å; W6-P8 VanDerWaalsContact CZ3-CG 3.49Å; W6-P8 WeakPolarHBondContact O-CD 3.44Å; W6-H11 AromaticContact CD1-CG 3.94Å; W6-H11 HydrophobicContact CD2-CB 4.36Å; W6-H11 HydrophobicContact CG-CB 4.31Å; W6-H11 HydrophobicContact CZ2-CB 4.34Å; W6-P536 HydrophobicContact CE3-CB 3.87Å; W6-P536 HydrophobicContact CH2-CB 4.09Å; W6-P536 HydrophobicContact CH2-CG 4.36Å; W6-P536 HydrophobicContact CZ3-CB 3.33Å; W6-P536 HydrophobicContact CZ3-CG 3.68Å; W6-V539 HydrophobicContact CZ2-CB 4.15Å; W6-V539 HydrophobicContact CZ2-CG1 3.72Å
7	N	47.8	Very low	44	Very low	61 Å²	61	96.4 Å²	96.4	33%	0.326	49%	0.49	S	S	.	.			trans	-81.1	107.9	175.4	-176	-22.4	0	0	0	109.2	T5 I9 I10 H11	T5-N7 PolarHBondContact O-N 3.34Å; N7-I9 PolarHBondContact O-N 3.3Å; N7-I9 VanDerWaalsContact OD1-CB 3.29Å; N7-I9 WeakPolarHBondContact OD1-CB 3.24Å; N7-I9 PolarHBondContact OD1-N 3.35Å; N7-I10 HydrophobicContact CB-CB 4.34Å; N7-I10 HydrophobicContact CB-CD1 4.38Å; N7-I10 HydrophobicContact CB-CG1 4.41Å; N7-I10 WeakPolarHBondContact ND2-CD1 3.47Å; N7-I10 PolarHBondContact O-N 3.19Å; N7-H11 PolarHBondContact N-CD2 3.05Å; N7-H11 PolarHBondContact O-CD2 3.19Å; N7-H11 PolarHBondContact O-N 3.37Å
8	P	41.4	Very low	44.4	Very low	61 Å²	61	94.4 Å²	94.4	40%	0.396	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-19.1	-176.3	-18	29.6	0	0	0	114.1	W6 I12 K423	W6-P8 HydrophobicContact CE3-CB 3.94Å; W6-P8 HydrophobicContact CE3-CG 3.72Å; W6-P8 HydrophobicContact CH2-CB 3.89Å; W6-P8 HydrophobicContact CZ3-CB 3.27Å; W6-P8 HydrophobicContact CZ3-CG 3.49Å; W6-P8 VanDerWaalsContact CZ3-CG 3.49Å; W6-P8 WeakPolarHBondContact O-CD 3.44Å; P8-I12 VanDerWaalsContact O-CG2 3.26Å; P8-I12 WeakPolarHBondContact O-CG2 3.41Å; P8-K423 PolarHBondContact O-NZ 3.01Å
9	I	42.3	Very low	44.8	Very low	79 Å²	79	91.6 Å²	91.6	41%	0.405	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-40.3	-179.4	-55.4	179.5	0	0	0	110.7	N7 I415	N7-I9 PolarHBondContact O-N 3.3Å; N7-I9 VanDerWaalsContact OD1-CB 3.29Å; N7-I9 WeakPolarHBondContact OD1-CB 3.24Å; N7-I9 PolarHBondContact OD1-N 3.35Å; I9-I415 HydrophobicContact CG1-CD1 4.4Å; I9-I415 HydrophobicContact CG2-CG1 4.44Å
10	I	49.2	Very low	44.8	Very low	98 Å²	98	91.9 Å²	91.9	50%	0.503	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-42.4	-172	-58.6	175.7	0	0	0	111.6	N7 I12	N7-I10 HydrophobicContact CB-CB 4.34Å; N7-I10 HydrophobicContact CB-CD1 4.38Å; N7-I10 HydrophobicContact CB-CG1 4.41Å; N7-I10 WeakPolarHBondContact ND2-CD1 3.47Å; N7-I10 PolarHBondContact O-N 3.19Å; I10-I12 PolarHBondContact O-N 2.87Å
11	H	50.4	Low	44.9	Very low	68 Å²	68	95.8 Å²	95.8	32%	0.315	49%	0.488	S	S	.	.	H	α-helix	trans	-78.6	-25.6	-167	-69	-93.3	0	0	0	113.7	W6 N7 D13 N14 Y15	W6-H11 AromaticContact CD1-CG 3.94Å; W6-H11 HydrophobicContact CD2-CB 4.36Å; W6-H11 HydrophobicContact CG-CB 4.31Å; W6-H11 HydrophobicContact CZ2-CB 4.34Å; N7-H11 PolarHBondContact N-CD2 3.05Å; N7-H11 PolarHBondContact O-CD2 3.19Å; N7-H11 PolarHBondContact O-N 3.37Å; H11-D13 VanDerWaalsContact C-N 3.32Å; H11-D13 PolarHBondContact O-N 2.77Å; H11-N14 CarbonylContact O-C 3.56Å; H11-N14 PolarHBondContact O-N 3.1Å; H11-Y15 PolarHBondContact O-N 2.95Å
12	I	54	Low	45.4	Very low	4 Å²	4	87.5 Å²	87.5	2%	0.021	45%	0.446	C	S	.	.	H	α-helix	trans	-70	-27.8	178.5	-165.2	64.7	0	0	0	113	P8 I10 N14 Y15 K423 K426 V539	P8-I12 VanDerWaalsContact O-CG2 3.26Å; P8-I12 WeakPolarHBondContact O-CG2 3.41Å; I10-I12 PolarHBondContact O-N 2.87Å; I12-N14 VanDerWaalsContact C-N 3.3Å; I12-Y15 HydrophobicContact CD1-CD1 4.03Å; I12-Y15 HydrophobicContact CD1-CG 4.38Å; I12-Y15 PolarHBondContact O-N 3.45Å; I12-K423 HydrophobicContact CB-CG 4.42Å; I12-K423 HydrophobicContact CG1-CG 3.99Å; I12-K423 HydrophobicContact CG2-CD 3.77Å; I12-K423 HydrophobicContact CG2-CG 3.54Å; I12-K426 WeakPolarHBondContact O-CD 3.15Å; I12-K426 PolarHBondContact O-NZ 3.31Å; I12-V539 HydrophobicContact CD1-CG2 3.89Å
13	D	47.3	Very low	46	Very low	73 Å²	73	81.4 Å²	81.4	39%	0.39	42%	0.419	S	S	.	.	H	α-helix	trans	-69.2	-34.2	176	-74.7	-12.1	0	0	0	110.4	H11 K426	H11-D13 VanDerWaalsContact C-N 3.32Å; H11-D13 PolarHBondContact O-N 2.77Å; D13-K426 PolarHBondContact O-NZ 3Å
14	N	55.3	Low	46.4	Very low	127 Å²	127	75.9 Å²	75.9	68%	0.679	40%	0.401	S	S	*	.	H	α-helix	trans	-88.5	-14.4	175.3	-66.4	-21.5	0	0	0	114.3	H11 I12 R16	H11-N14 CarbonylContact O-C 3.56Å; H11-N14 PolarHBondContact O-N 3.1Å; I12-N14 VanDerWaalsContact C-N 3.3Å; N14-R16 PolarHBondContact O-N 2.95Å
15	Y	51.5	Low	46.8	Very low	6 Å²	6	74.1 Å²	74.1	2%	0.024	38%	0.383	C	S	.	.			trans	-61.4	124.4	179	172.8	-110	0	0	0	110.9	H11 I12 I17 K426 V539 H542 Q543	H11-Y15 PolarHBondContact O-N 2.95Å; I12-Y15 HydrophobicContact CD1-CD1 4.03Å; I12-Y15 HydrophobicContact CD1-CG 4.38Å; I12-Y15 PolarHBondContact O-N 3.45Å; Y15-I17 HydrophobicContact CE1-CG1 3.81Å; Y15-K426 HydrophobicContact CD1-CD 4.32Å; Y15-K426 WeakPolarHBondContact O-CE 3.39Å; Y15-K426 PolarHBondContact O-NZ 3.11Å; Y15-V539 HydrophobicContact CD1-CG1 4.45Å; Y15-V539 HydrophobicContact CD2-CG1 3.58Å; Y15-V539 HydrophobicContact CE1-CG2 4.35Å; Y15-V539 HydrophobicContact CE2-CG1 3.73Å; Y15-V539 HydrophobicContact CG-CG1 3.97Å; Y15-H542 AromaticContact CE2-ND1 3.87Å; Y15-H542 AromaticContact CZ-ND1 3.74Å; Y15-H542 WeakPolarHBondContact OH-CB 3.33Å; Y15-H542 PolarHBondContact OH-CE1 3.32Å; Y15-H542 PolarHBondContact OH-ND1 3.04Å; Y15-Q543 HydrophobicContact CD2-CG 4.02Å; Y15-Q543 HydrophobicContact CE2-CG 3.89Å
16	R	55.9	Low	46.6	Very low	150 Å²	150	71.3 Å²	71.3	57%	0.566	36%	0.36	S	S	*	.			trans	-111.9	134.5	173.4	-60	-175.6	176	-151.8	2.8	108.3	N14 V18 D20	N14-R16 PolarHBondContact O-N 2.95Å; R16-V18 VanDerWaalsContact CB-O 3.32Å; R16-V18 WeakPolarHBondContact CB-O 3.46Å; R16-D20 IonicContact CZ-OD2 3.87Å; R16-D20 IonicContact NH1-OD1 2.77Å; R16-D20 PolarHBondContact NH1-OD1 3.48Å; R16-D20 IonicContact NH1-OD2 2.75Å; R16-D20 PolarHBondContact NH1-OD2 3.2Å
17	I	55.4	Low	46.4	Very low	36 Å²	36	74.8 Å²	74.8	19%	0.185	38%	0.378	C	S	.	.	S	Bend	trans	-72.3	-24.6	177.4	-63.8	176.9	0	0	0	110.6	Y15 E429 L433 H542	Y15-I17 HydrophobicContact CE1-CG1 3.81Å; I17-E429 HydrophobicContact CD1-CB 3.2Å; I17-E429 HydrophobicContact CD1-CG 4.22Å; I17-E429 VanDerWaalsContact CD1-OE2 3.23Å; I17-E429 WeakPolarHBondContact CD1-OE2 3.47Å; I17-L433 HydrophobicContact CG2-CD2 4.01Å; I17-H542 PolarHBondContact O-CE1 3.04Å; I17-H542 VanDerWaalsContact O-CE1 3.22Å
18	V	51.1	Low	45.9	Very low	61 Å²	61	76.7 Å²	76.7	37%	0.37	39%	0.388	S	S	.	.	S	Bend	trans	-130.3	133.7	175.6	-175.9	0	0	0	0	106.9	R16 D20 I23 Y26	R16-V18 VanDerWaalsContact CB-O 3.32Å; R16-V18 WeakPolarHBondContact CB-O 3.46Å; V18-D20 PolarHBondContact O-N 2.88Å; V18-I23 HydrophobicContact CG1-CG1 3.75Å; V18-Y26 HydrophobicContact CG1-CD2 3.55Å; V18-Y26 HydrophobicContact CG1-CE2 3.74Å
19	D	51.5	Low	45.9	Very low	40 Å²	40	77.6 Å²	77.6	21%	0.214	39%	0.389	C	S	.	.			trans	-77.2	115.6	165.8	-172.2	-11.4	0	0	0	108.5	Q21 Q22 I23 I546	D19-Q21 PolarHBondContact O-N 3.49Å; D19-Q21 VanDerWaalsContact O-N 3.09Å; D19-Q21 WeakPolarHBondContact OD1-CB 3.07Å; D19-Q21 PolarHBondContact OD1-N 2.71Å; D19-Q22 HydrophobicContact CB-CB 4.29Å; D19-Q22 HydrophobicContact CB-CG 4.38Å; D19-Q22 CarbonylContact O-C 3.5Å; D19-Q22 PolarHBondContact O-N 3.19Å; D19-I23 PolarHBondContact O-N 2.85Å; D19-I546 HydrophobicContact CB-CG2 4.26Å
20	D	46.1	Very low	45.5	Very low	97 Å²	97	81 Å²	81	52%	0.519	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-54.2	-29.6	179.5	-64.9	6.4	0	0	0	111.6	R16 V18 Q22 I23	R16-D20 IonicContact CZ-OD2 3.87Å; R16-D20 IonicContact NH1-OD1 2.77Å; R16-D20 PolarHBondContact NH1-OD1 3.48Å; R16-D20 IonicContact NH1-OD2 2.75Å; R16-D20 PolarHBondContact NH1-OD2 3.2Å; V18-D20 PolarHBondContact O-N 2.88Å; D20-Q22 VanDerWaalsContact C-N 3.27Å; D20-Q22 PolarHBondContact O-N 3.2Å; D20-I23 HydrophobicContact CB-CD1 4.3Å
21	Q	45.3	Very low	44.8	Very low	174 Å²	174	81.1 Å²	81.1	81%	0.813	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-73.3	-18.2	178.4	-63.8	-174.1	-11.3	0	0	113.4	D19	D19-Q21 PolarHBondContact O-N 3.49Å; D19-Q21 VanDerWaalsContact O-N 3.09Å; D19-Q21 WeakPolarHBondContact OD1-CB 3.07Å; D19-Q21 PolarHBondContact OD1-N 2.71Å
22	Q	43.7	Very low	44	Very low	48 Å²	48	80 Å²	80	22%	0.224	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-114.9	10.3	-177.1	-63.3	-172.4	-6.1	0	0	113	D19 D20 S24 D25 Y26 I546	D19-Q22 HydrophobicContact CB-CB 4.29Å; D19-Q22 HydrophobicContact CB-CG 4.38Å; D19-Q22 CarbonylContact O-C 3.5Å; D19-Q22 PolarHBondContact O-N 3.19Å; D20-Q22 VanDerWaalsContact C-N 3.27Å; D20-Q22 PolarHBondContact O-N 3.2Å; Q22-S24 PolarHBondContact O-N 3.37Å; Q22-D25 HydrophobicContact CB-CB 4.46Å; Q22-D25 WeakPolarHBondContact O-CA 3.22Å; Q22-D25 WeakPolarHBondContact O-CB 3.4Å; Q22-D25 PolarHBondContact O-N 3.38Å; Q22-Y26 HydrophobicContact CB-CD2 4.16Å; Q22-Y26 HydrophobicContact CB-CE2 3.72Å; Q22-Y26 WeakPolarHBondContact O-CD2 3.18Å; Q22-Y26 PolarHBondContact O-N 3.48Å; Q22-Y26 PolarHBondContact OE1-OH 2.9Å; Q22-I546 PolarHBondContact OE1-O 2.95Å
23	I	36.9	Very low	43.1	Very low	71 Å²	71	83.1 Å²	83.1	36%	0.364	42%	0.422	S	S	.	.	H	α-helix	trans	-51.1	-42.4	177.7	-73.4	170.8	0	0	0	111.4	V18 D19 D20 D25 Y26 E27	V18-I23 HydrophobicContact CG1-CG1 3.75Å; D19-I23 PolarHBondContact O-N 2.85Å; D20-I23 HydrophobicContact CB-CD1 4.3Å; I23-D25 VanDerWaalsContact C-N 3.28Å; I23-D25 PolarHBondContact O-N 3.42Å; I23-Y26 PolarHBondContact O-N 2.88Å; I23-E27 HydrophobicContact CG2-CG 4.3Å; I23-E27 WeakPolarHBondContact O-CB 3.28Å; I23-E27 WeakPolarHBondContact O-CG 3.47Å; I23-E27 PolarHBondContact O-N 2.92Å
24	S	37.3	Very low	42.5	Very low	64 Å²	64	85 Å²	85	45%	0.448	43%	0.425	S	S	.	.	H	α-helix	trans	-61.3	-37.4	177.2	60.8	0	0	0	0	112.5	Q22 N28	Q22-S24 PolarHBondContact O-N 3.37Å; S24-N28 VanDerWaalsContact O-CB 3.3Å; S24-N28 WeakPolarHBondContact O-CB 3.29Å; S24-N28 PolarHBondContact O-N 2.98Å; S24-N28 PolarHBondContact O-ND2 3.11Å
25	D	42.3	Very low	41.5	Very low	64 Å²	64	83.5 Å²	83.5	34%	0.342	42%	0.416	S	S	.	.	H	α-helix	trans	-72	-40.6	-179.7	-61.8	-17.1	0	0	0	110.3	Q22 I23 N28 I29	Q22-D25 HydrophobicContact CB-CB 4.46Å; Q22-D25 WeakPolarHBondContact O-CA 3.22Å; Q22-D25 WeakPolarHBondContact O-CB 3.4Å; Q22-D25 PolarHBondContact O-N 3.38Å; I23-D25 VanDerWaalsContact C-N 3.28Å; I23-D25 PolarHBondContact O-N 3.42Å; D25-N28 PolarHBondContact O-N 3.5Å; D25-I29 WeakPolarHBondContact O-CB 3.36Å; D25-I29 WeakPolarHBondContact O-CD1 3.48Å; D25-I29 WeakPolarHBondContact O-CG1 3.31Å; D25-I29 PolarHBondContact O-N 2.84Å
26	Y	36.3	Very low	40.8	Very low	65 Å²	65	87.6 Å²	87.6	26%	0.255	44%	0.437	S	S	.	.	H	α-helix	trans	-64.8	-42	173.1	-64.7	-58.2	0	0	0	112.8	V18 Q22 I23 N28 I29 F30 I546	V18-Y26 HydrophobicContact CG1-CD2 3.55Å; V18-Y26 HydrophobicContact CG1-CE2 3.74Å; Q22-Y26 HydrophobicContact CB-CD2 4.16Å; Q22-Y26 HydrophobicContact CB-CE2 3.72Å; Q22-Y26 WeakPolarHBondContact O-CD2 3.18Å; Q22-Y26 PolarHBondContact O-N 3.48Å; Q22-Y26 PolarHBondContact OE1-OH 2.9Å; I23-Y26 PolarHBondContact O-N 2.88Å; Y26-N28 VanDerWaalsContact C-N 3.34Å; Y26-I29 PolarHBondContact O-N 3.26Å; Y26-F30 VanDerWaalsContact O-CB 3.26Å; Y26-F30 WeakPolarHBondContact O-CB 3.43Å; Y26-F30 PolarHBondContact O-N 2.76Å; Y26-I546 WeakPolarHBondContact OH-CG1 3.3Å; Y26-I546 WeakPolarHBondContact OH-CG2 3.43Å
27	E	33.8	Very low	39.9	Very low	124 Å²	124	87.7 Å²	87.7	58%	0.579	44%	0.442	S	S	*	.	H	α-helix	trans	-61.2	-44.4	174.6	-78	-178.6	163.2	0	0	110.8	I23 F30 M31	I23-E27 HydrophobicContact CG2-CG 4.3Å; I23-E27 WeakPolarHBondContact O-CB 3.28Å; I23-E27 WeakPolarHBondContact O-CG 3.47Å; I23-E27 PolarHBondContact O-N 2.92Å; E27-F30 PolarHBondContact O-N 3.45Å; E27-M31 VanDerWaalsContact O-CB 3.29Å; E27-M31 WeakPolarHBondContact O-CB 3.33Å; E27-M31 VanDerWaalsContact O-CG 3.23Å; E27-M31 WeakPolarHBondContact O-CG 3.29Å; E27-M31 PolarHBondContact O-N 3.03Å
28	N	37.5	Very low	38.9	Very low	100 Å²	100	89.3 Å²	89.3	54%	0.535	45%	0.449	S	S	.	.	H	α-helix	trans	-65.2	-42.2	177.6	-71.8	-28.5	0	0	0	112.3	S24 D25 Y26 M31 A32	S24-N28 VanDerWaalsContact O-CB 3.3Å; S24-N28 WeakPolarHBondContact O-CB 3.29Å; S24-N28 PolarHBondContact O-N 2.98Å; S24-N28 PolarHBondContact O-ND2 3.11Å; D25-N28 PolarHBondContact O-N 3.5Å; Y26-N28 VanDerWaalsContact C-N 3.34Å; N28-M31 PolarHBondContact O-N 3.4Å; N28-A32 VanDerWaalsContact O-CB 3.26Å; N28-A32 WeakPolarHBondContact O-CB 3.29Å; N28-A32 PolarHBondContact O-N 3.4Å
29	I	41	Very low	38.1	Very low	80 Å²	80	92.6 Å²	92.6	41%	0.41	46%	0.46	S	S	.	.	H	α-helix	trans	-65.4	-43.1	175.7	-69.1	164.3	0	0	0	110.5	D25 Y26 A32 T33	D25-I29 WeakPolarHBondContact O-CB 3.36Å; D25-I29 WeakPolarHBondContact O-CD1 3.48Å; D25-I29 WeakPolarHBondContact O-CG1 3.31Å; D25-I29 PolarHBondContact O-N 2.84Å; Y26-I29 PolarHBondContact O-N 3.26Å; I29-A32 PolarHBondContact O-N 2.85Å; I29-T33 WeakPolarHBondContact O-CB 3.46Å; I29-T33 PolarHBondContact O-N 2.94Å; I29-T33 PolarHBondContact O-OG1 2.97Å
30	F	33.6	Very low	37.7	Very low	151 Å²	151	95 Å²	95	66%	0.662	47%	0.473	S	S	*	.	H	α-helix	trans	-65.1	-43.2	178.3	-168	-90.7	0	0	0	111.3	Y26 E27 T33 Y34	Y26-F30 VanDerWaalsContact O-CB 3.26Å; Y26-F30 WeakPolarHBondContact O-CB 3.43Å; Y26-F30 PolarHBondContact O-N 2.76Å; E27-F30 PolarHBondContact O-N 3.45Å; F30-T33 PolarHBondContact O-N 3.21Å; F30-Y34 VanDerWaalsContact O-CB 3.25Å; F30-Y34 WeakPolarHBondContact O-CB 3.41Å; F30-Y34 PolarHBondContact O-N 3.49Å
31	M	33.7	Very low	37.2	Very low	100 Å²	100	97.5 Å²	97.5	49%	0.493	48%	0.476	S	S	.	.	H	α-helix	trans	-63.2	-43.3	174.1	-74.6	-60	-65.2	0	0	111.8	E27 N28 Y34 L35	E27-M31 VanDerWaalsContact O-CB 3.29Å; E27-M31 WeakPolarHBondContact O-CB 3.33Å; E27-M31 VanDerWaalsContact O-CG 3.23Å; E27-M31 WeakPolarHBondContact O-CG 3.29Å; E27-M31 PolarHBondContact O-N 3.03Å; N28-M31 PolarHBondContact O-N 3.4Å; M31-Y34 PolarHBondContact O-N 3.4Å; M31-L35 WeakPolarHBondContact O-CB 3.26Å; M31-L35 VanDerWaalsContact O-CG 3.22Å; M31-L35 WeakPolarHBondContact O-CG 3.47Å; M31-L35 PolarHBondContact O-N 2.89Å
32	A	34.6	Very low	36.7	Very low	45 Å²	45	96.5 Å²	96.5	37%	0.372	47%	0.466	S	S	.	.	H	α-helix	trans	-61.5	-45	174.8	0	0	0	0	0	111.4	N28 I29 Y34 L35 I36	N28-A32 VanDerWaalsContact O-CB 3.26Å; N28-A32 WeakPolarHBondContact O-CB 3.29Å; N28-A32 PolarHBondContact O-N 3.4Å; I29-A32 PolarHBondContact O-N 2.85Å; A32-Y34 VanDerWaalsContact C-N 3.33Å; A32-Y34 PolarHBondContact O-N 3.47Å; A32-L35 PolarHBondContact O-N 3.08Å; A32-I36 WeakPolarHBondContact O-CB 3.28Å; A32-I36 WeakPolarHBondContact O-CD1 3.41Å; A32-I36 WeakPolarHBondContact O-CG1 3.41Å; A32-I36 PolarHBondContact O-N 3.15Å
33	T	35.8	Very low	36.5	Very low	69 Å²	69	98.8 Å²	98.8	42%	0.423	48%	0.48	S	S	.	.	H	α-helix	trans	-66.2	-36.7	178.2	-45.5	0	0	0	0	111.7	I29 F30 K37	I29-T33 WeakPolarHBondContact O-CB 3.46Å; I29-T33 PolarHBondContact O-N 2.94Å; I29-T33 PolarHBondContact O-OG1 2.97Å; F30-T33 PolarHBondContact O-N 3.21Å; T33-K37 WeakPolarHBondContact O-CB 3.19Å; T33-K37 PolarHBondContact O-N 3.5Å
34	Y	33.4	Very low	36.7	Very low	112 Å²	112	102.4 Å²	102.4	44%	0.439	49%	0.493	S	S	.	.	H	α-helix	trans	-66.8	-44	174.9	-179.2	-101	0	0	0	111.8	F30 M31 A32 K37 Q38	F30-Y34 VanDerWaalsContact O-CB 3.25Å; F30-Y34 WeakPolarHBondContact O-CB 3.41Å; F30-Y34 PolarHBondContact O-N 3.49Å; M31-Y34 PolarHBondContact O-N 3.4Å; A32-Y34 VanDerWaalsContact C-N 3.33Å; A32-Y34 PolarHBondContact O-N 3.47Å; Y34-K37 PolarHBondContact O-N 3.2Å; Y34-Q38 HydrophobicContact CE1-CG 4.22Å; Y34-Q38 PolarHBondContact O-N 2.66Å; Y34-Q38 PolarHBondContact OH-NE2 3.37Å
35	L	34.1	Very low	36.5	Very low	96 Å²	96	103.6 Å²	103.6	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-65.2	-44.4	175.9	-71.1	169.2	0	0	0	111.6	M31 A32 K37 Q38 E39	M31-L35 WeakPolarHBondContact O-CB 3.26Å; M31-L35 VanDerWaalsContact O-CG 3.22Å; M31-L35 WeakPolarHBondContact O-CG 3.47Å; M31-L35 PolarHBondContact O-N 2.89Å; A32-L35 PolarHBondContact O-N 3.08Å; L35-K37 VanDerWaalsContact C-N 3.28Å; L35-K37 PolarHBondContact O-N 3.23Å; L35-Q38 PolarHBondContact O-N 2.85Å; L35-Q38 VanDerWaalsContact O-N 3.08Å; L35-E39 PolarHBondContact O-N 2.82Å
36	I	38	Very low	36.2	Very low	92 Å²	92	103.1 Å²	103.1	47%	0.472	50%	0.496	S	S	.	.	H	α-helix	trans	-60.7	-38.2	174.1	-69	164.4	0	0	0	110.9	A32 N40	A32-I36 WeakPolarHBondContact O-CB 3.28Å; A32-I36 WeakPolarHBondContact O-CD1 3.41Å; A32-I36 WeakPolarHBondContact O-CG1 3.41Å; A32-I36 PolarHBondContact O-N 3.15Å; I36-N40 WeakPolarHBondContact CG2-ND2 3.27Å; I36-N40 VanDerWaalsContact O-CB 3.32Å; I36-N40 WeakPolarHBondContact O-CB 3.5Å; I36-N40 PolarHBondContact O-N 3.36Å; I36-N40 PolarHBondContact O-ND2 3.32Å
37	K	36.1	Very low	36.3	Very low	152 Å²	152	102 Å²	102	66%	0.661	50%	0.498	S	S	*	.	H	α-helix	trans	-68.7	-35.3	174.2	-88.4	-177.1	176.5	174.8	0	112.7	T33 Y34 L35 Y41	T33-K37 WeakPolarHBondContact O-CB 3.19Å; T33-K37 PolarHBondContact O-N 3.5Å; Y34-K37 PolarHBondContact O-N 3.2Å; L35-K37 VanDerWaalsContact C-N 3.28Å; L35-K37 PolarHBondContact O-N 3.23Å; K37-Y41 VanDerWaalsContact O-CB 3.28Å; K37-Y41 WeakPolarHBondContact O-CB 3.21Å; K37-Y41 PolarHBondContact O-N 3.5Å
38	Q	35	Very low	36.4	Very low	70 Å²	70	103.6 Å²	103.6	33%	0.327	51%	0.505	S	S	.	.	H	α-helix	trans	-68.9	-47	174.2	-75.3	-144	28.3	0	0	111.4	Y34 L35 N40 Y41 Y42	Y34-Q38 HydrophobicContact CE1-CG 4.22Å; Y34-Q38 PolarHBondContact O-N 2.66Å; Y34-Q38 PolarHBondContact OH-NE2 3.37Å; L35-Q38 PolarHBondContact O-N 2.85Å; L35-Q38 VanDerWaalsContact O-N 3.08Å; Q38-N40 PolarHBondContact O-N 3.17Å; Q38-Y41 WeakPolarHBondContact O-CB 3.46Å; Q38-Y41 PolarHBondContact O-N 3.38Å; Q38-Y41 VanDerWaalsContact O-N 3.07Å; Q38-Y42 WeakPolarHBondContact O-CD2 3.29Å; Q38-Y42 PolarHBondContact O-N 2.99Å
39	E	34.2	Very low	36.3	Very low	130 Å²	130	103.2 Å²	103.2	61%	0.607	51%	0.51	S	S	*	.	H	α-helix	trans	-57.6	-48.2	175.2	-80.5	-178.4	155.3	0	0	111	L35 Y41 Y42 D43	L35-E39 PolarHBondContact O-N 2.82Å; E39-Y41 VanDerWaalsContact C-N 3.25Å; E39-Y41 PolarHBondContact O-N 2.92Å; E39-Y42 PolarHBondContact O-N 3.04Å; E39-D43 WeakPolarHBondContact O-CB 3.34Å; E39-D43 PolarHBondContact O-N 3.43Å
40	N	43.5	Very low	35.9	Very low	91 Å²	91	106.8 Å²	106.8	49%	0.487	52%	0.522	S	S	.	.	H	α-helix	trans	-65.3	-24.8	176.2	-78.3	-60	0	0	0	114.1	I36 Q38 K44	I36-N40 WeakPolarHBondContact CG2-ND2 3.27Å; I36-N40 VanDerWaalsContact O-CB 3.32Å; I36-N40 WeakPolarHBondContact O-CB 3.5Å; I36-N40 PolarHBondContact O-N 3.36Å; I36-N40 PolarHBondContact O-ND2 3.32Å; Q38-N40 PolarHBondContact O-N 3.17Å; N40-K44 WeakPolarHBondContact O-CB 3.41Å; N40-K44 WeakPolarHBondContact O-CG 3.5Å; N40-K44 PolarHBondContact O-N 2.89Å; N40-K44 VanDerWaalsContact O-N 3.09Å
41	Y	34.9	Very low	35.8	Very low	150 Å²	150	109.1 Å²	109.1	59%	0.588	53%	0.528	S	S	*	.	H	α-helix	trans	-77	-41.9	174.3	-169.3	-100.8	0	0	0	111	K37 Q38 E39 K44 L45	K37-Y41 VanDerWaalsContact O-CB 3.28Å; K37-Y41 WeakPolarHBondContact O-CB 3.21Å; K37-Y41 PolarHBondContact O-N 3.5Å; Q38-Y41 WeakPolarHBondContact O-CB 3.46Å; Q38-Y41 PolarHBondContact O-N 3.38Å; Q38-Y41 VanDerWaalsContact O-N 3.07Å; E39-Y41 VanDerWaalsContact C-N 3.25Å; E39-Y41 PolarHBondContact O-N 2.92Å; Y41-K44 PolarHBondContact O-N 2.95Å; Y41-L45 HydrophobicContact CD1-CD1 3.53Å; Y41-L45 HydrophobicContact CD2-CD1 4.47Å; Y41-L45 HydrophobicContact CE1-CD1 3.19Å; Y41-L45 HydrophobicContact CE2-CD1 4.19Å; Y41-L45 HydrophobicContact CG-CD1 4.17Å; Y41-L45 WeakPolarHBondContact O-CD1 3.18Å; Y41-L45 PolarHBondContact O-N 3.49Å
42	Y	35	Very low	35.7	Very low	152 Å²	152	113.3 Å²	113.3	60%	0.596	55%	0.547	S	S	*	.	H	α-helix	trans	-67.9	-35.5	173.2	-79.5	-71.4	0	0	0	112.3	Q38 E39 L45 S46	Q38-Y42 WeakPolarHBondContact O-CD2 3.29Å; Q38-Y42 PolarHBondContact O-N 2.99Å; E39-Y42 PolarHBondContact O-N 3.04Å; Y42-L45 PolarHBondContact O-N 3.33Å; Y42-S46 VanDerWaalsContact O-CB 3.22Å; Y42-S46 WeakPolarHBondContact O-CB 3.33Å; Y42-S46 PolarHBondContact O-N 2.92Å; Y42-S46 PolarHBondContact O-OG 3.25Å
43	D	39.3	Very low	35.5	Very low	97 Å²	97	117.4 Å²	117.4	52%	0.519	56%	0.562	S	S	.	*	H	α-helix	trans	-69.7	-33.7	173.7	-74	-22.8	0	0	0	112.1	E39 S46 S47	E39-D43 WeakPolarHBondContact O-CB 3.34Å; E39-D43 PolarHBondContact O-N 3.43Å; D43-S46 WeakPolarHBondContact CA-OG 3.4Å; D43-S46 PolarHBondContact O-OG 3.49Å; D43-S47 WeakPolarHBondContact O-CB 3.29Å; D43-S47 PolarHBondContact O-N 3.03Å; D43-S47 PolarHBondContact O-OG 3.32Å
44	K	41.3	Very low	35.1	Very low	147 Å²	147	121.2 Å²	121.2	64%	0.639	58%	0.579	S	S	*	*	H	α-helix	trans	-72.1	-35.7	172.5	-86.3	-179.7	176.6	177.1	0	113.4	N40 Y41 S47 Q48	N40-K44 WeakPolarHBondContact O-CB 3.41Å; N40-K44 WeakPolarHBondContact O-CG 3.5Å; N40-K44 PolarHBondContact O-N 2.89Å; N40-K44 VanDerWaalsContact O-N 3.09Å; Y41-K44 PolarHBondContact O-N 2.95Å; K44-S47 WeakPolarHBondContact CA-OG 3.39Å; K44-S47 PolarHBondContact O-OG 3.27Å; K44-Q48 WeakPolarHBondContact O-CB 3.36Å; K44-Q48 PolarHBondContact O-N 3.44Å
45	L	34	Very low	34.8	Very low	89 Å²	89	122.9 Å²	122.9	47%	0.466	60%	0.595	S	S	.	*	H	α-helix	trans	-73.5	-37.3	173.2	-94.4	119	0	0	0	112.4	Y41 Y42 S49	Y41-L45 HydrophobicContact CD1-CD1 3.53Å; Y41-L45 HydrophobicContact CD2-CD1 4.47Å; Y41-L45 HydrophobicContact CE1-CD1 3.19Å; Y41-L45 HydrophobicContact CE2-CD1 4.19Å; Y41-L45 HydrophobicContact CG-CD1 4.17Å; Y41-L45 WeakPolarHBondContact O-CD1 3.18Å; Y41-L45 PolarHBondContact O-N 3.49Å; Y42-L45 PolarHBondContact O-N 3.33Å; L45-S49 WeakPolarHBondContact O-CB 3.37Å; L45-S49 PolarHBondContact O-N 2.97Å; L45-S49 VanDerWaalsContact O-N 3.09Å; L45-S49 PolarHBondContact O-OG 3.42Å
46	S	35.8	Very low	34.5	Very low	54 Å²	54	125 Å²	125	38%	0.378	61%	0.607	S	S	.	*	H	α-helix	trans	-70.2	-37	176.9	76.4	0	0	0	0	111.5	Y42 D43 S49 K50	Y42-S46 VanDerWaalsContact O-CB 3.22Å; Y42-S46 WeakPolarHBondContact O-CB 3.33Å; Y42-S46 PolarHBondContact O-N 2.92Å; Y42-S46 PolarHBondContact O-OG 3.25Å; D43-S46 WeakPolarHBondContact CA-OG 3.4Å; D43-S46 PolarHBondContact O-OG 3.49Å; S46-S49 PolarHBondContact O-OG 3.21Å; S46-K50 PolarHBondContact O-N 2.88Å
47	S	37.8	Very low	34.1	Very low	42 Å²	42	128.7 Å²	128.7	29%	0.294	63%	0.626	S	S	.	*	H	α-helix	trans	-72.4	-41	173.9	54.5	0	0	0	0	112.6	D43 K44 S49 K50 Y51	D43-S47 WeakPolarHBondContact O-CB 3.29Å; D43-S47 PolarHBondContact O-N 3.03Å; D43-S47 PolarHBondContact O-OG 3.32Å; K44-S47 WeakPolarHBondContact CA-OG 3.39Å; K44-S47 PolarHBondContact O-OG 3.27Å; S47-S49 VanDerWaalsContact C-N 3.28Å; S47-S49 PolarHBondContact O-N 2.82Å; S47-K50 PolarHBondContact O-N 3.49Å; S47-K50 VanDerWaalsContact O-N 3.09Å; S47-Y51 WeakPolarHBondContact O-CD2 3.5Å; S47-Y51 WeakPolarHBondContact O-CE2 3.28Å; S47-Y51 PolarHBondContact O-N 3.01Å
48	Q	35.9	Very low	33.7	Very low	157 Å²	157	128.1 Å²	128.1	73%	0.734	63%	0.63	S	S	*	*	H	α-helix	trans	-67.7	-23.7	174.9	-85.1	176.1	-42.1	0	0	114.2	K44	K44-Q48 WeakPolarHBondContact O-CB 3.36Å; K44-Q48 PolarHBondContact O-N 3.44Å
49	S	34.9	Very low	33.5	Very low	91 Å²	91	130.8 Å²	130.8	64%	0.636	65%	0.647	S	S	*	*	H	α-helix	trans	-83.5	-12.5	171.1	71.7	0	0	0	0	114.4	L45 S46 S47	L45-S49 WeakPolarHBondContact O-CB 3.37Å; L45-S49 PolarHBondContact O-N 2.97Å; L45-S49 VanDerWaalsContact O-N 3.09Å; L45-S49 PolarHBondContact O-OG 3.42Å; S46-S49 PolarHBondContact O-OG 3.21Å; S47-S49 VanDerWaalsContact C-N 3.28Å; S47-S49 PolarHBondContact O-N 2.82Å
50	K	33.1	Very low	33.3	Very low	155 Å²	155	131 Å²	131	67%	0.674	65%	0.652	S	S	*	*	H	α-helix	trans	-96.3	-13.7	179	-93	179.9	173.4	177.9	0	114.2	S46 S47 E52 L53	S46-K50 PolarHBondContact O-N 2.88Å; S47-K50 PolarHBondContact O-N 3.49Å; S47-K50 VanDerWaalsContact O-N 3.09Å; K50-E52 PolarHBondContact O-N 3.44Å; K50-L53 PolarHBondContact O-N 3.04Å
51	Y	31.5	Very low	32.7	Very low	201 Å²	201	133.9 Å²	133.9	79%	0.788	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	6.6	179.1	-75.8	-67.6	0	0	0	115.1	S47	S47-Y51 WeakPolarHBondContact O-CD2 3.5Å; S47-Y51 WeakPolarHBondContact O-CE2 3.28Å; S47-Y51 PolarHBondContact O-N 3.01Å
52	E	32	Very low	32.4	Very low	188 Å²	188	133.7 Å²	133.7	88%	0.879	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	1.1	165.9	-86.3	-176.2	164.8	0	0	113.8	K50	K50-E52 PolarHBondContact O-N 3.44Å
53	L	29.9	Very low	32.1	Very low	131 Å²	131	131.9 Å²	131.9	69%	0.686	69%	0.686	S	S	*	*	S	Bend	trans	-143	116.8	177.5	-127.4	98.1	0	0	0	110.3	K50	K50-L53 PolarHBondContact O-N 3.04Å
54	L	27.8	Very low	31.8	Very low	149 Å²	149	131.4 Å²	131.4	78%	0.78	69%	0.69	S	S	*	*			trans	98.2	77.7	164.1	-54	152.1	0	0	0	115.6
55	D	26.3	Very low	31.8	Very low	146 Å²	146	130.3 Å²	130.3	78%	0.781	69%	0.691	S	S	*	*				-44	140.8	127.6	-76	-42.1	0	0	0	110.5
56	N	27.6	Very low	31.6	Very low	141 Å²	141	130.9 Å²	130.9	75%	0.754	70%	0.698	S	S	*	*			trans	79.4	103.1	175.3	-48.3	-47.1	0	0	0	115.6
57	I	30.3	Very low	31.4	Very low	169 Å²	169	135.3 Å²	135.3	87%	0.867	71%	0.713	S	S	*	*				174.3	122	115.6	-83.7	152.5	0	0	0	108.2
58	N	28.2	Very low	31.3	Very low	141 Å²	141	137 Å²	137	75%	0.754	72%	0.722	S	S	*	*			trans	-71.5	158.6	168.2	-116.7	1.9	0	0	0	110.6
59	D	30.3	Very low	31	Very low	126 Å²	126	134.1 Å²	134.1	67%	0.674	71%	0.711	S	S	*	*			trans	91.5	118.4	156.4	-57.2	-24.3	0	0	0	119.9
60	N	29.2	Very low	31	Very low	135 Å²	135	133.9 Å²	133.9	72%	0.722	70%	0.701	S	S	*	*			trans	60.2	112.7	140.3	-60.4	-29.4	0	0	0	119.8
61	N	31.5	Very low	31.1	Very low	151 Å²	151	135.3 Å²	135.3	81%	0.807	70%	0.703	S	S	*	*				176.9	122.2	118	-88.6	-20.3	0	0	0	113.7
62	D	28.7	Very low	31.3	Very low	145 Å²	145	131.9 Å²	131.9	78%	0.775	69%	0.694	S	S	*	*			trans	33	113.7	138.2	-64.4	-19.5	0	0	0	121.4
63	S	29.4	Very low	31.4	Very low	114 Å²	114	130.8 Å²	130.8	80%	0.797	69%	0.687	S	S	*	*			trans	-117.1	80.4	156.1	68.9	0	0	0	0	110.9	N65	S63-N65 VanDerWaalsContact C-N 3.29Å; S63-N65 PolarHBondContact O-N 3.29Å
64	S	32.5	Very low	31.7	Very low	87 Å²	87	131.9 Å²	131.9	61%	0.608	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	21.8	179.8	52.4	0	0	0	0	115	T68	S64-T68 PolarHBondContact O-OG1 3.11Å
65	N	40.8	Very low	31.9	Very low	124 Å²	124	129.1 Å²	129.1	66%	0.663	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-21.9	-171.6	-86.6	-18.4	0	0	0	116	S63	S63-N65 VanDerWaalsContact C-N 3.29Å; S63-N65 PolarHBondContact O-N 3.29Å
66	V	31.1	Very low	32.2	Very low	101 Å²	101	132 Å²	132	61%	0.612	69%	0.686	S	S	*	*	H	α-helix	trans	-79.6	-35.8	-176	-179.2	0	0	0	0	112.3	T68 I70	V66-T68 PolarHBondContact O-N 2.74Å; V66-I70 HydrophobicContact CG1-CD1 4.14Å; V66-I70 WeakPolarHBondContact O-CG1 3.46Å; V66-I70 PolarHBondContact O-N 2.95Å
67	E	30.7	Very low	32.4	Very low	148 Å²	148	130.7 Å²	130.7	69%	0.692	69%	0.689	S	S	*	*	H	α-helix	trans	-74.7	-26.1	-177.3	-129.1	164.8	-179.8	0	0	113.2	R71	E67-R71 PolarHBondContact O-N 2.92Å
68	T	36.2	Very low	32.3	Very low	77 Å²	77	130 Å²	130	47%	0.472	69%	0.687	S	S	.	*	H	α-helix	trans	-73.7	-36.4	177.2	-42.3	0	0	0	0	112	S64 V66 Q72	S64-T68 PolarHBondContact O-OG1 3.11Å; V66-T68 PolarHBondContact O-N 2.74Å; T68-Q72 PolarHBondContact O-N 2.91Å
69	L	29.9	Very low	32.5	Very low	96 Å²	96	130.7 Å²	130.7	50%	0.503	69%	0.69	S	S	.	*	H	α-helix	trans	-68.9	-39.4	176.2	-91.1	152.8	0	0	0	111.6	R71 Q72 F73	L69-R71 PolarHBondContact O-N 3.29Å; L69-Q72 PolarHBondContact O-N 2.82Å; L69-F73 HydrophobicContact CD2-CE2 4.12Å; L69-F73 WeakPolarHBondContact O-CD2 3.37Å
70	I	34.7	Very low	32.5	Very low	86 Å²	86	131.4 Å²	131.4	44%	0.441	69%	0.694	S	S	.	*	H	α-helix	trans	-69	-35.8	-179.4	-65.3	169.4	0	0	0	112.1	V66 Q72 F73	V66-I70 HydrophobicContact CG1-CD1 4.14Å; V66-I70 WeakPolarHBondContact O-CG1 3.46Å; V66-I70 PolarHBondContact O-N 2.95Å; I70-Q72 VanDerWaalsContact C-N 3.33Å; I70-Q72 PolarHBondContact O-N 3.29Å; I70-F73 PolarHBondContact O-N 3.02Å
71	R	33.7	Very low	32.6	Very low	186 Å²	186	132 Å²	132	70%	0.702	70%	0.698	S	S	*	*	H	α-helix	trans	-71	-25.7	175.5	-74.6	-175.8	178.9	-152.5	2.2	113.6	E67 L69 F73 S75	E67-R71 PolarHBondContact O-N 2.92Å; L69-R71 PolarHBondContact O-N 3.29Å; R71-F73 VanDerWaalsContact C-N 3.32Å; R71-S75 PolarHBondContact O-OG 2.88Å; R71-S75 VanDerWaalsContact O-OG 3.08Å
72	Q	35.9	Very low	32.6	Very low	128 Å²	128	132.1 Å²	132.1	60%	0.598	70%	0.698	S	S	*	*	H	α-helix	trans	-73.4	-21.6	175.4	-77.9	-179.1	-18.9	0	0	113.2	T68 L69 I70 S75	T68-Q72 PolarHBondContact O-N 2.91Å; L69-Q72 PolarHBondContact O-N 2.82Å; I70-Q72 VanDerWaalsContact C-N 3.33Å; I70-Q72 PolarHBondContact O-N 3.29Å; Q72-S75 PolarHBondContact O-OG 3.46Å
73	F	35.1	Very low	32.7	Very low	166 Å²	166	132.6 Å²	132.6	73%	0.728	70%	0.7	S	S	*	*	H	α-helix	trans	-91.6	-16.5	177.6	-68.8	-67.4	0	0	0	114.3	L69 I70 R71	L69-F73 HydrophobicContact CD2-CE2 4.12Å; L69-F73 WeakPolarHBondContact O-CD2 3.37Å; I70-F73 PolarHBondContact O-N 3.02Å; R71-F73 VanDerWaalsContact C-N 3.32Å
74	Q	36.3	Very low	32.8	Very low	154 Å²	154	133 Å²	133	72%	0.72	70%	0.703	S	S	*	*	S	Bend	trans	-86.3	-3.7	178.3	-70.2	-179.7	-11	0	0	114.2
75	S	32	Very low	32.8	Very low	90 Å²	90	135.1 Å²	135.1	63%	0.629	71%	0.708	S	S	*	*	S	Bend	trans	-104.4	20.8	-168.8	35.3	0	0	0	0	115.7	R71 Q72	R71-S75 PolarHBondContact O-OG 2.88Å; R71-S75 VanDerWaalsContact O-OG 3.08Å; Q72-S75 PolarHBondContact O-OG 3.46Å
76	K	33.2	Very low	32.4	Very low	206 Å²	206	137.1 Å²	137.1	90%	0.896	72%	0.719	S	S	*	*	S	Bend	trans	-123	9.7	179	-91.5	-179.1	178.1	175.4	0	117.6
77	S	31.2	Very low	32.7	Very low	115 Å²	115	138.5 Å²	138.5	80%	0.804	72%	0.723	S	S	*	*	S	Bend	trans	-111.9	69.3	170.9	-167.6	0	0	0	0	111
78	N	28.4	Very low	32.8	Very low	155 Å²	155	139.8 Å²	139.8	83%	0.829	73%	0.734	S	S	*	*			trans	-165.6	91.5	163.7	-114.4	-4.1	0	0	0	109
79	N	30.9	Very low	33	Very low	154 Å²	154	140.2 Å²	140.2	82%	0.824	74%	0.741	S	S	*	*			trans	177.4	135.5	139.9	-101	-19.9	0	0	0	112.6
80	N	30.4	Very low	33.3	Very low	141 Å²	141	144 Å²	144	75%	0.754	76%	0.761	S	S	*	*			trans	114.4	113.7	153	-64.2	-12.1	0	0	0	118.1
81	N	32.5	Very low	33.3	Very low	149 Å²	149	145 Å²	145	80%	0.797	78%	0.776	S	S	*	*			trans	100.9	80.1	154	-59.8	-11.8	0	0	0	115.1
82	N	31.9	Very low	33.5	Very low	152 Å²	152	143.6 Å²	143.6	81%	0.813	78%	0.782	S	S	*	*				49.1	114.9	79.4	-82	-10.9	0	0	0	115.2
83	N	29.4	Very low	33.4	Very low	155 Å²	155	144.9 Å²	144.9	83%	0.829	79%	0.793	S	S	*	*			trans	59.4	106.7	150	-82.6	-7.5	0	0	0	119.6
84	S	31.5	Very low	33.4	Very low	122 Å²	122	141.4 Å²	141.4	85%	0.853	79%	0.789	S	S	*	*				-166	118.3	103.7	-171.7	0	0	0	0	110.8
85	N	33.1	Very low	33.4	Very low	132 Å²	132	140.5 Å²	140.5	71%	0.706	79%	0.79	S	S	*	*			trans	-56.6	143.8	172.4	-85.5	-27.1	0	0	0	112.5
86	N	32.6	Very low	33.5	Very low	167 Å²	167	143.4 Å²	143.4	89%	0.893	80%	0.798	S	S	*	*			trans	-136.6	76.1	151.3	-130.9	4.8	0	0	0	107.9
87	N	37.4	Very low	33.7	Very low	130 Å²	130	138.3 Å²	138.3	70%	0.695	79%	0.788	S	S	*	*			trans	-92.8	111	172.3	-93.4	-8.2	0	0	0	108.9	S89	N87-S89 PolarHBondContact O-N 2.87Å
88	N	33.5	Very low	33.9	Very low	174 Å²	174	140.5 Å²	140.5	93%	0.93	79%	0.791	S	S	*	*			trans	-78.1	90.8	162.7	-147.6	10.2	0	0	0	106.7
89	S	38.7	Very low	34.2	Very low	87 Å²	87	136.9 Å²	136.9	61%	0.608	79%	0.79	S	S	*	*			trans	-109	114.1	175.4	-63.7	0	0	0	0	109.6	N87 S91	N87-S89 PolarHBondContact O-N 2.87Å; S89-S91 PolarHBondContact O-N 3.33Å; S89-S91 VanDerWaalsContact O-N 3.08Å
90	N	36	Very low	34.4	Very low	174 Å²	174	136.5 Å²	136.5	93%	0.93	79%	0.788	S	S	*	*			trans	-65.8	98.1	167.9	-144.2	13.4	0	0	0	107.8
91	S	36.2	Very low	34.8	Very low	107 Å²	107	136.5 Å²	136.5	75%	0.748	79%	0.788	S	S	*	*			trans	-96.5	115.5	174.3	66.3	0	0	0	0	110	S89	S89-S91 PolarHBondContact O-N 3.33Å; S89-S91 VanDerWaalsContact O-N 3.08Å
92	N	36.6	Very low	34.9	Very low	158 Å²	158	136.1 Å²	136.1	85%	0.845	79%	0.786	S	S	*	*			trans	-83.5	144.1	154.8	-103.4	-14.3	0	0	0	109.3
93	N	35.6	Very low	35.2	Very low	155 Å²	155	136.7 Å²	136.7	83%	0.829	79%	0.789	S	S	*	*			trans	82.4	107.5	160.8	-83.1	-5.4	0	0	0	120
94	S	34.9	Very low	35.4	Very low	92 Å²	92	136.6 Å²	136.6	64%	0.643	79%	0.789	S	S	*	*				100.4	102.1	112.6	164.1	0	0	0	0	117.2
95	N	35.4	Very low	35.7	Very low	136 Å²	136	138 Å²	138	73%	0.727	79%	0.792	S	S	*	*			trans	99.5	110.7	132	-69	-9.9	0	0	0	119.7
96	N	34.6	Very low	35.7	Very low	150 Å²	150	138.5 Å²	138.5	80%	0.802	80%	0.795	S	S	*	*				80.7	102.2	129	-79.6	-5.9	0	0	0	119.6
97	S	36.4	Very low	35.9	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	79%	0.794	S	S	*	*				123.8	107.9	103.6	-167.9	0	0	0	0	114.6
98	N	37.1	Very low	35.8	Very low	162 Å²	162	136.1 Å²	136.1	87%	0.866	80%	0.802	S	S	*	*			trans	52.3	127.3	137.3	-71.4	-10.9	0	0	0	121.4
99	G	34.1	Very low	35.8	Very low	78 Å²	78	135.8 Å²	135.8	80%	0.804	80%	0.8	S	S	*	*			trans	155.2	67.3	143	0	0	0	0	0	117.9
100	N	35.4	Very low	35.7	Very low	147 Å²	147	137.1 Å²	137.1	79%	0.786	81%	0.809	S	S	*	*			trans	-9.9	131.4	148.1	-104.4	-0.7	0	0	0	118.2
101	N	38.1	Very low	35.7	Very low	141 Å²	141	135.2 Å²	135.2	75%	0.754	80%	0.799	S	S	*	*				163.5	146.2	97.1	-95.9	-20.1	0	0	0	114.8
102	N	34.9	Very low	35.6	Very low	140 Å²	140	136.6 Å²	136.6	75%	0.749	80%	0.798	S	S	*	*			trans	-56.1	157.3	175.2	-65.8	-37	0	0	0	115.7
103	N	38.4	Very low	35.6	Very low	164 Å²	164	135.1 Å²	135.1	88%	0.877	79%	0.79	S	S	*	*				-175.4	139.1	116	-91.9	-18.9	0	0	0	114.5
104	N	33.1	Very low	35.5	Very low	154 Å²	154	136.7 Å²	136.7	82%	0.824	79%	0.789	S	S	*	*			trans	-65	159.6	166	-76.3	-30.4	0	0	0	112.5
105	T	37.3	Very low	35.5	Very low	150 Å²	150	139.3 Å²	139.3	92%	0.92	80%	0.802	S	S	*	*			trans	-171.4	150.1	131.9	16.5	0	0	0	0	113.3
106	N	34.2	Very low	35.3	Very low	143 Å²	143	141.2 Å²	141.2	77%	0.765	81%	0.812	S	S	*	*			trans	-82.5	177.4	-174.7	-77.6	-27.7	0	0	0	114.6
107	D	36.1	Very low	35.3	Very low	166 Å²	166	138 Å²	138	89%	0.888	82%	0.815	S	S	*	*			trans	99.5	133.2	143.7	-62.7	-34.5	0	0	0	119
108	G	36.4	Very low	35.2	Very low	82 Å²	82	140.5 Å²	140.5	85%	0.845	82%	0.82	S	S	*	*			trans	154.8	87.2	161.9	0	0	0	0	0	115.8
109	N	32	Very low	35.1	Very low	166 Å²	166	140 Å²	140	89%	0.888	82%	0.817	S	S	*	*			trans	-96.3	132.2	171.1	-166.3	19.7	0	0	0	109.3
110	S	37.5	Very low	34.9	Very low	115 Å²	115	139.7 Å²	139.7	80%	0.804	81%	0.814	S	S	*	*			trans	-175.2	123.4	150.7	-165.9	0	0	0	0	115.2
111	N	34.8	Very low	34.6	Very low	134 Å²	134	138.9 Å²	138.9	72%	0.717	82%	0.819	S	S	*	*			trans	-13.3	149.6	153.6	-76.9	-21.5	0	0	0	124.2
112	N	36	Very low	34.3	Very low	136 Å²	136	137.9 Å²	137.9	73%	0.727	82%	0.823	S	S	*	*				102.5	127.1	128.4	-82.1	-10.3	0	0	0	122.8
113	N	36.4	Very low	34	Very low	128 Å²	128	137.6 Å²	137.6	68%	0.684	82%	0.821	S	S	*	*			trans	103.5	113.3	136	-78.1	-23	0	0	0	122.1
114	K	32.1	Very low	33.7	Very low	187 Å²	187	137.7 Å²	137.7	81%	0.813	82%	0.822	S	S	*	*				59.1	125.3	129	-76.3	178.4	174.2	174.1	0	120.5
115	T	35.9	Very low	33.5	Very low	147 Å²	147	136.5 Å²	136.5	90%	0.902	82%	0.816	S	S	*	*				-163.7	135.1	118.2	35.4	0	0	0	0	112.2
116	N	30.6	Very low	33.3	Very low	176 Å²	176	137.1 Å²	137.1	94%	0.941	81%	0.813	S	S	*	*			trans	-78	155	175.6	-82.7	-18.3	0	0	0	112.9
117	G	35	Very low	33.1	Very low	84 Å²	84	136.9 Å²	136.9	87%	0.866	81%	0.812	S	S	*	*			trans	-148.4	134.1	161.6	0	0	0	0	0	110.1
118	N	33.7	Very low	32.7	Very low	151 Å²	151	134.9 Å²	134.9	81%	0.807	80%	0.8	S	S	*	*			trans	-118.1	164.1	-149.7	-145.9	12.2	0	0	0	112.7
119	N	34.5	Very low	32.4	Very low	150 Å²	150	137.9 Å²	137.9	80%	0.802	80%	0.797	S	S	*	*			trans	106.6	128.4	145.7	-62.9	-15.5	0	0	0	123.1
120	G	31.4	Very low	32	Very low	72 Å²	72	135.8 Å²	135.8	74%	0.742	79%	0.793	S	S	*	*			trans	137.7	80.8	148.4	0	0	0	0	0	115.7
121	C	28.4	Very low	31.7	Very low	131 Å²	131	135.9 Å²	135.9	89%	0.885	79%	0.794	S	S	*	*				63.2	131.3	104	-80.1	0	0	0	0	115.6
122	S	32.3	Very low	31.3	Very low	119 Å²	119	137.1 Å²	137.1	83%	0.832	80%	0.801	S	S	*	*			cis	-158.6	162.7	16.3	-73	0	0	0	0	111.1
123	N	28.8	Very low	31.1	Very low	134 Å²	134	136.3 Å²	136.3	72%	0.717	81%	0.806	S	S	*	*			trans	-112.6	141.1	-176.6	-156.5	22	0	0	0	108.2
124	D	32	Very low	30.9	Very low	166 Å²	166	136.5 Å²	136.5	89%	0.888	81%	0.807	S	S	*	*			trans	-139.3	111.4	162.6	-88.4	-32.4	0	0	0	110.5
125	N	27.9	Very low	30.9	Very low	130 Å²	130	134.6 Å²	134.6	70%	0.695	81%	0.806	S	S	*	*			trans	-98.1	145.7	165.3	-88.1	-31.5	0	0	0	108.5
126	N	33.4	Very low	30.8	Very low	162 Å²	162	132 Å²	132	87%	0.866	79%	0.794	S	S	*	*			trans	-168.2	99.4	147.9	-90.1	-28.2	0	0	0	108.3
127	N	29.6	Very low	30.9	Very low	139 Å²	139	130 Å²	130	74%	0.743	78%	0.783	S	S	*	*				63	118.7	81.1	-110.6	4.5	0	0	0	117.6
128	I	27.4	Very low	30.9	Very low	123 Å²	123	131.8 Å²	131.8	63%	0.631	77%	0.773	S	S	*	*			trans	72.8	114.5	134.3	-62.7	164.7	0	0	0	119.1
129	N	30.3	Very low	30.8	Very low	146 Å²	146	131.8 Å²	131.8	78%	0.781	77%	0.772	S	S	*	*				-176.7	130.5	101.5	-114.3	-23.2	0	0	0	114.1
130	C	23.5	Very low	30.8	Very low	121 Å²	121	129.5 Å²	129.5	82%	0.818	77%	0.769	S	S	*	*			trans	-97.1	140.5	162.7	-69.6	0	0	0	0	108.7
131	S	32.6	Very low	31	Very low	117 Å²	117	130.6 Å²	130.6	82%	0.818	77%	0.765	S	S	*	*			trans	-152.9	115.1	158.8	-70.3	0	0	0	0	110.1
132	N	25.6	Very low	31.3	Very low	160 Å²	160	131.3 Å²	131.3	86%	0.856	76%	0.76	S	S	*	*			trans	-66.7	150.4	167.6	-91.8	-19.3	0	0	0	111.2
133	S	32.7	Very low	31.3	Very low	120 Å²	120	131.7 Å²	131.7	84%	0.839	75%	0.752	S	S	*	*			trans	-158.6	116.4	146.2	176.6	0	0	0	0	111.1
134	N	30.3	Very low	31.4	Very low	132 Å²	132	134.5 Å²	134.5	71%	0.706	76%	0.758	S	S	*	*			trans	-66.8	156.5	176	-66.4	-37.6	0	0	0	113.4
135	N	32.3	Very low	31.4	Very low	146 Å²	146	131.4 Å²	131.4	78%	0.781	75%	0.75	S	S	*	*				169.2	122	109.9	-103.5	-12.4	0	0	0	111.7
136	S	33.6	Very low	31.4	Very low	93 Å²	93	132.7 Å²	132.7	65%	0.65	76%	0.757	S	S	*	*				81.8	141.1	106.5	96.3	0	0	0	0	113.2
137	N	34.6	Very low	31.2	Very low	135 Å²	135	130 Å²	130	72%	0.722	75%	0.751	S	S	*	*			cis	-175.2	161.6	11.4	-127	-3.3	0	0	0	108.5
138	N	34.1	Very low	31.1	Very low	121 Å²	121	131.1 Å²	131.1	65%	0.647	76%	0.756	S	S	*	*			trans	89.4	99.8	145.4	-63.1	-13.6	0	0	0	123
139	N	32.3	Very low	31	Very low	150 Å²	150	129 Å²	129	80%	0.802	77%	0.765	S	S	*	*				60	121.3	111.6	-64.2	-13	0	0	0	121.4
140	S	33.7	Very low	30.8	Very low	103 Å²	103	127 Å²	127	72%	0.72	76%	0.763	S	S	*	*				161.3	129	89.1	-175.9	0	0	0	0	113.6
141	S	35.9	Very low	30.9	Very low	95 Å²	95	131 Å²	131	66%	0.664	76%	0.762	S	S	*	*			trans	60	141.3	143.4	64.7	0	0	0	0	120
142	N	33.6	Very low	30.6	Very low	146 Å²	146	131.5 Å²	131.5	78%	0.781	76%	0.755	S	S	*	*			cis	-173.2	160.3	4	-114.1	-17.3	0	0	0	109
143	N	32.5	Very low	30.5	Very low	126 Å²	126	130.1 Å²	130.1	67%	0.674	75%	0.748	S	S	*	*			trans	96.5	97.9	155.8	-63.8	-23.8	0	0	0	120.8
144	K	31.8	Very low	30.1	Very low	194 Å²	194	131.7 Å²	131.7	84%	0.843	75%	0.747	S	S	*	*				50.1	126.1	119.2	-74	169.6	175.1	168.1	0	116.6
145	S	30.8	Very low	30	Very low	101 Å²	101	132.3 Å²	132.3	71%	0.706	75%	0.746	S	S	*	*			cis	-175.4	145.1	36.8	34.8	0	0	0	0	111.9
146	N	27.8	Very low	29.7	Very low	157 Å²	157	135.8 Å²	135.8	84%	0.84	75%	0.754	S	S	*	*			trans	57.1	124.7	153.8	-62.6	-7.1	0	0	0	117.6
147	S	30.3	Very low	29.5	Very low	106 Å²	106	136.1 Å²	136.1	74%	0.741	75%	0.748	S	S	*	*			cis	-164.9	138.8	28.8	42.2	0	0	0	0	110.6
148	N	28.1	Very low	29.1	Very low	161 Å²	161	139.7 Å²	139.7	86%	0.861	76%	0.758	S	S	*	*			trans	25.1	119.4	150.8	-56.3	-13.7	0	0	0	118
149	G	24.8	Very low	28.8	Very low	79 Å²	79	140.9 Å²	140.9	81%	0.814	76%	0.762	S	S	*	*				77.7	127.8	59.9	0	0	0	0	0	109
150	S	26.9	Very low	28.7	Very low	105 Å²	105	139.8 Å²	139.8	73%	0.734	75%	0.752	S	S	*	*			cis	-177.6	133.3	33.9	167.9	0	0	0	0	109
151	Y	24.5	Very low	28.4	Very low	205 Å²	205	141.2 Å²	141.2	80%	0.804	75%	0.752	S	S	*	*			trans	35.5	134.1	141.5	-66.5	-81.1	0	0	0	124.8
152	N	25.6	Very low	27.9	Very low	126 Å²	126	143.8 Å²	143.8	67%	0.674	76%	0.758	S	S	*	*				105.3	108.7	129.5	-76.7	-4.8	0	0	0	121.6
153	N	24.7	Very low	27.5	Very low	132 Å²	132	143.7 Å²	143.7	71%	0.706	76%	0.758	S	S	*	*				93.5	122	129.2	-66.1	-13.2	0	0	0	120.4
154	N	23.8	Very low	27.3	Very low	152 Å²	152	147.1 Å²	147.1	81%	0.813	77%	0.77	S	S	*	*			trans	92	68.9	156.3	-57.3	-16.2	0	0	0	118.2
155	E	27.9	Very low	26.9	Very low	146 Å²	146	144.3 Å²	144.3	68%	0.682	77%	0.769	S	S	*	*			trans	-138	102.1	149.4	-78.1	-166.6	165.7	0	0	110.5	N157	E155-N157 HydrophobicContact CB-CB 4.49Å; E155-N157 PolarHBondContact O-N 3.39Å; E155-N157 PolarHBondContact OE2-ND2 3.34Å
156	K	25.7	Very low	26.6	Very low	218 Å²	218	148.9 Å²	148.9	95%	0.948	78%	0.776	S	S	*	*			trans	-70.9	81.4	157.8	-80.2	-178.3	175.8	177.1	0	107.3
157	N	30	Very low	26.4	Very low	100 Å²	100	149.5 Å²	149.5	54%	0.535	78%	0.779	S	S	.	*			trans	-115.3	126.6	171.4	-86.9	-30.8	0	0	0	108.8	E155 I159	E155-N157 HydrophobicContact CB-CB 4.49Å; E155-N157 PolarHBondContact O-N 3.39Å; E155-N157 PolarHBondContact OE2-ND2 3.34Å; N157-I159 PolarHBondContact O-N 3.41Å
158	F	26.5	Very low	26.2	Very low	211 Å²	211	151.2 Å²	151.2	93%	0.925	78%	0.778	S	S	*	*			trans	-50.2	106.2	173.9	-100.3	-101.4	0	0	0	110.1
159	I	28.1	Very low	25.9	Very low	145 Å²	145	148.6 Å²	148.6	74%	0.744	77%	0.772	S	S	*	*			trans	-81.7	116.8	160.2	-66.1	173	0	0	0	105.4	N157	N157-I159 PolarHBondContact O-N 3.41Å
160	H	29.8	Very low	25.9	Very low	127 Å²	127	151.3 Å²	151.3	59%	0.588	77%	0.768	S	S	*	*			trans	-80.5	115.2	167.2	-137	-67.6	0	0	0	106	D162 F334	H160-D162 PolarHBondContact O-N 3.44Å; H160-D162 VanDerWaalsContact O-N 3.07Å; H160-F334 AromaticContact NE2-CE2 3.89Å; H160-F334 AromaticContact NE2-CZ 3.25Å; H160-F334 WeakPolarHBondContact NE2-CZ 3.36Å
161	D	27.4	Very low	25.8	Very low	134 Å²	134	153.1 Å²	153.1	72%	0.717	77%	0.769	S	S	*	*			trans	-64.3	104.5	168.7	-81.1	-40.7	0	0	0	108.7	N163	D161-N163 PolarHBondContact O-N 3.28Å; D161-N163 VanDerWaalsContact O-N 3.17Å
162	D	26.2	Very low	25.9	Very low	149 Å²	149	153.3 Å²	153.3	80%	0.797	78%	0.775	S	S	*	*			trans	-77.8	73.8	162.1	-76.2	-31.8	0	0	0	107.9	H160	H160-D162 PolarHBondContact O-N 3.44Å; H160-D162 VanDerWaalsContact O-N 3.07Å
163	N	25	Very low	25.9	Very low	144 Å²	144	155.9 Å²	155.9	77%	0.77	78%	0.782	S	S	*	*			trans	-159.8	68.3	173.8	-90.1	-32.4	0	0	0	111.9	D161	D161-N163 PolarHBondContact O-N 3.28Å; D161-N163 VanDerWaalsContact O-N 3.17Å
164	E	27.6	Very low	25.9	Very low	197 Å²	197	158.6 Å²	158.6	92%	0.921	79%	0.788	S	S	*	*			trans	-154.6	61.1	161.4	-114.3	177.8	-162.9	0	0	110.3
165	T	24.4	Very low	25.9	Very low	136 Å²	136	159.1 Å²	159.1	83%	0.834	79%	0.785	S	S	*	*			trans	-131.2	77.1	163.8	41.2	0	0	0	0	109.2
166	K	23.2	Very low	25.7	Very low	197 Å²	197	161.6 Å²	161.6	86%	0.857	79%	0.794	S	S	*	*			trans	-179.1	115.7	163.1	-104.2	160	-171.1	-176.8	0	108.4
167	L	24.9	Very low	25.5	Very low	169 Å²	169	160.4 Å²	160.4	89%	0.885	79%	0.789	S	S	*	*			trans	134.2	114.6	169.8	-79.9	148.7	0	0	0	107
168	I	25.2	Very low	25.2	Very low	143 Å²	143	161.1 Å²	161.1	73%	0.733	79%	0.792	S	S	*	*			cis	-152.3	117.5	15	-80.1	146.7	0	0	0	105.8
169	S	22.5	Very low	25.1	Very low	105 Å²	105	159.2 Å²	159.2	73%	0.734	79%	0.791	S	S	*	*			trans	-73.1	127.1	156.4	48.6	0	0	0	0	108.2
170	N	24.3	Very low	24.8	Very low	136 Å²	136	161.6 Å²	161.6	73%	0.727	79%	0.791	S	S	*	*			trans	-170.2	110.1	142.8	-96.5	-17.1	0	0	0	112.2
171	N	23.9	Very low	24.5	Very low	143 Å²	143	160.8 Å²	160.8	77%	0.765	80%	0.8	S	S	*	*			trans	50.6	111.4	141.5	-63.5	-15.5	0	0	0	119.9
172	K	27.9	Very low	24.3	Very low	210 Å²	210	159.7 Å²	159.7	91%	0.913	80%	0.798	S	S	*	*				-165.9	125.3	113.5	-100	160.7	-172.2	-179.3	0	111.3
173	E	24.2	Very low	24.2	Very low	179 Å²	179	159.5 Å²	159.5	84%	0.836	80%	0.797	S	S	*	*			trans	-47.2	152	179.4	-60.2	157.3	142.6	0	0	114.3
174	K	25.5	Very low	24.3	Very low	190 Å²	190	161.3 Å²	161.3	83%	0.826	80%	0.801	S	S	*	*				179.2	113.4	118.5	-92.8	165.4	-176.2	-173.9	0	113.8
175	H	24	Very low	24.2	Very low	163 Å²	163	161.8 Å²	161.8	76%	0.755	80%	0.8	S	S	*	*			trans	59.8	97	149.6	-68.4	-78.6	0	0	0	121.7
176	F	22.4	Very low	24.3	Very low	197 Å²	197	161.2 Å²	161.2	86%	0.864	79%	0.791	S	S	*	*			trans	-83.7	130.1	148	-84.8	-94.7	0	0	0	109.5
177	F	23.2	Very low	24.4	Very low	194 Å²	194	158.5 Å²	158.5	85%	0.851	79%	0.785	S	S	*	*			trans	-92.9	111	161.2	-99.6	-87.4	0	0	0	108.6
178	I	23.6	Very low	24.6	Very low	115 Å²	115	156.1 Å²	156.1	59%	0.59	77%	0.774	S	S	*	*			trans	-99.7	124	170.6	-64	173.7	0	0	0	107.1	Y180	I178-Y180 HydrophobicContact CG2-CD2 3.18Å; I178-Y180 HydrophobicContact CG2-CE2 3.47Å; I178-Y180 VanDerWaalsContact CG2-CE2 3.47Å; I178-Y180 HydrophobicContact CG2-CG 4.17Å
179	L	22.9	Very low	24.9	Very low	171 Å²	171	157.9 Å²	157.9	90%	0.895	78%	0.776	S	S	*	*			trans	-120.5	97.7	161.7	-80.2	166.4	0	0	0	108.4
180	Y	22.9	Very low	25.2	Very low	194 Å²	194	159.8 Å²	159.8	76%	0.761	78%	0.778	S	S	*	*			trans	-89.4	160.8	167.1	-85	-74	0	0	0	111	I178	I178-Y180 HydrophobicContact CG2-CD2 3.18Å; I178-Y180 HydrophobicContact CG2-CE2 3.47Å; I178-Y180 VanDerWaalsContact CG2-CE2 3.47Å; I178-Y180 HydrophobicContact CG2-CG 4.17Å
181	S	23.7	Very low	25.5	Very low	110 Å²	110	160.5 Å²	160.5	77%	0.769	78%	0.777	S	S	*	*			trans	-168	100.8	130.8	-76.6	0	0	0	0	109.1
182	T	23.1	Very low	25.9	Very low	111 Å²	111	158.9 Å²	158.9	68%	0.681	76%	0.763	S	S	*	*				84.9	120.8	96.2	53.6	0	0	0	0	116.3
183	N	22.8	Very low	26	Very low	145 Å²	145	155 Å²	155	78%	0.775	75%	0.752	S	S	*	*			trans	77.9	104.2	146.3	-58	-23.9	0	0	0	119.6
184	Q	27.8	Very low	26.3	Very low	182 Å²	182	154.6 Å²	154.6	85%	0.85	75%	0.747	S	S	*	*				-165.7	121.5	119.6	-103	167.9	22.5	0	0	111.9
185	K	25.5	Very low	26.5	Very low	208 Å²	208	151.1 Å²	151.1	90%	0.904	74%	0.738	S	S	*	*			trans	-68.7	118.9	172.2	-72.9	172.9	174.9	174.7	0	109.4
186	I	26.7	Very low	26.8	Very low	124 Å²	124	149.5 Å²	149.5	64%	0.636	73%	0.73	S	S	*	*			trans	-141	122.3	156.9	-59.9	-176.5	0	0	0	109.4	K192	I186-K192 WeakPolarHBondContact O-CE 3.47Å; I186-K192 PolarHBondContact O-NZ 3.08Å
187	N	25.8	Very low	27.2	Very low	139 Å²	139	147.4 Å²	147.4	74%	0.743	72%	0.718	S	S	*	*			trans	-63.8	129.5	176.1	-78.7	-35.7	0	0	0	111.3
188	N	29.1	Very low	27.6	Very low	119 Å²	119	146.5 Å²	146.5	64%	0.636	71%	0.71	S	S	*	*			trans	-179.8	104.2	143.4	-93.3	-11.8	0	0	0	108.3	N190	N188-N190 PolarHBondContact O-N 2.78Å
189	K	30.2	Very low	27.9	Very low	181 Å²	181	147.5 Å²	147.5	79%	0.787	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-11.8	-156.1	-85.8	176.6	173.4	175.1	0	116.3
190	N	30.3	Very low	28.5	Very low	144 Å²	144	141.9 Å²	141.9	77%	0.77	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.4	-19.9	-173	-74.2	-14.4	0	0	0	116.1	N188	N188-N190 PolarHBondContact O-N 2.78Å
191	E	31	Very low	29.3	Very low	151 Å²	151	138.1 Å²	138.1	71%	0.706	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-23.3	169.8	-82.1	-176.4	146.3	0	0	113	L193 K194 N195	E191-L193 VanDerWaalsContact C-N 3.28Å; E191-L193 PolarHBondContact O-N 3.02Å; E191-K194 PolarHBondContact O-N 2.93Å; E191-N195 PolarHBondContact O-N 3.21Å
192	K	30.2	Very low	29.9	Very low	110 Å²	110	139.4 Å²	139.4	48%	0.478	66%	0.662	S	S	.	*	H	α-helix	trans	-64	-27.1	174	-86.8	-173	170.4	-168.7	0	113	I186 H196	I186-K192 WeakPolarHBondContact O-CE 3.47Å; I186-K192 PolarHBondContact O-NZ 3.08Å; K192-H196 WeakPolarHBondContact O-CA 3.36Å; K192-H196 WeakPolarHBondContact O-CB 3.49Å; K192-H196 PolarHBondContact O-N 3.4Å
193	L	30.9	Very low	30.3	Very low	129 Å²	129	138.4 Å²	138.4	68%	0.675	65%	0.652	S	S	*	*	H	α-helix	trans	-71.9	-35.4	179	-103.3	106.4	0	0	0	113.6	E191 Y197	E191-L193 VanDerWaalsContact C-N 3.28Å; E191-L193 PolarHBondContact O-N 3.02Å; L193-Y197 WeakPolarHBondContact O-CB 3.39Å; L193-Y197 PolarHBondContact O-N 3.49Å
194	K	31.1	Very low	31.1	Very low	169 Å²	169	137.9 Å²	137.9	74%	0.735	64%	0.643	S	S	*	*	H	α-helix	trans	-73.7	-43.1	175.8	-86.4	-178.3	176.7	177.3	0	111.7	E191 Y197 Y198	E191-K194 PolarHBondContact O-N 2.93Å; K194-Y197 PolarHBondContact O-N 3.27Å; K194-Y198 PolarHBondContact O-N 2.99Å
195	N	28.8	Very low	31.6	Very low	118 Å²	118	134.2 Å²	134.2	63%	0.631	63%	0.626	S	S	*	*	H	α-helix	trans	-71.4	-36.6	176.4	-78.7	-12	0	0	0	111.8	E191 Y198 F199	E191-N195 PolarHBondContact O-N 3.21Å; N195-Y198 PolarHBondContact O-N 3.39Å; N195-F199 WeakPolarHBondContact O-CB 3.43Å; N195-F199 PolarHBondContact O-N 3.23Å
196	H	30	Very low	31.9	Very low	128 Å²	128	128.6 Å²	128.6	59%	0.593	61%	0.605	S	S	*	*	H	α-helix	trans	-68.6	-38.9	172.7	-165.6	53.4	0	0	0	110.8	K192 Y198 F199 T200	K192-H196 WeakPolarHBondContact O-CA 3.36Å; K192-H196 WeakPolarHBondContact O-CB 3.49Å; K192-H196 PolarHBondContact O-N 3.4Å; H196-Y198 PolarHBondContact O-N 2.86Å; H196-F199 PolarHBondContact O-N 3.3Å; H196-T200 WeakPolarHBondContact O-CA 3.35Å; H196-T200 WeakPolarHBondContact O-CB 3.42Å; H196-T200 PolarHBondContact O-N 2.96Å; H196-T200 PolarHBondContact O-OG1 2.76Å
197	Y	32.6	Very low	32.2	Very low	154 Å²	154	128.5 Å²	128.5	60%	0.604	60%	0.602	S	S	*	*	H	α-helix	trans	-61.5	-44.3	172.8	-175.6	-103.2	0	0	0	112.1	L193 K194 K201	L193-Y197 WeakPolarHBondContact O-CB 3.39Å; L193-Y197 PolarHBondContact O-N 3.49Å; K194-Y197 PolarHBondContact O-N 3.27Å; Y197-K201 WeakPolarHBondContact O-CB 3.25Å; Y197-K201 PolarHBondContact O-N 3.26Å
198	Y	31.1	Very low	32.7	Very low	174 Å²	174	124.6 Å²	124.6	68%	0.682	58%	0.58	S	S	*	*	H	α-helix	trans	-66.5	-41	175.4	-109.9	-89.4	0	0	0	112.8	K194 N195 H196 K201 K202	K194-Y198 PolarHBondContact O-N 2.99Å; N195-Y198 PolarHBondContact O-N 3.39Å; H196-Y198 PolarHBondContact O-N 2.86Å; Y198-K201 PolarHBondContact O-N 2.89Å; Y198-K202 WeakPolarHBondContact O-CB 3.3Å; Y198-K202 PolarHBondContact O-N 3.46Å
199	F	29.8	Very low	32.8	Very low	137 Å²	137	122.8 Å²	122.8	60%	0.601	57%	0.57	S	S	*	*	H	α-helix	trans	-73.5	-36.1	-179.6	-148.9	-90.1	0	0	0	111.9	N195 H196 K202 L203	N195-F199 WeakPolarHBondContact O-CB 3.43Å; N195-F199 PolarHBondContact O-N 3.23Å; H196-F199 PolarHBondContact O-N 3.3Å; F199-K202 PolarHBondContact O-N 3.46Å; F199-L203 HydrophobicContact CD1-CD1 3.56Å; F199-L203 HydrophobicContact CD1-CG 4.05Å; F199-L203 HydrophobicContact CE1-CD1 3.8Å; F199-L203 HydrophobicContact CE1-CG 4.18Å; F199-L203 VanDerWaalsContact O-CB 3.29Å; F199-L203 WeakPolarHBondContact O-CB 3.38Å; F199-L203 WeakPolarHBondContact O-CG 3.45Å; F199-L203 PolarHBondContact O-N 2.84Å
200	T	34.8	Very low	32.7	Very low	52 Å²	52	119.5 Å²	119.5	32%	0.319	56%	0.561	S	S	.	*	H	α-helix	trans	-71.6	-32.8	174.2	-44	0	0	0	0	110.9	H196 K204	H196-T200 WeakPolarHBondContact O-CA 3.35Å; H196-T200 WeakPolarHBondContact O-CB 3.42Å; H196-T200 PolarHBondContact O-N 2.96Å; H196-T200 PolarHBondContact O-OG1 2.76Å; T200-K204 VanDerWaalsContact O-CB 3.29Å; T200-K204 WeakPolarHBondContact O-CB 3.41Å; T200-K204 WeakPolarHBondContact O-CG 3.43Å; T200-K204 PolarHBondContact O-N 3.26Å
201	K	41	Very low	32.9	Very low	115 Å²	115	116.6 Å²	116.6	50%	0.5	55%	0.545	S	S	.	.	H	α-helix	trans	-70.6	-39.1	172.1	-161	175.1	-174	-178.9	0	111.7	Y197 Y198 Q205	Y197-K201 WeakPolarHBondContact O-CB 3.25Å; Y197-K201 PolarHBondContact O-N 3.26Å; Y198-K201 PolarHBondContact O-N 2.89Å; K201-Q205 WeakPolarHBondContact O-CB 3.37Å; K201-Q205 VanDerWaalsContact O-CG 3.3Å; K201-Q205 WeakPolarHBondContact O-CG 3.46Å; K201-Q205 PolarHBondContact O-N 2.91Å
202	K	35.4	Very low	33	Very low	138 Å²	138	112 Å²	112	60%	0.6	52%	0.523	S	S	*	.	H	α-helix	trans	-68.2	-39.2	172.4	-111.2	-174.2	175.3	-174.4	0	112.9	Y198 F199 Q205 L206	Y198-K202 WeakPolarHBondContact O-CB 3.3Å; Y198-K202 PolarHBondContact O-N 3.46Å; F199-K202 PolarHBondContact O-N 3.46Å; K202-Q205 PolarHBondContact O-N 3.38Å; K202-L206 WeakPolarHBondContact O-CB 3.44Å; K202-L206 PolarHBondContact O-N 3.21Å
203	L	31.9	Very low	32.8	Very low	90 Å²	90	113.7 Å²	113.7	47%	0.471	54%	0.537	S	S	.	.	H	α-helix	trans	-69.7	-41.5	175.4	-81.3	168.2	0	0	0	111.6	F199 Q205 L206 E207	F199-L203 HydrophobicContact CD1-CD1 3.56Å; F199-L203 HydrophobicContact CD1-CG 4.05Å; F199-L203 HydrophobicContact CE1-CD1 3.8Å; F199-L203 HydrophobicContact CE1-CG 4.18Å; F199-L203 VanDerWaalsContact O-CB 3.29Å; F199-L203 WeakPolarHBondContact O-CB 3.38Å; F199-L203 WeakPolarHBondContact O-CG 3.45Å; F199-L203 PolarHBondContact O-N 2.84Å; L203-Q205 VanDerWaalsContact C-N 3.31Å; L203-Q205 PolarHBondContact O-N 2.91Å; L203-L206 PolarHBondContact O-N 3.47Å; L203-E207 VanDerWaalsContact O-CB 3.24Å; L203-E207 WeakPolarHBondContact O-CB 3.3Å; L203-E207 PolarHBondContact O-N 3.49Å
204	K	39.9	Very low	32.9	Very low	134 Å²	134	112 Å²	112	58%	0.583	54%	0.536	S	S	*	.	H	α-helix	trans	-60.9	-40.2	169.8	-82.9	-176.5	174.3	-174	0	111.7	T200 E207 I208	T200-K204 VanDerWaalsContact O-CB 3.29Å; T200-K204 WeakPolarHBondContact O-CB 3.41Å; T200-K204 WeakPolarHBondContact O-CG 3.43Å; T200-K204 PolarHBondContact O-N 3.26Å; K204-E207 PolarHBondContact O-N 3.38Å; K204-I208 VanDerWaalsContact O-CB 3.31Å; K204-I208 WeakPolarHBondContact O-CB 3.38Å; K204-I208 VanDerWaalsContact O-CD1 3.27Å; K204-I208 WeakPolarHBondContact O-CD1 3.5Å; K204-I208 WeakPolarHBondContact O-CG1 3.48Å; K204-I208 PolarHBondContact O-N 3.01Å
205	Q	38.6	Very low	33.2	Very low	105 Å²	105	106.5 Å²	106.5	49%	0.491	51%	0.514	S	S	.	.	H	α-helix	trans	-64.4	-42.1	173.2	-81	174.9	-16.8	0	0	112.1	K201 K202 L203 I208 I209	K201-Q205 WeakPolarHBondContact O-CB 3.37Å; K201-Q205 VanDerWaalsContact O-CG 3.3Å; K201-Q205 WeakPolarHBondContact O-CG 3.46Å; K201-Q205 PolarHBondContact O-N 2.91Å; K202-Q205 PolarHBondContact O-N 3.38Å; L203-Q205 VanDerWaalsContact C-N 3.31Å; L203-Q205 PolarHBondContact O-N 2.91Å; Q205-I208 PolarHBondContact O-N 3.42Å; Q205-I209 WeakPolarHBondContact O-CB 3.42Å; Q205-I209 WeakPolarHBondContact O-CD1 3.44Å; Q205-I209 WeakPolarHBondContact O-CG1 3.46Å; Q205-I209 PolarHBondContact O-N 2.96Å
206	L	30.1	Very low	33.9	Very low	89 Å²	89	104.7 Å²	104.7	47%	0.466	50%	0.504	S	S	.	.	H	α-helix	trans	-67.1	-37.8	175.9	-93.6	156.2	0	0	0	112.5	K202 L203 I209 L210	K202-L206 WeakPolarHBondContact O-CB 3.44Å; K202-L206 PolarHBondContact O-N 3.21Å; L203-L206 PolarHBondContact O-N 3.47Å; L206-I209 PolarHBondContact O-N 2.92Å; L206-L210 HydrophobicContact CD2-CD1 4.48Å; L206-L210 WeakPolarHBondContact O-CB 3.43Å; L206-L210 WeakPolarHBondContact O-CD1 3.14Å; L206-L210 PolarHBondContact O-N 3.15Å
207	E	33.2	Very low	34.5	Very low	122 Å²	122	108.1 Å²	108.1	57%	0.57	51%	0.512	S	S	*	.	H	α-helix	trans	-69.4	-36.6	174.8	-169.4	175.5	-164.3	0	0	111.2	L203 K204 N211	L203-E207 VanDerWaalsContact O-CB 3.24Å; L203-E207 WeakPolarHBondContact O-CB 3.3Å; L203-E207 PolarHBondContact O-N 3.49Å; K204-E207 PolarHBondContact O-N 3.38Å; E207-N211 WeakPolarHBondContact O-CB 3.49Å; E207-N211 PolarHBondContact O-N 3.19Å; E207-N211 PolarHBondContact O-ND2 3.4Å
208	I	36.5	Very low	34.8	Very low	57 Å²	57	106.4 Å²	106.4	29%	0.292	51%	0.505	S	S	.	.	H	α-helix	trans	-63.2	-44.8	168.3	-70.7	161.1	0	0	0	110.2	K204 Q205 N211 E212	K204-I208 VanDerWaalsContact O-CB 3.31Å; K204-I208 WeakPolarHBondContact O-CB 3.38Å; K204-I208 VanDerWaalsContact O-CD1 3.27Å; K204-I208 WeakPolarHBondContact O-CD1 3.5Å; K204-I208 WeakPolarHBondContact O-CG1 3.48Å; K204-I208 PolarHBondContact O-N 3.01Å; Q205-I208 PolarHBondContact O-N 3.42Å; I208-N211 PolarHBondContact O-N 3.37Å; I208-E212 HydrophobicContact CG2-CG 4.26Å; I208-E212 WeakPolarHBondContact CG2-OE1 3.41Å; I208-E212 WeakPolarHBondContact O-CB 3.26Å; I208-E212 WeakPolarHBondContact O-CG 3.25Å; I208-E212 PolarHBondContact O-N 3.18Å
209	I	31.7	Very low	35.4	Very low	81 Å²	81	100.4 Å²	100.4	42%	0.415	49%	0.487	S	S	.	.	H	α-helix	trans	-66.7	-41	178.5	-69.5	160.7	0	0	0	111.9	Q205 L206 E212 L213	Q205-I209 WeakPolarHBondContact O-CB 3.42Å; Q205-I209 WeakPolarHBondContact O-CD1 3.44Å; Q205-I209 WeakPolarHBondContact O-CG1 3.46Å; Q205-I209 PolarHBondContact O-N 2.96Å; L206-I209 PolarHBondContact O-N 2.92Å; I209-E212 PolarHBondContact O-N 2.97Å; I209-L213 HydrophobicContact CG2-CD1 4.18Å; I209-L213 WeakPolarHBondContact O-CD1 3.01Å; I209-L213 VanDerWaalsContact O-CG 3.31Å; I209-L213 WeakPolarHBondContact O-CG 3.46Å; I209-L213 PolarHBondContact O-N 3.26Å
210	L	28.1	Very low	36.3	Very low	113 Å²	113	96.5 Å²	96.5	59%	0.592	47%	0.471	S	S	*	.	H	α-helix	trans	-71.4	-35.7	177.6	-98.2	126	0	0	0	112.3	L206 S214	L206-L210 HydrophobicContact CD2-CD1 4.48Å; L206-L210 WeakPolarHBondContact O-CB 3.43Å; L206-L210 WeakPolarHBondContact O-CD1 3.14Å; L206-L210 PolarHBondContact O-N 3.15Å; L210-S214 PolarHBondContact O-OG 3.33Å
211	N	33.5	Very low	37.1	Very low	82 Å²	82	100.2 Å²	100.2	44%	0.439	48%	0.483	S	S	.	.	H	α-helix	trans	-71.2	-40.8	170.4	-73.2	-32.5	0	0	0	110.6	E207 I208 L213 S214 L215	E207-N211 WeakPolarHBondContact O-CB 3.49Å; E207-N211 PolarHBondContact O-N 3.19Å; E207-N211 PolarHBondContact O-ND2 3.4Å; I208-N211 PolarHBondContact O-N 3.37Å; N211-L213 VanDerWaalsContact C-N 3.28Å; N211-L213 PolarHBondContact O-N 3.08Å; N211-S214 PolarHBondContact O-N 2.92Å; N211-S214 PolarHBondContact O-OG 3.48Å; N211-S214 VanDerWaalsContact O-OG 3.06Å; N211-L215 HydrophobicContact CB-CD1 3.93Å; N211-L215 WeakPolarHBondContact O-CB 3.37Å; N211-L215 WeakPolarHBondContact O-CD1 3.49Å; N211-L215 WeakPolarHBondContact O-CG 3.35Å; N211-L215 PolarHBondContact O-N 3Å
212	E	33.1	Very low	37.3	Very low	54 Å²	54	97.7 Å²	97.7	25%	0.252	47%	0.47	S	S	.	.	H	α-helix	trans	-56.8	-40	173.6	-84.1	172.9	179.6	0	0	111.4	I208 I209 S214 L215 Q220	I208-E212 HydrophobicContact CG2-CG 4.26Å; I208-E212 WeakPolarHBondContact CG2-OE1 3.41Å; I208-E212 WeakPolarHBondContact O-CB 3.26Å; I208-E212 WeakPolarHBondContact O-CG 3.25Å; I208-E212 PolarHBondContact O-N 3.18Å; I209-E212 PolarHBondContact O-N 2.97Å; E212-S214 PolarHBondContact O-N 3.48Å; E212-L215 PolarHBondContact O-N 3.31Å; E212-Q220 HydrophobicContact CB-CG 4.39Å; E212-Q220 HydrophobicContact CG-CG 4.21Å; E212-Q220 PolarHBondContact O-NE2 3.4Å
213	L	27.2	Very low	38	Very low	147 Å²	147	93.5 Å²	93.5	77%	0.77	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-15.2	177.6	-76.8	161.8	0	0	0	114.5	I209 N211	I209-L213 HydrophobicContact CG2-CD1 4.18Å; I209-L213 WeakPolarHBondContact O-CD1 3.01Å; I209-L213 VanDerWaalsContact O-CG 3.31Å; I209-L213 WeakPolarHBondContact O-CG 3.46Å; I209-L213 PolarHBondContact O-N 3.26Å; N211-L213 VanDerWaalsContact C-N 3.28Å; N211-L213 PolarHBondContact O-N 3.08Å
214	S	33.7	Very low	39.2	Very low	92 Å²	92	92.5 Å²	92.5	64%	0.643	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	-1.3	-178.9	55.5	0	0	0	0	114.2	L210 N211 E212	L210-S214 PolarHBondContact O-OG 3.33Å; N211-S214 PolarHBondContact O-N 2.92Å; N211-S214 PolarHBondContact O-OG 3.48Å; N211-S214 VanDerWaalsContact O-OG 3.06Å; E212-S214 PolarHBondContact O-N 3.48Å
215	L	35.9	Very low	39.7	Very low	55 Å²	55	87.6 Å²	87.6	29%	0.288	43%	0.434	S	S	.	.	S	Bend	trans	-99.8	139.2	-178.1	-78	160.7	0	0	0	110.5	N211 E212 T219 Q220 I223	N211-L215 HydrophobicContact CB-CD1 3.93Å; N211-L215 WeakPolarHBondContact O-CB 3.37Å; N211-L215 WeakPolarHBondContact O-CD1 3.49Å; N211-L215 WeakPolarHBondContact O-CG 3.35Å; N211-L215 PolarHBondContact O-N 3Å; E212-L215 PolarHBondContact O-N 3.31Å; L215-T219 HydrophobicContact CD2-CG2 3.46Å; L215-T219 VanDerWaalsContact CD2-CG2 3.46Å; L215-Q220 HydrophobicContact CB-CG 4.2Å; L215-I223 HydrophobicContact CD1-CD1 3.62Å
216	D	43.5	Very low	40.4	Very low	79 Å²	79	83.8 Å²	83.8	42%	0.422	42%	0.417	S	S	.	.			trans	-58.8	154	171.5	78.3	14.9	0	0	0	110.1	Y218 T219 Q220	D216-Y218 PolarHBondContact O-N 3.42Å; D216-Y218 WeakPolarHBondContact OD1-CA 3.48Å; D216-Y218 VanDerWaalsContact OD1-CB 3.26Å; D216-Y218 WeakPolarHBondContact OD1-CB 3.45Å; D216-Y218 PolarHBondContact OD1-N 3.46Å; D216-T219 PolarHBondContact O-N 3.44Å; D216-T219 PolarHBondContact OD1-N 2.99Å; D216-T219 PolarHBondContact OD1-OG1 2.86Å; D216-Q220 PolarHBondContact O-N 3.17Å; D216-Q220 VanDerWaalsContact O-N 3.14Å
217	R	43	Very low	41.8	Very low	200 Å²	200	83.3 Å²	83.3	76%	0.755	41%	0.413	S	S	*	.	H	α-helix	trans	-51.8	-22.3	178.5	-88.3	-176.4	-177.3	175.6	1.5	113.5	K221	R217-K221 WeakPolarHBondContact O-CG 3.31Å; R217-K221 PolarHBondContact O-N 2.83Å
218	Y	39.8	Very low	43.1	Very low	118 Å²	118	85.8 Å²	85.8	46%	0.463	42%	0.417	S	S	.	.	H	α-helix	trans	-78.7	-39.5	-179.9	-62.5	-80.7	0	0	0	111.4	D216 K221 Y222	D216-Y218 PolarHBondContact O-N 3.42Å; D216-Y218 WeakPolarHBondContact OD1-CA 3.48Å; D216-Y218 VanDerWaalsContact OD1-CB 3.26Å; D216-Y218 WeakPolarHBondContact OD1-CB 3.45Å; D216-Y218 PolarHBondContact OD1-N 3.46Å; Y218-K221 PolarHBondContact O-N 3.29Å; Y218-Y222 WeakPolarHBondContact O-CB 3.46Å; Y218-Y222 PolarHBondContact O-N 2.95Å
219	T	44	Very low	43.8	Very low	49 Å²	49	84 Å²	84	30%	0.301	41%	0.408	S	S	.	.	H	α-helix	trans	-75.5	-34.3	-179.7	-39.3	0	0	0	0	111	L215 D216 Y222 I223	L215-T219 HydrophobicContact CD2-CG2 3.46Å; L215-T219 VanDerWaalsContact CD2-CG2 3.46Å; D216-T219 PolarHBondContact O-N 3.44Å; D216-T219 PolarHBondContact OD1-N 2.99Å; D216-T219 PolarHBondContact OD1-OG1 2.86Å; T219-Y222 PolarHBondContact O-N 2.78Å; T219-I223 HydrophobicContact CG2-CD1 4.27Å; T219-I223 WeakPolarHBondContact O-CB 3.48Å; T219-I223 VanDerWaalsContact O-CG1 3.27Å; T219-I223 WeakPolarHBondContact O-CG1 3.38Å; T219-I223 PolarHBondContact O-N 3.05Å
220	Q	47.7	Very low	45.2	Very low	54 Å²	54	82.7 Å²	82.7	25%	0.252	40%	0.402	S	S	.	.	H	α-helix	trans	-56.5	-52.9	167.4	-72.1	-177.1	-27.4	0	0	111.7	E212 L215 D216 Y222 I223 E224	E212-Q220 HydrophobicContact CB-CG 4.39Å; E212-Q220 HydrophobicContact CG-CG 4.21Å; E212-Q220 PolarHBondContact O-NE2 3.4Å; L215-Q220 HydrophobicContact CB-CG 4.2Å; D216-Q220 PolarHBondContact O-N 3.17Å; D216-Q220 VanDerWaalsContact O-N 3.14Å; Q220-Y222 VanDerWaalsContact C-N 3.31Å; Q220-Y222 PolarHBondContact O-N 2.98Å; Q220-I223 PolarHBondContact O-N 2.68Å; Q220-E224 WeakPolarHBondContact O-CG 3.43Å; Q220-E224 PolarHBondContact O-N 2.94Å
221	K	50.9	Low	47	Very low	131 Å²	131	83 Å²	83	57%	0.57	40%	0.404	S	S	*	.	H	α-helix	trans	-62.1	-35.8	179.9	-77.4	-176.3	176.2	-172.6	0	113.5	R217 Y218 G225	R217-K221 WeakPolarHBondContact O-CG 3.31Å; R217-K221 PolarHBondContact O-N 2.83Å; Y218-K221 PolarHBondContact O-N 3.29Å; K221-G225 PolarHBondContact O-N 3.32Å
222	Y	46.8	Very low	48.1	Very low	62 Å²	62	82.1 Å²	82.1	24%	0.243	40%	0.396	C	S	.	.	H	α-helix	trans	-65.3	-46.9	174.6	167.3	-99.6	0	0	0	111.8	Y218 T219 Q220 G225 L226 I347 S351	Y218-Y222 WeakPolarHBondContact O-CB 3.46Å; Y218-Y222 PolarHBondContact O-N 2.95Å; T219-Y222 PolarHBondContact O-N 2.78Å; Q220-Y222 VanDerWaalsContact C-N 3.31Å; Q220-Y222 PolarHBondContact O-N 2.98Å; Y222-G225 PolarHBondContact O-N 3Å; Y222-L226 HydrophobicContact CD1-CD1 4.2Å; Y222-L226 HydrophobicContact CD2-CD1 4.36Å; Y222-L226 HydrophobicContact CE1-CD1 3.46Å; Y222-L226 VanDerWaalsContact CE1-CD1 3.46Å; Y222-L226 HydrophobicContact CE2-CD1 3.65Å; Y222-L226 HydrophobicContact CE2-CG 4.48Å; Y222-L226 PolarHBondContact O-N 3.3Å; Y222-L226 WeakPolarHBondContact OH-CD1 3.22Å; Y222-I347 HydrophobicContact CD2-CG2 4.47Å; Y222-I347 HydrophobicContact CE2-CG2 3.83Å; Y222-S351 VanDerWaalsContact CE2-CB 3.45Å; Y222-S351 WeakPolarHBondContact OH-CB 3.49Å; Y222-S351 PolarHBondContact OH-OG 3.42Å
223	I	49.9	Very low	49.4	Very low	49 Å²	49	80.2 Å²	80.2	25%	0.251	39%	0.388	S	S	.	.	H	α-helix	trans	-63.1	-44.5	177.3	-69.7	167.1	0	0	0	110.7	L215 T219 Q220 G225 L226 Q227	L215-I223 HydrophobicContact CD1-CD1 3.62Å; T219-I223 HydrophobicContact CG2-CD1 4.27Å; T219-I223 WeakPolarHBondContact O-CB 3.48Å; T219-I223 VanDerWaalsContact O-CG1 3.27Å; T219-I223 WeakPolarHBondContact O-CG1 3.38Å; T219-I223 PolarHBondContact O-N 3.05Å; Q220-I223 PolarHBondContact O-N 2.68Å; I223-G225 VanDerWaalsContact C-N 3.28Å; I223-G225 PolarHBondContact O-N 2.94Å; I223-L226 PolarHBondContact O-N 3.36Å; I223-Q227 HydrophobicContact CG2-CG 4.3Å; I223-Q227 WeakPolarHBondContact O-CB 3.25Å; I223-Q227 VanDerWaalsContact O-CG 3.3Å; I223-Q227 WeakPolarHBondContact O-CG 3.37Å; I223-Q227 PolarHBondContact O-N 3.18Å
224	E	56.1	Low	51.4	Low	69 Å²	69	79.3 Å²	79.3	32%	0.322	38%	0.38	S	S	.	.	H	α-helix	trans	-58.1	-40.9	173.8	-75.7	-178.4	-150.5	0	0	112	Q220 R228	Q220-E224 WeakPolarHBondContact O-CG 3.43Å; Q220-E224 PolarHBondContact O-N 2.94Å; E224-R228 WeakPolarHBondContact O-CB 3.23Å; E224-R228 WeakPolarHBondContact O-CD 3.26Å; E224-R228 WeakPolarHBondContact O-CG 3.26Å; E224-R228 PolarHBondContact O-N 3.29Å; E224-R228 VanDerWaalsContact O-N 3.08Å; E224-R228 IonicContact OE2-NH2 3.61Å
225	G	49.9	Very low	53	Low	31 Å²	31	80.9 Å²	80.9	32%	0.32	38%	0.376	S	S	.	.	H	α-helix	trans	-61.9	-48.1	177	0	0	0	0	0	112.6	K221 Y222 I223 R228 V229	K221-G225 PolarHBondContact O-N 3.32Å; Y222-G225 PolarHBondContact O-N 3Å; I223-G225 VanDerWaalsContact C-N 3.28Å; I223-G225 PolarHBondContact O-N 2.94Å; G225-R228 PolarHBondContact O-N 3.18Å; G225-V229 WeakPolarHBondContact O-CG2 3.48Å; G225-V229 PolarHBondContact O-N 2.86Å; G225-V229 VanDerWaalsContact O-N 3.11Å
226	L	53.7	Low	53.9	Low	25 Å²	25	78.4 Å²	78.4	13%	0.131	36%	0.363	C	S	.	.	H	α-helix	trans	-63.9	-45.8	177	-93.6	160.3	0	0	0	112.9	Y222 I223 R228 V229 D230 I347 E348	Y222-L226 HydrophobicContact CD1-CD1 4.2Å; Y222-L226 HydrophobicContact CD2-CD1 4.36Å; Y222-L226 HydrophobicContact CE1-CD1 3.46Å; Y222-L226 VanDerWaalsContact CE1-CD1 3.46Å; Y222-L226 HydrophobicContact CE2-CD1 3.65Å; Y222-L226 HydrophobicContact CE2-CG 4.48Å; Y222-L226 PolarHBondContact O-N 3.3Å; Y222-L226 WeakPolarHBondContact OH-CD1 3.22Å; I223-L226 PolarHBondContact O-N 3.36Å; L226-R228 PolarHBondContact O-N 3.49Å; L226-V229 PolarHBondContact O-N 2.9Å; L226-V229 VanDerWaalsContact O-N 3.07Å; L226-D230 PolarHBondContact O-N 3.45Å; L226-I347 HydrophobicContact CD2-CG2 4.45Å; L226-I347 HydrophobicContact CG-CG2 4.27Å; L226-E348 HydrophobicContact CD2-CG 4.47Å
227	Q	60.4	Low	55	Low	80 Å²	80	78.5 Å²	78.5	37%	0.374	36%	0.361	S	S	.	.	H	α-helix	trans	-58.4	-38.7	176.8	-74.2	177.9	0.6	0	0	111.8	I223 L231	I223-Q227 HydrophobicContact CG2-CG 4.3Å; I223-Q227 WeakPolarHBondContact O-CB 3.25Å; I223-Q227 VanDerWaalsContact O-CG 3.3Å; I223-Q227 WeakPolarHBondContact O-CG 3.37Å; I223-Q227 PolarHBondContact O-N 3.18Å; Q227-L231 VanDerWaalsContact O-CB 3.32Å; Q227-L231 WeakPolarHBondContact O-CB 3.29Å; Q227-L231 PolarHBondContact O-N 3.39Å
228	R	59.5	Low	56.3	Low	173 Å²	173	77 Å²	77	65%	0.653	36%	0.356	S	S	*	.	H	α-helix	trans	-65.6	-40.5	175.3	-72.7	170.3	-166.5	-136.3	8.5	112.2	E224 G225 L226 K232	E224-R228 WeakPolarHBondContact O-CB 3.23Å; E224-R228 WeakPolarHBondContact O-CD 3.26Å; E224-R228 WeakPolarHBondContact O-CG 3.26Å; E224-R228 PolarHBondContact O-N 3.29Å; E224-R228 VanDerWaalsContact O-N 3.08Å; E224-R228 IonicContact OE2-NH2 3.61Å; G225-R228 PolarHBondContact O-N 3.18Å; L226-R228 PolarHBondContact O-N 3.49Å; R228-K232 WeakPolarHBondContact O-CB 3.21Å; R228-K232 PolarHBondContact O-N 3.09Å
229	V	50.9	Low	57.1	Low	19 Å²	19	72.7 Å²	72.7	12%	0.115	34%	0.34	C	S	.	.	H	α-helix	trans	-67	-44.9	177	172.7	0	0	0	0	110.7	G225 L226 K232 C233 K344	G225-V229 WeakPolarHBondContact O-CG2 3.48Å; G225-V229 PolarHBondContact O-N 2.86Å; G225-V229 VanDerWaalsContact O-N 3.11Å; L226-V229 PolarHBondContact O-N 2.9Å; L226-V229 VanDerWaalsContact O-N 3.07Å; V229-K232 WeakPolarHBondContact O-CB 3.47Å; V229-K232 PolarHBondContact O-N 2.98Å; V229-C233 PolarHBondContact O-N 3.28Å; V229-C233 PolarHBondContact O-SG 3.37Å; V229-K344 HydrophobicContact CG1-CB 3.93Å; V229-K344 HydrophobicContact CG1-CG 4.36Å
230	D	61	Low	58	Low	55 Å²	55	72.6 Å²	72.6	29%	0.294	34%	0.337	S	S	.	.	H	α-helix	trans	-61.9	-49.7	179.1	-79.7	-20.5	0	0	0	112	L226 K232 C233 E234 K344	L226-D230 PolarHBondContact O-N 3.45Å; D230-K232 PolarHBondContact O-N 2.89Å; D230-K232 VanDerWaalsContact O-N 3.16Å; D230-C233 WeakPolarHBondContact O-CB 3.45Å; D230-C233 PolarHBondContact O-N 3.03Å; D230-C233 VanDerWaalsContact O-N 3.09Å; D230-E234 WeakPolarHBondContact O-CG 3.15Å; D230-E234 PolarHBondContact O-N 3.49Å; D230-K344 WeakPolarHBondContact OD1-CE 3.44Å; D230-K344 IonicContact OD1-NZ 3.3Å; D230-K344 PolarHBondContact OD1-NZ 2.95Å
231	L	66.2	Low	59.2	Low	119 Å²	119	76.8 Å²	76.8	62%	0.623	35%	0.354	S	S	*	.	H	α-helix	trans	-57.5	-34.5	176.8	-170.9	72.9	0	0	0	111.8	Q227 K235	Q227-L231 VanDerWaalsContact O-CB 3.32Å; Q227-L231 WeakPolarHBondContact O-CB 3.29Å; Q227-L231 PolarHBondContact O-N 3.39Å; L231-K235 WeakPolarHBondContact O-CB 3.32Å; L231-K235 PolarHBondContact O-N 3.34Å; L231-K235 VanDerWaalsContact O-N 3.09Å
232	K	57.7	Low	60.1	Low	64 Å²	64	73.5 Å²	73.5	28%	0.278	35%	0.345	S	S	.	.	H	α-helix	trans	-75.8	-37.8	179.2	-149.7	170.8	-169.4	172.9	0	111.9	R228 V229 D230 K235 L236 L375	R228-K232 WeakPolarHBondContact O-CB 3.21Å; R228-K232 PolarHBondContact O-N 3.09Å; V229-K232 WeakPolarHBondContact O-CB 3.47Å; V229-K232 PolarHBondContact O-N 2.98Å; D230-K232 PolarHBondContact O-N 2.89Å; D230-K232 VanDerWaalsContact O-N 3.16Å; K232-K235 PolarHBondContact O-N 3.17Å; K232-L236 WeakPolarHBondContact O-CG 3.42Å; K232-L236 PolarHBondContact O-N 3.07Å; K232-L375 HydrophobicContact CD-CD2 4.1Å
233	C	59.4	Low	60.5	Low	13 Å²	13	71.8 Å²	71.8	9%	0.088	34%	0.34	C	S	.	.	H	α-helix	trans	-62.5	-47.6	172.2	-67.9	0	0	0	0	110.8	V229 D230 K235 L236 E237	V229-C233 PolarHBondContact O-N 3.28Å; V229-C233 PolarHBondContact O-SG 3.37Å; D230-C233 WeakPolarHBondContact O-CB 3.45Å; D230-C233 PolarHBondContact O-N 3.03Å; D230-C233 VanDerWaalsContact O-N 3.09Å; C233-K235 VanDerWaalsContact C-N 3.31Å; C233-K235 PolarHBondContact O-N 3.48Å; C233-L236 PolarHBondContact O-N 2.65Å; C233-L236 VanDerWaalsContact O-N 3.17Å; C233-E237 WeakPolarHBondContact O-CB 3.41Å; C233-E237 WeakPolarHBondContact O-CG 3.49Å; C233-E237 PolarHBondContact O-N 3.3Å
234	E	69.2	Low	61.3	Low	128 Å²	128	76.4 Å²	76.4	60%	0.598	36%	0.358	S	S	*	.	H	α-helix	trans	-57.6	-43.4	176	-72.2	-177.4	171	0	0	111.8	D230 E237 Y238	D230-E234 WeakPolarHBondContact O-CG 3.15Å; D230-E234 PolarHBondContact O-N 3.49Å; E234-E237 PolarHBondContact O-N 2.97Å; E234-Y238 WeakPolarHBondContact O-CB 3.49Å; E234-Y238 PolarHBondContact O-N 3.04Å
235	K	67.1	Low	62.1	Low	126 Å²	126	77.7 Å²	77.7	55%	0.548	37%	0.368	S	S	.	.	H	α-helix	trans	-62.7	-43.5	176.8	-172.2	177.5	-179.2	-179.2	0	112.1	L231 K232 C233 Y238 M239	L231-K235 WeakPolarHBondContact O-CB 3.32Å; L231-K235 PolarHBondContact O-N 3.34Å; L231-K235 VanDerWaalsContact O-N 3.09Å; K232-K235 PolarHBondContact O-N 3.17Å; C233-K235 VanDerWaalsContact C-N 3.31Å; C233-K235 PolarHBondContact O-N 3.48Å; K235-Y238 PolarHBondContact O-N 3.15Å; K235-M239 WeakPolarHBondContact O-CG 3.28Å; K235-M239 PolarHBondContact O-N 3.47Å
236	L	54.6	Low	62.8	Low	3 Å²	3	79 Å²	79	2%	0.016	37%	0.37	C	S	.	.	H	α-helix	trans	-68.1	-39.2	177.7	-75.2	171.8	0	0	0	112.1	K232 C233 M239 M240 T333 L340 I380	K232-L236 WeakPolarHBondContact O-CG 3.42Å; K232-L236 PolarHBondContact O-N 3.07Å; C233-L236 PolarHBondContact O-N 2.65Å; C233-L236 VanDerWaalsContact O-N 3.17Å; L236-M239 PolarHBondContact O-N 3.38Å; L236-M240 WeakPolarHBondContact O-CB 3.36Å; L236-M240 VanDerWaalsContact O-CG 3.28Å; L236-M240 WeakPolarHBondContact O-CG 3.2Å; L236-M240 PolarHBondContact O-N 3.48Å; L236-T333 HydrophobicContact CD2-CG2 3.85Å; L236-L340 HydrophobicContact CD1-CD1 3.26Å; L236-I380 HydrophobicContact CD2-CD1 3.84Å
237	E	66.9	Low	63.2	Low	81 Å²	81	80 Å²	80	38%	0.379	38%	0.375	S	S	.	.	H	α-helix	trans	-62.8	-43.6	175.2	-75	-179.7	-179.9	0	0	111.3	C233 E234 M240 K241 W337 R341	C233-E237 WeakPolarHBondContact O-CB 3.41Å; C233-E237 WeakPolarHBondContact O-CG 3.49Å; C233-E237 PolarHBondContact O-N 3.3Å; E234-E237 PolarHBondContact O-N 2.97Å; E237-M240 PolarHBondContact O-N 2.9Å; E237-K241 WeakPolarHBondContact O-CB 3.44Å; E237-K241 PolarHBondContact O-N 2.93Å; E237-W337 VanDerWaalsContact CG-NE1 3.27Å; E237-W337 PolarHBondContact OE1-NE1 2.93Å; E237-W337 VanDerWaalsContact OE1-NE1 3.17Å; E237-R341 IonicContact OE1-NH2 3.2Å; E237-R341 PolarHBondContact OE1-NH2 2.87Å; E237-R341 VanDerWaalsContact OE1-NH2 3.17Å
238	Y	70.3	Confident	63.7	Low	167 Å²	167	79.4 Å²	79.4	66%	0.655	38%	0.379	S	S	*	.	H	α-helix	trans	-58.6	-48.8	173	179.1	-96.9	0	0	0	111.5	E234 K235 M240 K241 T242	E234-Y238 WeakPolarHBondContact O-CB 3.49Å; E234-Y238 PolarHBondContact O-N 3.04Å; K235-Y238 PolarHBondContact O-N 3.15Å; Y238-M240 PolarHBondContact O-N 3.43Å; Y238-K241 WeakPolarHBondContact O-CB 3.43Å; Y238-K241 PolarHBondContact O-N 3.22Å; Y238-T242 PolarHBondContact O-N 3.4Å; Y238-T242 PolarHBondContact O-OG1 3.38Å; Y238-T242 VanDerWaalsContact O-OG1 3.06Å
239	M	56.6	Low	64.5	Low	28 Å²	28	76.9 Å²	76.9	14%	0.138	38%	0.378	C	S	.	.	H	α-helix	trans	-62.2	-42.5	177.7	-75	-178.7	65.2	0	0	112.9	K235 L236 K241 T242 M243 I380 F381	K235-M239 WeakPolarHBondContact O-CG 3.28Å; K235-M239 PolarHBondContact O-N 3.47Å; L236-M239 PolarHBondContact O-N 3.38Å; M239-K241 VanDerWaalsContact C-N 3.29Å; M239-K241 PolarHBondContact O-N 2.87Å; M239-T242 PolarHBondContact O-N 3.49Å; M239-M243 HydrophobicContact CB-CE 4.33Å; M239-M243 WeakPolarHBondContact O-CB 3.39Å; M239-M243 WeakPolarHBondContact O-CG 3.42Å; M239-M243 PolarHBondContact O-N 3.07Å; M239-I380 HydrophobicContact CE-CD1 3.87Å; M239-I380 HydrophobicContact CE-CG1 4.39Å; M239-I380 HydrophobicContact CE-CG2 3.56Å; M239-I380 HydrophobicContact SD-CD1 3.8Å; M239-I380 HydrophobicContact SD-CG2 3.62Å; M239-F381 HydrophobicContact CE-CD2 3.96Å; M239-F381 HydrophobicContact CE-CE2 3.85Å
240	M	63.4	Low	64.9	Low	47 Å²	47	78.9 Å²	78.9	23%	0.232	39%	0.385	C	S	.	.	H	α-helix	trans	-60.4	-41.3	176.4	-79.2	174.7	52.8	0	0	111	L236 E237 Y238 M243 K244 T333 F334 W337	L236-M240 WeakPolarHBondContact O-CB 3.36Å; L236-M240 VanDerWaalsContact O-CG 3.28Å; L236-M240 WeakPolarHBondContact O-CG 3.2Å; L236-M240 PolarHBondContact O-N 3.48Å; E237-M240 PolarHBondContact O-N 2.9Å; Y238-M240 PolarHBondContact O-N 3.43Å; M240-M243 HydrophobicContact CG-CE 4.33Å; M240-M243 PolarHBondContact O-N 2.74Å; M240-K244 VanDerWaalsContact O-CB 3.31Å; M240-K244 WeakPolarHBondContact O-CB 3.21Å; M240-K244 PolarHBondContact O-N 3.12Å; M240-T333 HydrophobicContact CG-CG2 4.03Å; M240-F334 HydrophobicContact CE-CD2 3.67Å; M240-F334 HydrophobicContact CE-CE2 4.38Å; M240-W337 HydrophobicContact CE-CD2 4.45Å; M240-W337 HydrophobicContact SD-CB 3.71Å; M240-W337 HydrophobicContact SD-CD2 4.19Å; M240-W337 HydrophobicContact SD-CG 3.74Å
241	K	73.7	Confident	65.2	Low	142 Å²	142	79.3 Å²	79.3	62%	0.617	39%	0.386	S	S	*	.	H	α-helix	trans	-60.9	-50.2	173.7	-170.9	170.6	-177.2	174.2	0	111.1	E237 Y238 M239 M243 K244 D245	E237-K241 WeakPolarHBondContact O-CB 3.44Å; E237-K241 PolarHBondContact O-N 2.93Å; Y238-K241 WeakPolarHBondContact O-CB 3.43Å; Y238-K241 PolarHBondContact O-N 3.22Å; M239-K241 VanDerWaalsContact C-N 3.29Å; M239-K241 PolarHBondContact O-N 2.87Å; K241-M243 VanDerWaalsContact C-N 3.33Å; K241-M243 PolarHBondContact O-N 2.97Å; K241-K244 WeakPolarHBondContact O-CB 3.25Å; K241-K244 PolarHBondContact O-N 3.37Å; K241-D245 VanDerWaalsContact O-CG 3.22Å; K241-D245 PolarHBondContact O-N 3.02Å
242	T	69.1	Low	65.6	Low	62 Å²	62	76.3 Å²	76.3	38%	0.38	38%	0.379	S	S	.	.	H	α-helix	trans	-60.4	-39.9	177.2	-50.2	0	0	0	0	112.8	Y238 M239 D245 T246	Y238-T242 PolarHBondContact O-N 3.4Å; Y238-T242 PolarHBondContact O-OG1 3.38Å; Y238-T242 VanDerWaalsContact O-OG1 3.06Å; M239-T242 PolarHBondContact O-N 3.49Å; T242-D245 PolarHBondContact O-N 3.49Å; T242-T246 WeakPolarHBondContact O-CB 3.45Å; T242-T246 PolarHBondContact O-N 2.99Å; T242-T246 PolarHBondContact O-OG1 3.35Å
243	M	55.8	Low	66.2	Low	27 Å²	27	75.7 Å²	75.7	13%	0.133	38%	0.38	C	S	.	.	H	α-helix	trans	-68.6	-39.7	177	-77.5	-172.9	-69.3	0	0	112.3	M239 M240 K241 D245 T246 L247 L329 T333	M239-M243 HydrophobicContact CB-CE 4.33Å; M239-M243 WeakPolarHBondContact O-CB 3.39Å; M239-M243 WeakPolarHBondContact O-CG 3.42Å; M239-M243 PolarHBondContact O-N 3.07Å; M240-M243 HydrophobicContact CG-CE 4.33Å; M240-M243 PolarHBondContact O-N 2.74Å; K241-M243 VanDerWaalsContact C-N 3.33Å; K241-M243 PolarHBondContact O-N 2.97Å; M243-D245 VanDerWaalsContact C-N 3.34Å; M243-T246 PolarHBondContact O-N 3.27Å; M243-L247 VanDerWaalsContact O-CB 3.25Å; M243-L247 WeakPolarHBondContact O-CB 3.18Å; M243-L247 PolarHBondContact O-N 2.81Å; M243-L329 HydrophobicContact SD-CD2 3.89Å; M243-L329 HydrophobicContact SD-CG 3.93Å; M243-T333 HydrophobicContact CE-CG2 3.66Å; M243-T333 WeakPolarHBondContact CE-OG1 3.45Å
244	K	66.6	Low	66.2	Low	146 Å²	146	77 Å²	77	64%	0.635	38%	0.384	S	S	*	.	H	α-helix	trans	-60.9	-45.3	174.1	-175.5	179.2	179.9	178.2	0	110.8	M240 K241 L247 S248	M240-K244 VanDerWaalsContact O-CB 3.31Å; M240-K244 WeakPolarHBondContact O-CB 3.21Å; M240-K244 PolarHBondContact O-N 3.12Å; K241-K244 WeakPolarHBondContact O-CB 3.25Å; K241-K244 PolarHBondContact O-N 3.37Å; K244-L247 PolarHBondContact O-N 3.03Å; K244-S248 WeakPolarHBondContact O-CB 3.4Å; K244-S248 PolarHBondContact O-N 2.92Å; K244-S248 PolarHBondContact O-OG 2.75Å
245	D	72.6	Confident	66.2	Low	96 Å²	96	75 Å²	75	51%	0.513	38%	0.375	S	S	.	.	H	α-helix	trans	-63.4	-45	177.8	-64.3	-18.7	0	0	0	110.8	K241 T242 M243 S248 L249	K241-D245 VanDerWaalsContact O-CG 3.22Å; K241-D245 PolarHBondContact O-N 3.02Å; T242-D245 PolarHBondContact O-N 3.49Å; M243-D245 VanDerWaalsContact C-N 3.34Å; D245-S248 PolarHBondContact O-N 3.38Å; D245-L249 WeakPolarHBondContact O-CB 3.48Å; D245-L249 PolarHBondContact O-N 2.86Å
246	T	65.2	Low	66.7	Low	59 Å²	59	76.6 Å²	76.6	36%	0.362	38%	0.381	S	S	.	.	H	α-helix	trans	-63.5	-43.9	177.5	-58.2	0	0	0	0	112.2	T242 M243 L249 K250	T242-T246 WeakPolarHBondContact O-CB 3.45Å; T242-T246 PolarHBondContact O-N 2.99Å; T242-T246 PolarHBondContact O-OG1 3.35Å; M243-T246 PolarHBondContact O-N 3.27Å; T246-L249 PolarHBondContact O-N 3.32Å; T246-K250 HydrophobicContact CG2-CD 4.34Å; T246-K250 WeakPolarHBondContact O-CB 3.4Å; T246-K250 WeakPolarHBondContact O-CG 3.37Å; T246-K250 PolarHBondContact O-N 3.37Å
247	L	61.5	Low	67.2	Low	45 Å²	45	79.9 Å²	79.9	24%	0.236	40%	0.396	C	S	.	.	H	α-helix	trans	-64.1	-42.7	177.8	-177.5	66.9	0	0	0	110.7	M243 K244 L249 K250 M251 M323	M243-L247 VanDerWaalsContact O-CB 3.25Å; M243-L247 WeakPolarHBondContact O-CB 3.18Å; M243-L247 PolarHBondContact O-N 2.81Å; K244-L247 PolarHBondContact O-N 3.03Å; L247-L249 PolarHBondContact O-N 2.83Å; L247-K250 PolarHBondContact O-N 3.49Å; L247-M251 VanDerWaalsContact O-CB 3.3Å; L247-M251 WeakPolarHBondContact O-CB 3.3Å; L247-M251 PolarHBondContact O-N 3.38Å; L247-M323 HydrophobicContact CD1-CG 4.16Å
248	S	71.1	Confident	66.9	Low	68 Å²	68	80.5 Å²	80.5	48%	0.476	40%	0.398	S	S	.	.	H	α-helix	trans	-61.3	-44.2	177	-57.7	0	0	0	0	111.3	K244 D245 M251 A252	K244-S248 WeakPolarHBondContact O-CB 3.4Å; K244-S248 PolarHBondContact O-N 2.92Å; K244-S248 PolarHBondContact O-OG 2.75Å; D245-S248 PolarHBondContact O-N 3.38Å; S248-M251 PolarHBondContact O-N 2.93Å; S248-A252 WeakPolarHBondContact O-CB 3.39Å; S248-A252 PolarHBondContact O-N 3.38Å
249	L	75.1	Confident	67	Low	119 Å²	119	78.9 Å²	78.9	62%	0.623	39%	0.394	S	S	*	.	H	α-helix	trans	-62.8	-44.8	175.9	-176.8	65	0	0	0	112.3	D245 T246 L247 A252 T253	D245-L249 WeakPolarHBondContact O-CB 3.48Å; D245-L249 PolarHBondContact O-N 2.86Å; T246-L249 PolarHBondContact O-N 3.32Å; L247-L249 PolarHBondContact O-N 2.83Å; L249-A252 PolarHBondContact O-N 3.34Å; L249-T253 WeakPolarHBondContact O-CB 3.48Å; L249-T253 PolarHBondContact O-N 3.37Å; L249-T253 PolarHBondContact O-OG1 3.47Å
250	K	60.8	Low	67.6	Low	62 Å²	62	83.2 Å²	83.2	27%	0.27	41%	0.412	S	S	.	.	H	α-helix	trans	-64.6	-41.6	176.8	-74.5	-178	-177.6	-178.3	0	111.8	T246 L247 T253 Y254 S326	T246-K250 HydrophobicContact CG2-CD 4.34Å; T246-K250 WeakPolarHBondContact O-CB 3.4Å; T246-K250 WeakPolarHBondContact O-CG 3.37Å; T246-K250 PolarHBondContact O-N 3.37Å; L247-K250 PolarHBondContact O-N 3.49Å; K250-T253 WeakPolarHBondContact O-CB 3.23Å; K250-T253 PolarHBondContact O-N 2.83Å; K250-Y254 WeakPolarHBondContact O-CB 3.06Å; K250-Y254 PolarHBondContact O-N 2.99Å; K250-S326 PolarHBondContact NZ-OG 3.41Å
251	M	67.1	Low	67.4	Low	63 Å²	63	81.9 Å²	81.9	31%	0.31	41%	0.406	S	S	.	.	H	α-helix	trans	-64.2	-45.3	177.4	-175.8	56	156.6	0	0	111.3	L247 S248 T253 Y254 Q255 M323	L247-M251 VanDerWaalsContact O-CB 3.3Å; L247-M251 WeakPolarHBondContact O-CB 3.3Å; L247-M251 PolarHBondContact O-N 3.38Å; S248-M251 PolarHBondContact O-N 2.93Å; M251-T253 VanDerWaalsContact C-N 3.3Å; M251-T253 PolarHBondContact O-N 2.85Å; M251-Y254 PolarHBondContact O-N 3.42Å; M251-Y254 HydrophobicContact SD-CD1 4.25Å; M251-Q255 WeakPolarHBondContact O-CB 3.47Å; M251-Q255 WeakPolarHBondContact O-CG 3.45Å; M251-Q255 PolarHBondContact O-N 2.87Å; M251-Q255 HydrophobicContact SD-CG 4.33Å; M251-M323 HydrophobicContact SD-CE 4.44Å; M251-M323 HydrophobicContact SD-SD 3.38Å
252	A	75	Confident	66.5	Low	57 Å²	57	78.3 Å²	78.3	47%	0.471	39%	0.394	S	S	.	.	H	α-helix	trans	-59.6	-41.7	174.5	0	0	0	0	0	111.8	S248 L249 Q255 K256	S248-A252 WeakPolarHBondContact O-CB 3.39Å; S248-A252 PolarHBondContact O-N 3.38Å; L249-A252 PolarHBondContact O-N 3.34Å; A252-Q255 PolarHBondContact O-N 3.49Å; A252-K256 WeakPolarHBondContact O-CB 3.42Å; A252-K256 PolarHBondContact O-N 3.42Å
253	T	68.9	Low	66.4	Low	50 Å²	50	80 Å²	80	31%	0.307	40%	0.4	S	S	.	.	H	α-helix	trans	-63.3	-49.2	176	-56.4	0	0	0	0	111.2	L249 K250 M251 Q255 K256 H257 L319	L249-T253 WeakPolarHBondContact O-CB 3.48Å; L249-T253 PolarHBondContact O-N 3.37Å; L249-T253 PolarHBondContact O-OG1 3.47Å; K250-T253 WeakPolarHBondContact O-CB 3.23Å; K250-T253 PolarHBondContact O-N 2.83Å; M251-T253 VanDerWaalsContact C-N 3.3Å; M251-T253 PolarHBondContact O-N 2.85Å; T253-Q255 PolarHBondContact O-N 3.23Å; T253-K256 PolarHBondContact O-N 3.46Å; T253-H257 PolarHBondContact O-CD2 3.47Å; T253-H257 VanDerWaalsContact O-CD2 3.26Å; T253-H257 PolarHBondContact O-N 3.15Å; T253-L319 HydrophobicContact CG2-CD2 4.47Å
254	Y	60.6	Low	66.7	Low	41 Å²	41	82.6 Å²	82.6	16%	0.161	41%	0.412	C	S	.	.	H	α-helix	trans	-56.5	-49.4	175.7	171.4	-96.8	0	0	0	111.7	K250 M251 K256 H257 K258 L316 L319 Y320	K250-Y254 WeakPolarHBondContact O-CB 3.06Å; K250-Y254 PolarHBondContact O-N 2.99Å; M251-Y254 PolarHBondContact O-N 3.42Å; M251-Y254 HydrophobicContact SD-CD1 4.25Å; Y254-K256 VanDerWaalsContact C-N 3.32Å; Y254-K256 PolarHBondContact O-N 3.33Å; Y254-H257 PolarHBondContact O-N 3.46Å; Y254-K258 HydrophobicContact CE1-CD 4.02Å; Y254-K258 VanDerWaalsContact O-CB 3.29Å; Y254-K258 WeakPolarHBondContact O-CB 3.46Å; Y254-K258 PolarHBondContact O-N 3.32Å; Y254-L316 HydrophobicContact CD2-CD2 3.92Å; Y254-L316 HydrophobicContact CE2-CD2 3.54Å; Y254-L319 HydrophobicContact CD2-CB 4.28Å; Y254-Y320 HydrophobicContact CE2-CD2 4.37Å
255	Q	69.4	Low	66	Low	87 Å²	87	77.6 Å²	77.6	41%	0.407	39%	0.392	S	S	.	.	H	α-helix	trans	-61.7	-39.1	178.5	-73	-171.8	7.1	0	0	112.3	M251 A252 T253 K259	M251-Q255 WeakPolarHBondContact O-CB 3.47Å; M251-Q255 WeakPolarHBondContact O-CG 3.45Å; M251-Q255 PolarHBondContact O-N 2.87Å; M251-Q255 HydrophobicContact SD-CG 4.33Å; A252-Q255 PolarHBondContact O-N 3.49Å; T253-Q255 PolarHBondContact O-N 3.23Å; Q255-K259 WeakPolarHBondContact O-CB 3.35Å; Q255-K259 WeakPolarHBondContact O-CG 3.36Å; Q255-K259 PolarHBondContact O-N 3.04Å
256	K	76.2	Confident	65.2	Low	159 Å²	159	76.9 Å²	76.9	69%	0.691	39%	0.387	S	S	*	.	H	α-helix	trans	-62.6	-46.9	175.9	-176.1	-179.8	179.4	-179.5	0	111.5	A252 T253 Y254 K260	A252-K256 WeakPolarHBondContact O-CB 3.42Å; A252-K256 PolarHBondContact O-N 3.42Å; T253-K256 PolarHBondContact O-N 3.46Å; Y254-K256 VanDerWaalsContact C-N 3.32Å; Y254-K256 PolarHBondContact O-N 3.33Å; K256-K260 WeakPolarHBondContact O-CB 3.46Å; K256-K260 PolarHBondContact O-N 3.41Å
257	H	64.7	Low	65	Low	71 Å²	71	81 Å²	81	33%	0.329	40%	0.4	S	S	.	.	H	α-helix	trans	-68.4	-38.9	178.3	-81.1	-83.5	0	0	0	112.5	T253 Y254 K260 L261 L319	T253-H257 PolarHBondContact O-CD2 3.47Å; T253-H257 VanDerWaalsContact O-CD2 3.26Å; T253-H257 PolarHBondContact O-N 3.15Å; Y254-H257 PolarHBondContact O-N 3.46Å; H257-K260 PolarHBondContact O-N 3.48Å; H257-L261 PolarHBondContact O-N 2.93Å; H257-L319 HydrophobicContact CB-CD1 4.28Å
258	K	62.6	Low	64.6	Low	94 Å²	94	83.8 Å²	83.8	41%	0.409	41%	0.41	S	S	.	.	H	α-helix	trans	-59.8	-51.8	173.4	-175.5	-180	176.9	-177.8	0	111.2	Y254 K260 L261 D262 L316	Y254-K258 HydrophobicContact CE1-CD 4.02Å; Y254-K258 VanDerWaalsContact O-CB 3.29Å; Y254-K258 WeakPolarHBondContact O-CB 3.46Å; Y254-K258 PolarHBondContact O-N 3.32Å; K258-K260 VanDerWaalsContact C-N 3.27Å; K258-K260 PolarHBondContact O-N 2.92Å; K258-L261 PolarHBondContact O-N 3Å; K258-L261 VanDerWaalsContact O-N 3.11Å; K258-D262 VanDerWaalsContact O-CG 3.25Å; K258-D262 PolarHBondContact O-N 3.2Å; K258-L316 HydrophobicContact CB-CD2 4.19Å
259	K	71.4	Confident	63.4	Low	133 Å²	133	82.3 Å²	82.3	58%	0.578	40%	0.4	S	S	*	.	H	α-helix	trans	-57.9	-38.8	175.5	-75.2	179	-179.4	-179.2	0	112.4	Q255 N263	Q255-K259 WeakPolarHBondContact O-CB 3.35Å; Q255-K259 WeakPolarHBondContact O-CG 3.36Å; Q255-K259 PolarHBondContact O-N 3.04Å; K259-N263 WeakPolarHBondContact O-CB 3.44Å; K259-N263 PolarHBondContact O-N 2.94Å; K259-N263 PolarHBondContact O-ND2 3.41Å
260	K	69.9	Low	62.1	Low	120 Å²	120	86.1 Å²	86.1	52%	0.522	41%	0.406	S	S	.	.	H	α-helix	trans	-64.1	-44.9	176	-169.5	-179.3	178.1	-175	0	111.4	K256 H257 K258 N263 E264 F314	K256-K260 WeakPolarHBondContact O-CB 3.46Å; K256-K260 PolarHBondContact O-N 3.41Å; H257-K260 PolarHBondContact O-N 3.48Å; K258-K260 VanDerWaalsContact C-N 3.27Å; K258-K260 PolarHBondContact O-N 2.92Å; K260-N263 PolarHBondContact O-N 3.45Å; K260-E264 WeakPolarHBondContact O-CG 3.36Å; K260-E264 PolarHBondContact O-N 3.37Å; K260-F314 HydrophobicContact CB-CE1 4.22Å; K260-F314 HydrophobicContact CD-CE1 4.12Å; K260-F314 HydrophobicContact CG-CE1 4.02Å
261	L	57.8	Low	61.6	Low	19 Å²	19	90 Å²	90	10%	0.099	43%	0.429	C	S	.	.	H	α-helix	trans	-63.3	-47.8	175.5	178.4	68.1	0	0	0	111.3	H257 K258 N263 E264 I265 I310 F314 L316	H257-L261 PolarHBondContact O-N 2.93Å; K258-L261 PolarHBondContact O-N 3Å; K258-L261 VanDerWaalsContact O-N 3.11Å; L261-N263 VanDerWaalsContact C-N 3.26Å; L261-N263 PolarHBondContact O-N 3.24Å; L261-E264 PolarHBondContact O-N 2.79Å; L261-I265 HydrophobicContact CD1-CD1 4.08Å; L261-I265 HydrophobicContact CD1-CG1 4.17Å; L261-I265 HydrophobicContact CD2-CD1 4.18Å; L261-I265 HydrophobicContact CG-CD1 3.79Å; L261-I265 HydrophobicContact CG-CG1 4.26Å; L261-I265 WeakPolarHBondContact O-CG1 3.03Å; L261-I265 PolarHBondContact O-N 2.97Å; L261-I310 HydrophobicContact CD1-CG2 3.52Å; L261-F314 HydrophobicContact CB-CD1 3.98Å; L261-F314 HydrophobicContact CB-CE1 4.05Å; L261-F314 HydrophobicContact CB-CG 4.3Å; L261-F314 HydrophobicContact CB-CZ 4.43Å; L261-F314 HydrophobicContact CD1-CD1 4.44Å; L261-F314 HydrophobicContact CD1-CD2 3.66Å; L261-F314 HydrophobicContact CD1-CE2 3.73Å; L261-F314 HydrophobicContact CD1-CG 4.03Å; L261-F314 HydrophobicContact CD1-CZ 4.17Å; L261-L316 HydrophobicContact CB-CD1 4Å; L261-L316 HydrophobicContact CD2-CD1 3.3Å; L261-L316 HydrophobicContact CG-CD1 4.22Å
262	D	54.7	Low	60.5	Low	67 Å²	67	90.3 Å²	90.3	36%	0.358	43%	0.429	S	S	.	.	H	α-helix	trans	-56.8	-43.6	178.5	-67.2	-22.4	0	0	0	110.3	K258 E264 I265 I266	K258-D262 VanDerWaalsContact O-CG 3.25Å; K258-D262 PolarHBondContact O-N 3.2Å; D262-E264 PolarHBondContact O-N 3.47Å; D262-I265 PolarHBondContact O-N 3.26Å; D262-I266 WeakPolarHBondContact O-CB 3.29Å; D262-I266 WeakPolarHBondContact O-CD1 3.48Å; D262-I266 WeakPolarHBondContact O-CG1 3.36Å; D262-I266 PolarHBondContact O-N 2.88Å
263	N	68.3	Low	59.1	Low	97 Å²	97	90.8 Å²	90.8	52%	0.519	43%	0.429	S	S	.	.	H	α-helix	trans	-63.9	-38.4	175	-73.8	-22.2	0	0	0	113.1	K259 K260 L261 K267	K259-N263 WeakPolarHBondContact O-CB 3.44Å; K259-N263 PolarHBondContact O-N 2.94Å; K259-N263 PolarHBondContact O-ND2 3.41Å; K260-N263 PolarHBondContact O-N 3.45Å; L261-N263 VanDerWaalsContact C-N 3.26Å; L261-N263 PolarHBondContact O-N 3.24Å; N263-K267 WeakPolarHBondContact O-CB 3.45Å; N263-K267 VanDerWaalsContact O-CG 3.28Å; N263-K267 WeakPolarHBondContact O-CG 3.45Å; N263-K267 PolarHBondContact O-N 2.82Å
264	E	60.9	Low	57.8	Low	82 Å²	82	95.2 Å²	95.2	38%	0.383	45%	0.448	S	S	.	.	H	α-helix	trans	-68.8	-40.6	175.2	-72.2	-132.8	171.9	0	0	112.5	K260 L261 D262 K267 K268 F314	K260-E264 WeakPolarHBondContact O-CG 3.36Å; K260-E264 PolarHBondContact O-N 3.37Å; L261-E264 PolarHBondContact O-N 2.79Å; D262-E264 PolarHBondContact O-N 3.47Å; E264-K267 PolarHBondContact O-N 2.96Å; E264-K268 WeakPolarHBondContact O-CG 3.3Å; E264-K268 PolarHBondContact O-N 3.47Å; E264-F314 HydrophobicContact CG-CZ 4.19Å
265	I	51.7	Low	57.2	Low	40 Å²	40	101.7 Å²	101.7	21%	0.205	48%	0.477	C	S	.	.	H	α-helix	trans	-62.1	-48.6	174	-67.6	172.7	0	0	0	109.2	L261 D262 K267 K268 C269 L298	L261-I265 HydrophobicContact CD1-CD1 4.08Å; L261-I265 HydrophobicContact CD1-CG1 4.17Å; L261-I265 HydrophobicContact CD2-CD1 4.18Å; L261-I265 HydrophobicContact CG-CD1 3.79Å; L261-I265 HydrophobicContact CG-CG1 4.26Å; L261-I265 WeakPolarHBondContact O-CG1 3.03Å; L261-I265 PolarHBondContact O-N 2.97Å; D262-I265 PolarHBondContact O-N 3.26Å; I265-K267 VanDerWaalsContact C-N 3.33Å; I265-K267 PolarHBondContact O-N 3.36Å; I265-K268 PolarHBondContact O-N 2.83Å; I265-K268 VanDerWaalsContact O-N 3.17Å; I265-C269 VanDerWaalsContact O-CB 3.28Å; I265-C269 WeakPolarHBondContact O-CB 3.33Å; I265-C269 PolarHBondContact O-N 3.03Å; I265-C269 PolarHBondContact O-SG 2.83Å; I265-L298 HydrophobicContact CG2-CD2 4.28Å
266	I	56.5	Low	56	Low	82 Å²	82	102.6 Å²	102.6	42%	0.421	48%	0.481	S	S	.	.	H	α-helix	trans	-58.6	-43.9	177	-69.3	164	0	0	0	111	D262 K268 C269 R270	D262-I266 WeakPolarHBondContact O-CB 3.29Å; D262-I266 WeakPolarHBondContact O-CD1 3.48Å; D262-I266 WeakPolarHBondContact O-CG1 3.36Å; D262-I266 PolarHBondContact O-N 2.88Å; I266-K268 PolarHBondContact O-N 2.79Å; I266-C269 PolarHBondContact O-N 2.95Å; I266-R270 WeakPolarHBondContact O-CB 3.25Å; I266-R270 WeakPolarHBondContact O-CG 3.41Å; I266-R270 PolarHBondContact O-N 3.08Å
267	K	61.8	Low	54.5	Low	146 Å²	146	97.6 Å²	97.6	64%	0.635	46%	0.46	S	S	*	.	H	α-helix	trans	-61.2	-43.1	176.3	-79.5	178.6	-178.8	-174.6	0	112.2	N263 E264 I265	N263-K267 WeakPolarHBondContact O-CB 3.45Å; N263-K267 VanDerWaalsContact O-CG 3.28Å; N263-K267 WeakPolarHBondContact O-CG 3.45Å; N263-K267 PolarHBondContact O-N 2.82Å; E264-K267 PolarHBondContact O-N 2.96Å; I265-K267 VanDerWaalsContact C-N 3.33Å; I265-K267 PolarHBondContact O-N 3.36Å
268	K	52.4	Low	53.5	Low	102 Å²	102	100.8 Å²	100.8	44%	0.443	47%	0.472	S	S	.	.	H	α-helix	trans	-69.2	-44.8	177.2	-74.1	-173.6	178.1	-175.6	0	111.6	E264 I265 I266 R270 N271 F272	E264-K268 WeakPolarHBondContact O-CG 3.3Å; E264-K268 PolarHBondContact O-N 3.47Å; I265-K268 PolarHBondContact O-N 2.83Å; I265-K268 VanDerWaalsContact O-N 3.17Å; I266-K268 PolarHBondContact O-N 2.79Å; K268-R270 VanDerWaalsContact C-N 3.32Å; K268-R270 PolarHBondContact O-N 2.92Å; K268-N271 WeakPolarHBondContact O-CB 3.34Å; K268-N271 PolarHBondContact O-N 2.85Å; K268-F272 VanDerWaalsContact O-CD2 3.29Å; K268-F272 WeakPolarHBondContact O-CD2 3.41Å
269	C	44.8	Very low	52.7	Low	37 Å²	37	101.8 Å²	101.8	25%	0.25	48%	0.482	C	S	.	.	H	α-helix	trans	-62.2	-33.8	177	-70.8	0	0	0	0	113	I265 I266 N271 F272	I265-C269 VanDerWaalsContact O-CB 3.28Å; I265-C269 WeakPolarHBondContact O-CB 3.33Å; I265-C269 PolarHBondContact O-N 3.03Å; I265-C269 PolarHBondContact O-SG 2.83Å; I266-C269 PolarHBondContact O-N 2.95Å; C269-N271 PolarHBondContact O-N 3.36Å; C269-F272 PolarHBondContact O-N 3.34Å
270	R	49.1	Very low	51.2	Low	200 Å²	200	98.9 Å²	98.9	76%	0.755	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-22.6	172.7	-81	-179.7	-173.5	179.5	2.2	113.5	I266 K268	I266-R270 WeakPolarHBondContact O-CB 3.25Å; I266-R270 WeakPolarHBondContact O-CG 3.41Å; I266-R270 PolarHBondContact O-N 3.08Å; K268-R270 VanDerWaalsContact C-N 3.32Å; K268-R270 PolarHBondContact O-N 2.92Å
271	N	50.6	Low	49.9	Very low	142 Å²	142	97.3 Å²	97.3	76%	0.759	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-2.2	176.8	-63	-11.8	0	0	0	112.9	K268 C269	K268-N271 WeakPolarHBondContact O-CB 3.34Å; K268-N271 PolarHBondContact O-N 2.85Å; C269-N271 PolarHBondContact O-N 3.36Å
272	F	44.2	Very low	49.4	Very low	70 Å²	70	103.6 Å²	103.6	31%	0.307	50%	0.503	S	S	.	.	S	Bend	trans	-81.8	134	175.3	-88.8	-88	0	0	0	110.5	K268 C269 M274 E276 F277 I301	K268-F272 VanDerWaalsContact O-CD2 3.29Å; K268-F272 WeakPolarHBondContact O-CD2 3.41Å; C269-F272 PolarHBondContact O-N 3.34Å; F272-M274 PolarHBondContact O-N 3.3Å; F272-E276 WeakPolarHBondContact CD1-OE2 3.34Å; F272-F277 HydrophobicContact CB-CE2 4.5Å; F272-I301 HydrophobicContact CD1-CG2 4.03Å; F272-I301 HydrophobicContact CE1-CG2 3.38Å; F272-I301 HydrophobicContact CE2-CG2 4.15Å; F272-I301 HydrophobicContact CZ-CG2 3.45Å; F272-I301 VanDerWaalsContact CZ-CG2 3.45Å
273	S	44	Very low	48.5	Very low	67 Å²	67	107.2 Å²	107.2	47%	0.469	52%	0.518	S	S	.	.			trans	-63.7	132	178.3	94.7	0	0	0	0	109.8	K275 E276	S273-K275 PolarHBondContact O-N 3.45Å; S273-E276 PolarHBondContact O-N 2.83Å
274	M	41.5	Very low	46.9	Very low	144 Å²	144	108.9 Å²	108.9	71%	0.709	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-1.3	-176.6	-156.5	54.6	-166.9	0	0	114.1	F272 F277	F272-M274 PolarHBondContact O-N 3.3Å; M274-F277 HydrophobicContact CE-CB 4.37Å; M274-F277 HydrophobicContact SD-CB 4.32Å
275	K	49	Very low	46	Very low	177 Å²	177	109.6 Å²	109.6	77%	0.77	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-32.2	173.5	-77.1	-177.9	175.4	179.6	0	112.7	S273	S273-K275 PolarHBondContact O-N 3.45Å
276	E	44.5	Very low	45.1	Very low	106 Å²	106	115.8 Å²	115.8	50%	0.495	57%	0.574	S	S	.	*	S	Bend	trans	-80.9	-23.2	-177	-67.2	179.9	166.7	0	0	113.3	F272 S273	F272-E276 WeakPolarHBondContact CD1-OE2 3.34Å; S273-E276 PolarHBondContact O-N 2.83Å
277	F	43.4	Very low	44.4	Very low	54 Å²	54	114.6 Å²	114.6	24%	0.237	57%	0.573	C	S	.	*	S	Bend	trans	-84.2	-15.9	177	-90.1	-86.2	0	0	0	114	F272 M274 D279 I280 S281 I301	F272-F277 HydrophobicContact CB-CE2 4.5Å; M274-F277 HydrophobicContact CE-CB 4.37Å; M274-F277 HydrophobicContact SD-CB 4.32Å; F277-D279 VanDerWaalsContact C-N 3.26Å; F277-D279 PolarHBondContact O-N 3.36Å; F277-I280 HydrophobicContact CD1-CD1 4.45Å; F277-I280 PolarHBondContact O-N 3.09Å; F277-S281 PolarHBondContact O-N 2.66Å; F277-S281 PolarHBondContact O-OG 2.84Å; F277-I301 HydrophobicContact CE2-CD1 4.18Å; F277-I301 HydrophobicContact CZ-CD1 4.04Å
278	K	43.8	Very low	43.6	Very low	137 Å²	137	113.8 Å²	113.8	60%	0.596	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-19.9	-176.2	-116.5	-179.9	179.6	-177.9	0	113.6	S281	K278-S281 PolarHBondContact O-OG 2.98Å
279	D	45.5	Very low	43.6	Very low	115 Å²	115	111.9 Å²	111.9	62%	0.615	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-23.4	176.6	-65.7	-28.2	0	0	0	112.3	F277	F277-D279 VanDerWaalsContact C-N 3.26Å; F277-D279 PolarHBondContact O-N 3.36Å
280	I	41.8	Very low	43.4	Very low	73 Å²	73	113.9 Å²	113.9	37%	0.374	59%	0.591	S	S	.	*	G	3₁₀ helix	trans	-81.4	-25.2	177.8	-61.5	160.2	0	0	0	111.8	F277 K282 I301	F277-I280 HydrophobicContact CD1-CD1 4.45Å; F277-I280 PolarHBondContact O-N 3.09Å; I280-K282 VanDerWaalsContact C-N 3.34Å; I280-I301 HydrophobicContact CD1-CD1 4.49Å
281	S	41.5	Very low	42.8	Very low	86 Å²	86	108 Å²	108	60%	0.601	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-85.8	-0.7	-178.9	49.7	0	0	0	0	114.6	F277 K278	F277-S281 PolarHBondContact O-N 2.66Å; F277-S281 PolarHBondContact O-OG 2.84Å; K278-S281 PolarHBondContact O-OG 2.98Å
282	K	46.4	Very low	42.8	Very low	152 Å²	152	106.9 Å²	106.9	66%	0.661	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-90.2	-13.2	177.6	-74	179.1	-178.8	172	0	114.3	I280 T284	I280-K282 VanDerWaalsContact C-N 3.34Å; K282-T284 PolarHBondContact O-N 3.22Å
283	E	37.8	Very low	43	Very low	143 Å²	143	106.8 Å²	106.8	67%	0.668	57%	0.574	S	S	*	*			trans	-81.7	84.1	171	-79.9	-176.1	165.3	0	0	110.4	T285	E283-T285 PolarHBondContact O-N 3.48Å
284	T	34.5	Very low	43.1	Very low	131 Å²	131	108.7 Å²	108.7	80%	0.804	57%	0.574	S	S	*	*			trans	-73.2	66.3	171.5	35	0	0	0	0	111	K282	K282-T284 PolarHBondContact O-N 3.22Å
285	T	41.1	Very low	43.4	Very low	97 Å²	97	103.8 Å²	103.8	60%	0.595	55%	0.553	S	S	*	*			trans	-143.5	92.7	159.5	51.1	0	0	0	0	108.4	E283 S287	E283-T285 PolarHBondContact O-N 3.48Å; T285-S287 PolarHBondContact O-N 3.3Å
286	L	32.5	Very low	43.7	Very low	170 Å²	170	99.2 Å²	99.2	89%	0.89	54%	0.536	S	S	*	.			trans	-65.1	78.7	167.5	-103.6	98.8	0	0	0	109	V290	L286-V290 HydrophobicContact CD2-CG2 4.47Å; L286-V290 HydrophobicContact CG-CG2 4.43Å
287	S	41.4	Very low	44	Very low	58 Å²	58	95.1 Å²	95.1	41%	0.406	52%	0.519	S	S	.	.			trans	-77.9	155.7	164.6	165.3	0	0	0	0	109	T285 D289	T285-S287 PolarHBondContact O-N 3.3Å; S287-D289 PolarHBondContact O-N 2.75Å
288	S	44.9	Very low	44.4	Very low	128 Å²	128	93.3 Å²	93.3	90%	0.895	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	9	-178.8	56.4	0	0	0	0	115.9
289	D	52.2	Low	45.1	Very low	63 Å²	63	89.9 Å²	89.9	34%	0.337	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	24.6	-172.7	-118.6	-10.3	0	0	0	113	S287 A291 K292 Q293	S287-D289 PolarHBondContact O-N 2.75Å; D289-A291 PolarHBondContact O-N 3.41Å; D289-K292 HydrophobicContact CB-CB 4.14Å; D289-K292 CarbonylContact O-C 3.58Å; D289-K292 WeakPolarHBondContact O-CA 3.28Å; D289-K292 WeakPolarHBondContact O-CB 3.38Å; D289-K292 PolarHBondContact O-N 3.22Å; D289-K292 WeakPolarHBondContact OD1-CB 3.37Å; D289-K292 WeakPolarHBondContact OD1-CD 3.43Å; D289-K292 WeakPolarHBondContact OD2-CD 3.44Å; D289-K292 IonicContact OD2-NZ 3.17Å; D289-K292 PolarHBondContact OD2-NZ 2.77Å; D289-Q293 PolarHBondContact O-N 2.87Å
290	V	41.3	Very low	45.8	Very low	78 Å²	78	90 Å²	90	47%	0.473	50%	0.503	S	S	.	.	H	α-helix	trans	-52.2	-40.5	177.2	179.3	0	0	0	0	111.9	L286 K292 Q293 F294	L286-V290 HydrophobicContact CD2-CG2 4.47Å; L286-V290 HydrophobicContact CG-CG2 4.43Å; V290-K292 VanDerWaalsContact C-N 3.3Å; V290-K292 PolarHBondContact O-N 3.05Å; V290-Q293 PolarHBondContact O-N 3.28Å; V290-F294 VanDerWaalsContact O-CB 3.3Å; V290-F294 WeakPolarHBondContact O-CB 3.22Å; V290-F294 PolarHBondContact O-N 2.82Å
291	A	37.6	Very low	46.3	Very low	76 Å²	76	88.8 Å²	88.8	63%	0.628	50%	0.496	S	S	*	.	H	α-helix	trans	-64	-36	176.5	0	0	0	0	0	112.3	D289 T295	D289-A291 PolarHBondContact O-N 3.41Å; A291-T295 VanDerWaalsContact O-CB 3.26Å; A291-T295 WeakPolarHBondContact O-CB 3.47Å; A291-T295 PolarHBondContact O-N 3.15Å; A291-T295 PolarHBondContact O-OG1 2.88Å
292	K	48.9	Very low	47	Very low	119 Å²	119	86 Å²	86	52%	0.517	47%	0.474	S	S	.	.	H	α-helix	trans	-78.4	-38.5	-179.5	-154.6	-179.3	-175.6	-179.9	0	111.3	D289 V290 T295 N296	D289-K292 HydrophobicContact CB-CB 4.14Å; D289-K292 CarbonylContact O-C 3.58Å; D289-K292 WeakPolarHBondContact O-CA 3.28Å; D289-K292 WeakPolarHBondContact O-CB 3.38Å; D289-K292 PolarHBondContact O-N 3.22Å; D289-K292 WeakPolarHBondContact OD1-CB 3.37Å; D289-K292 WeakPolarHBondContact OD1-CD 3.43Å; D289-K292 WeakPolarHBondContact OD2-CD 3.44Å; D289-K292 IonicContact OD2-NZ 3.17Å; D289-K292 PolarHBondContact OD2-NZ 2.77Å; V290-K292 VanDerWaalsContact C-N 3.3Å; V290-K292 PolarHBondContact O-N 3.05Å; K292-T295 PolarHBondContact O-N 3.07Å; K292-N296 WeakPolarHBondContact O-CB 2.79Å; K292-N296 PolarHBondContact O-N 3.43Å; K292-N296 PolarHBondContact O-ND2 2.66Å
293	Q	49.2	Very low	47.5	Very low	68 Å²	68	80.3 Å²	80.3	32%	0.318	46%	0.459	S	S	.	.	H	α-helix	trans	-61.3	-49.5	171.2	-72.9	-178.6	-6.1	0	0	110.9	D289 V290 T295 N296 S297	D289-Q293 PolarHBondContact O-N 2.87Å; V290-Q293 PolarHBondContact O-N 3.28Å; Q293-T295 VanDerWaalsContact C-N 3.32Å; Q293-T295 PolarHBondContact O-N 3.2Å; Q293-N296 PolarHBondContact O-N 3.45Å; Q293-N296 VanDerWaalsContact O-N 3.11Å; Q293-S297 PolarHBondContact O-N 2.95Å; Q293-S297 PolarHBondContact O-OG 3.35Å; Q293-S297 VanDerWaalsContact O-OG 3.1Å
294	F	46.8	Very low	48.3	Very low	108 Å²	108	82.7 Å²	82.7	47%	0.474	46%	0.461	S	S	.	.	H	α-helix	trans	-60.2	-41.6	175.9	-174.8	-105.5	0	0	0	112.3	V290 N296 S297 L298	V290-F294 VanDerWaalsContact O-CB 3.3Å; V290-F294 WeakPolarHBondContact O-CB 3.22Å; V290-F294 PolarHBondContact O-N 2.82Å; F294-N296 VanDerWaalsContact C-N 3.35Å; F294-N296 PolarHBondContact O-N 3.5Å; F294-S297 PolarHBondContact O-N 3.29Å; F294-L298 HydrophobicContact CD1-CD1 3.64Å; F294-L298 HydrophobicContact CE1-CD1 3.21Å; F294-L298 HydrophobicContact CE1-CG 4.26Å; F294-L298 HydrophobicContact CE2-CD1 4.49Å; F294-L298 HydrophobicContact CG-CD1 4.45Å; F294-L298 HydrophobicContact CZ-CD1 3.7Å; F294-L298 HydrophobicContact CZ-CG 4.36Å; F294-L298 WeakPolarHBondContact O-CB 3.44Å; F294-L298 PolarHBondContact O-N 3.37Å
295	T	48.1	Very low	49.1	Very low	41 Å²	41	85.1 Å²	85.1	25%	0.252	46%	0.461	S	S	.	.	H	α-helix	trans	-63.1	-40.2	174.9	-61.7	0	0	0	0	111.9	A291 K292 Q293 L298 K299 Y307	A291-T295 VanDerWaalsContact O-CB 3.26Å; A291-T295 WeakPolarHBondContact O-CB 3.47Å; A291-T295 PolarHBondContact O-N 3.15Å; A291-T295 PolarHBondContact O-OG1 2.88Å; K292-T295 PolarHBondContact O-N 3.07Å; Q293-T295 VanDerWaalsContact C-N 3.32Å; Q293-T295 PolarHBondContact O-N 3.2Å; T295-L298 PolarHBondContact O-N 2.98Å; T295-K299 HydrophobicContact CG2-CD 4.37Å; T295-K299 WeakPolarHBondContact O-CB 3.32Å; T295-K299 VanDerWaalsContact O-CG 3.31Å; T295-K299 WeakPolarHBondContact O-CG 3.34Å; T295-K299 PolarHBondContact O-N 2.99Å; T295-Y307 WeakPolarHBondContact CG2-OH 3.39Å
296	N	54.5	Low	49.8	Very low	80 Å²	80	86.3 Å²	86.3	43%	0.428	46%	0.46	S	S	.	.	H	α-helix	trans	-68.8	-42.9	177.3	-72.9	-16.9	0	0	0	111.1	K292 Q293 F294 L298 K299 T300	K292-N296 WeakPolarHBondContact O-CB 2.79Å; K292-N296 PolarHBondContact O-N 3.43Å; K292-N296 PolarHBondContact O-ND2 2.66Å; Q293-N296 PolarHBondContact O-N 3.45Å; Q293-N296 VanDerWaalsContact O-N 3.11Å; F294-N296 VanDerWaalsContact C-N 3.35Å; F294-N296 PolarHBondContact O-N 3.5Å; N296-L298 PolarHBondContact O-N 3.07Å; N296-K299 WeakPolarHBondContact O-CB 3.24Å; N296-K299 PolarHBondContact O-N 3.2Å; N296-T300 PolarHBondContact O-N 3.37Å; N296-T300 PolarHBondContact O-OG1 3.33Å
297	S	51.6	Low	50.7	Low	20 Å²	20	80.2 Å²	80.2	14%	0.14	43%	0.425	C	S	.	.	H	α-helix	trans	-59.2	-44.3	173.1	-58.7	0	0	0	0	111.9	Q293 F294 K299 T300 I301	Q293-S297 PolarHBondContact O-N 2.95Å; Q293-S297 PolarHBondContact O-OG 3.35Å; Q293-S297 VanDerWaalsContact O-OG 3.1Å; F294-S297 PolarHBondContact O-N 3.29Å; S297-K299 PolarHBondContact O-N 2.82Å; S297-T300 PolarHBondContact O-N 3.42Å; S297-I301 WeakPolarHBondContact O-CB 3.37Å; S297-I301 VanDerWaalsContact O-CG1 3.24Å; S297-I301 WeakPolarHBondContact O-CG1 3.11Å; S297-I301 PolarHBondContact O-N 2.94Å
298	L	50.5	Low	51.2	Low	16 Å²	16	82.9 Å²	82.9	8%	0.084	43%	0.43	C	S	.	.	H	α-helix	trans	-63.1	-39.5	174.8	-88.9	164.5	0	0	0	112.9	I265 F294 T295 N296 T300 I301 L302 Y307	I265-L298 HydrophobicContact CG2-CD2 4.28Å; F294-L298 HydrophobicContact CD1-CD1 3.64Å; F294-L298 HydrophobicContact CE1-CD1 3.21Å; F294-L298 HydrophobicContact CE1-CG 4.26Å; F294-L298 HydrophobicContact CE2-CD1 4.49Å; F294-L298 HydrophobicContact CG-CD1 4.45Å; F294-L298 HydrophobicContact CZ-CD1 3.7Å; F294-L298 HydrophobicContact CZ-CG 4.36Å; F294-L298 WeakPolarHBondContact O-CB 3.44Å; F294-L298 PolarHBondContact O-N 3.37Å; T295-L298 PolarHBondContact O-N 2.98Å; N296-L298 PolarHBondContact O-N 3.07Å; L298-T300 VanDerWaalsContact C-N 3.29Å; L298-T300 PolarHBondContact O-N 3.34Å; L298-I301 PolarHBondContact O-N 3Å; L298-L302 HydrophobicContact CD2-CD1 3.75Å; L298-L302 HydrophobicContact CD2-CG 4.49Å; L298-L302 WeakPolarHBondContact O-CB 3.48Å; L298-L302 PolarHBondContact O-N 3.43Å; L298-Y307 HydrophobicContact CB-CD2 4.41Å; L298-Y307 HydrophobicContact CB-CE2 4.26Å
299	K	58.4	Low	51.7	Low	66 Å²	66	82.9 Å²	82.9	29%	0.287	42%	0.416	S	S	.	.	H	α-helix	trans	-62.7	-36.7	174	-78.8	171.5	-177.5	170.3	0	111.9	T295 N296 S297 G303 Y307	T295-K299 HydrophobicContact CG2-CD 4.37Å; T295-K299 WeakPolarHBondContact O-CB 3.32Å; T295-K299 VanDerWaalsContact O-CG 3.31Å; T295-K299 WeakPolarHBondContact O-CG 3.34Å; T295-K299 PolarHBondContact O-N 2.99Å; N296-K299 WeakPolarHBondContact O-CB 3.24Å; N296-K299 PolarHBondContact O-N 3.2Å; S297-K299 PolarHBondContact O-N 2.82Å; K299-G303 CarbonylContact O-C 3.57Å; K299-G303 VanDerWaalsContact O-CA 3.29Å; K299-G303 WeakPolarHBondContact O-CA 3.36Å; K299-G303 PolarHBondContact O-N 3.46Å; K299-Y307 HydrophobicContact CD-CE1 4.48Å; K299-Y307 HydrophobicContact CG-CD1 3.79Å; K299-Y307 HydrophobicContact CG-CD2 4.45Å; K299-Y307 HydrophobicContact CG-CE1 3.87Å; K299-Y307 HydrophobicContact CG-CG 4.08Å
300	T	60.7	Low	51.7	Low	118 Å²	118	81.7 Å²	81.7	72%	0.724	41%	0.409	S	S	*	.	H	α-helix	trans	-71.3	-47.8	177.4	-53.1	0	0	0	0	111.1	N296 S297 L298 G303	N296-T300 PolarHBondContact O-N 3.37Å; N296-T300 PolarHBondContact O-OG1 3.33Å; S297-T300 PolarHBondContact O-N 3.42Å; L298-T300 VanDerWaalsContact C-N 3.29Å; L298-T300 PolarHBondContact O-N 3.34Å; T300-G303 PolarHBondContact O-N 3.17Å
301	I	53.3	Low	52.1	Low	47 Å²	47	79.8 Å²	79.8	24%	0.241	40%	0.395	C	S	.	.	H	α-helix	trans	-67.9	-45.1	-176.4	-67.5	165	0	0	0	112	F272 F277 I280 S297 L298 G303	F272-I301 HydrophobicContact CD1-CG2 4.03Å; F272-I301 HydrophobicContact CE1-CG2 3.38Å; F272-I301 HydrophobicContact CE2-CG2 4.15Å; F272-I301 HydrophobicContact CZ-CG2 3.45Å; F272-I301 VanDerWaalsContact CZ-CG2 3.45Å; F277-I301 HydrophobicContact CE2-CD1 4.18Å; F277-I301 HydrophobicContact CZ-CD1 4.04Å; I280-I301 HydrophobicContact CD1-CD1 4.49Å; S297-I301 WeakPolarHBondContact O-CB 3.37Å; S297-I301 VanDerWaalsContact O-CG1 3.24Å; S297-I301 WeakPolarHBondContact O-CG1 3.11Å; S297-I301 PolarHBondContact O-N 2.94Å; L298-I301 PolarHBondContact O-N 3Å; I301-G303 VanDerWaalsContact C-N 3.34Å
302	L	54.5	Low	52.7	Low	27 Å²	27	84.3 Å²	84.3	14%	0.141	40%	0.401	C	S	.	.	H	α-helix	trans	-83.3	-14.5	-177.9	-66.4	164.2	0	0	0	112.5	L298 Q306 Y307 I310	L298-L302 HydrophobicContact CD2-CD1 3.75Å; L298-L302 HydrophobicContact CD2-CG 4.49Å; L298-L302 WeakPolarHBondContact O-CB 3.48Å; L298-L302 PolarHBondContact O-N 3.43Å; L302-Q306 VanDerWaalsContact O-CB 3.29Å; L302-Q306 WeakPolarHBondContact O-CB 3.43Å; L302-Q306 PolarHBondContact O-OE1 3.17Å; L302-Y307 HydrophobicContact CD1-CD2 4.09Å; L302-I310 HydrophobicContact CD1-CD1 4.42Å; L302-I310 HydrophobicContact CD2-CD1 4.41Å
303	G	58.6	Low	52.8	Low	32 Å²	32	83.4 Å²	83.4	33%	0.33	41%	0.406	S	S	.	.	H	α-helix	trans	67.6	144.7	-162.2	0	0	0	0	0	112	K299 T300 I301 K305 Q306 Y307	K299-G303 CarbonylContact O-C 3.57Å; K299-G303 VanDerWaalsContact O-CA 3.29Å; K299-G303 WeakPolarHBondContact O-CA 3.36Å; K299-G303 PolarHBondContact O-N 3.46Å; T300-G303 PolarHBondContact O-N 3.17Å; I301-G303 VanDerWaalsContact C-N 3.34Å; G303-K305 VanDerWaalsContact C-N 3.27Å; G303-K305 PolarHBondContact O-N 3.14Å; G303-K305 VanDerWaalsContact O-N 3.15Å; G303-Q306 PolarHBondContact O-N 3.3Å; G303-Y307 PolarHBondContact O-N 3.36Å; G303-Y307 VanDerWaalsContact O-N 3.08Å
304	R	54	Low	52.7	Low	193 Å²	193	81.4 Å²	81.4	73%	0.728	40%	0.396	S	S	*	.	H	α-helix	trans	-50	-44.9	-177.7	-87.3	-179.1	168.9	145	-3.4	112.8	F308	R304-F308 HydrophobicContact CB-CD2 4.49Å; R304-F308 WeakPolarHBondContact O-CB 3.49Å; R304-F308 WeakPolarHBondContact O-CD2 3.08Å; R304-F308 PolarHBondContact O-N 3.06Å
305	K	52.2	Low	53.2	Low	183 Å²	183	82.1 Å²	82.1	80%	0.796	40%	0.4	S	S	*	.	H	α-helix	trans	-59.8	-51.5	-178.3	-94.1	-175.2	176	178.5	0	112.4	G303 F308 Q309	G303-K305 VanDerWaalsContact C-N 3.27Å; G303-K305 PolarHBondContact O-N 3.14Å; G303-K305 VanDerWaalsContact O-N 3.15Å; K305-F308 PolarHBondContact O-N 2.76Å; K305-Q309 VanDerWaalsContact O-CB 3.29Å; K305-Q309 WeakPolarHBondContact O-CB 3.46Å; K305-Q309 PolarHBondContact O-N 3.17Å
306	Q	55.6	Low	53.4	Low	122 Å²	122	81.1 Å²	81.1	57%	0.57	39%	0.394	S	S	*	.	H	α-helix	trans	-71.6	-35.8	-177.1	-55.8	-178.4	-5.5	0	0	111.8	L302 G303 Q309 I310	L302-Q306 VanDerWaalsContact O-CB 3.29Å; L302-Q306 WeakPolarHBondContact O-CB 3.43Å; L302-Q306 PolarHBondContact O-OE1 3.17Å; G303-Q306 PolarHBondContact O-N 3.3Å; Q306-Q309 PolarHBondContact O-N 2.84Å; Q306-I310 VanDerWaalsContact O-CG1 3.27Å; Q306-I310 WeakPolarHBondContact O-CG1 3.41Å; Q306-I310 PolarHBondContact O-N 2.95Å
307	Y	49.7	Very low	53.2	Low	41 Å²	41	83.4 Å²	83.4	16%	0.161	40%	0.402	C	S	.	.	H	α-helix	trans	-58.6	-51.1	173.9	178.1	-98.7	0	0	0	111.8	T295 L298 K299 L302 G303 Q309 I310 I311	T295-Y307 WeakPolarHBondContact CG2-OH 3.39Å; L298-Y307 HydrophobicContact CB-CD2 4.41Å; L298-Y307 HydrophobicContact CB-CE2 4.26Å; K299-Y307 HydrophobicContact CD-CE1 4.48Å; K299-Y307 HydrophobicContact CG-CD1 3.79Å; K299-Y307 HydrophobicContact CG-CD2 4.45Å; K299-Y307 HydrophobicContact CG-CE1 3.87Å; K299-Y307 HydrophobicContact CG-CG 4.08Å; L302-Y307 HydrophobicContact CD1-CD2 4.09Å; G303-Y307 PolarHBondContact O-N 3.36Å; G303-Y307 VanDerWaalsContact O-N 3.08Å; Y307-Q309 VanDerWaalsContact C-N 3.3Å; Y307-Q309 PolarHBondContact O-N 3.49Å; Y307-I310 PolarHBondContact O-N 3.41Å; Y307-I311 HydrophobicContact CD1-CD1 3.91Å; Y307-I311 HydrophobicContact CE1-CD1 3.26Å; Y307-I311 HydrophobicContact CE1-CG1 4.4Å; Y307-I311 HydrophobicContact CE2-CD1 4.1Å; Y307-I311 WeakPolarHBondContact O-CG1 3.42Å; Y307-I311 PolarHBondContact O-N 3.29Å; Y307-I311 WeakPolarHBondContact OH-CD1 3.22Å
308	F	52.8	Low	53.3	Low	114 Å²	114	86.3 Å²	86.3	50%	0.5	42%	0.416	S	S	.	.	H	α-helix	trans	-64.7	-35.5	176.5	-85.2	-69.6	0	0	0	112.1	R304 K305 I311 K312	R304-F308 HydrophobicContact CB-CD2 4.49Å; R304-F308 WeakPolarHBondContact O-CB 3.49Å; R304-F308 WeakPolarHBondContact O-CD2 3.08Å; R304-F308 PolarHBondContact O-N 3.06Å; K305-F308 PolarHBondContact O-N 2.76Å; F308-I311 PolarHBondContact O-N 3.33Å; F308-K312 WeakPolarHBondContact O-CB 3.27Å; F308-K312 PolarHBondContact O-N 2.77Å
309	Q	55.8	Low	53.2	Low	129 Å²	129	87.1 Å²	87.1	60%	0.603	42%	0.42	S	S	*	.	H	α-helix	trans	-64	-45.5	176.7	-156.3	145.5	-3.2	0	0	110.8	K305 Q306 Y307 I311 K312 T313	K305-Q309 VanDerWaalsContact O-CB 3.29Å; K305-Q309 WeakPolarHBondContact O-CB 3.46Å; K305-Q309 PolarHBondContact O-N 3.17Å; Q306-Q309 PolarHBondContact O-N 2.84Å; Y307-Q309 VanDerWaalsContact C-N 3.3Å; Y307-Q309 PolarHBondContact O-N 3.49Å; Q309-I311 PolarHBondContact O-N 2.72Å; Q309-K312 CarbonylContact O-C 3.42Å; Q309-K312 PolarHBondContact O-N 3Å; Q309-T313 WeakPolarHBondContact O-CB 3.3Å; Q309-T313 PolarHBondContact O-N 2.75Å; Q309-T313 PolarHBondContact O-OG1 3.24Å
310	I	51.4	Low	52.7	Low	37 Å²	37	89.9 Å²	89.9	19%	0.19	43%	0.429	C	S	.	.	H	α-helix	trans	-61	-45.8	175.8	-68.1	165.5	0	0	0	111.3	L261 L302 Q306 Y307 K312 T313 F314	L261-I310 HydrophobicContact CD1-CG2 3.52Å; L302-I310 HydrophobicContact CD1-CD1 4.42Å; L302-I310 HydrophobicContact CD2-CD1 4.41Å; Q306-I310 VanDerWaalsContact O-CG1 3.27Å; Q306-I310 WeakPolarHBondContact O-CG1 3.41Å; Q306-I310 PolarHBondContact O-N 2.95Å; Y307-I310 PolarHBondContact O-N 3.41Å; I310-K312 VanDerWaalsContact C-N 3.31Å; I310-K312 PolarHBondContact O-N 3.01Å; I310-T313 PolarHBondContact O-N 3.41Å; I310-F314 HydrophobicContact CG2-CD2 4.13Å; I310-F314 HydrophobicContact CG2-CE2 4.38Å; I310-F314 WeakPolarHBondContact O-CD2 3.49Å; I310-F314 PolarHBondContact O-N 2.96Å
311	I	49.7	Very low	52.2	Low	38 Å²	38	87.9 Å²	87.9	20%	0.195	41%	0.414	C	S	.	.	H	α-helix	trans	-60.7	-43.2	175.9	-69.4	179.8	0	0	0	111.3	Y307 F308 Q309 F314 H315	Y307-I311 HydrophobicContact CD1-CD1 3.91Å; Y307-I311 HydrophobicContact CE1-CD1 3.26Å; Y307-I311 HydrophobicContact CE1-CG1 4.4Å; Y307-I311 HydrophobicContact CE2-CD1 4.1Å; Y307-I311 WeakPolarHBondContact O-CG1 3.42Å; Y307-I311 PolarHBondContact O-N 3.29Å; Y307-I311 WeakPolarHBondContact OH-CD1 3.22Å; F308-I311 PolarHBondContact O-N 3.33Å; Q309-I311 PolarHBondContact O-N 2.72Å; I311-F314 PolarHBondContact O-N 3.15Å; I311-H315 PolarHBondContact O-N 2.81Å
312	K	51.4	Low	52	Low	172 Å²	172	89.2 Å²	89.2	75%	0.748	42%	0.42	S	S	*	.	H	α-helix	trans	-65.8	-39.4	178.8	-160.5	174.2	-173.7	179.5	0	111.3	F308 Q309 I310 F314 H315	F308-K312 WeakPolarHBondContact O-CB 3.27Å; F308-K312 PolarHBondContact O-N 2.77Å; Q309-K312 CarbonylContact O-C 3.42Å; Q309-K312 PolarHBondContact O-N 3Å; I310-K312 VanDerWaalsContact C-N 3.31Å; I310-K312 PolarHBondContact O-N 3.01Å; K312-F314 VanDerWaalsContact C-N 3.3Å; K312-F314 PolarHBondContact O-N 3.22Å; K312-H315 PolarHBondContact O-N 2.78Å
313	T	50.2	Low	51.8	Low	100 Å²	100	89 Å²	89	61%	0.613	42%	0.418	S	S	*	.	H	α-helix	trans	-64.1	-33.6	175.2	-49.4	0	0	0	0	112	Q309 I310	Q309-T313 WeakPolarHBondContact O-CB 3.3Å; Q309-T313 PolarHBondContact O-N 2.75Å; Q309-T313 PolarHBondContact O-OG1 3.24Å; I310-T313 PolarHBondContact O-N 3.41Å
314	F	47.9	Very low	51.4	Low	25 Å²	25	88.9 Å²	88.9	11%	0.11	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	1.8	-178.1	-86.4	-92.5	0	0	0	114.9	K260 L261 E264 I310 I311 K312 L316	K260-F314 HydrophobicContact CB-CE1 4.22Å; K260-F314 HydrophobicContact CD-CE1 4.12Å; K260-F314 HydrophobicContact CG-CE1 4.02Å; L261-F314 HydrophobicContact CB-CD1 3.98Å; L261-F314 HydrophobicContact CB-CE1 4.05Å; L261-F314 HydrophobicContact CB-CG 4.3Å; L261-F314 HydrophobicContact CB-CZ 4.43Å; L261-F314 HydrophobicContact CD1-CD1 4.44Å; L261-F314 HydrophobicContact CD1-CD2 3.66Å; L261-F314 HydrophobicContact CD1-CE2 3.73Å; L261-F314 HydrophobicContact CD1-CG 4.03Å; L261-F314 HydrophobicContact CD1-CZ 4.17Å; E264-F314 HydrophobicContact CG-CZ 4.19Å; I310-F314 HydrophobicContact CG2-CD2 4.13Å; I310-F314 HydrophobicContact CG2-CE2 4.38Å; I310-F314 WeakPolarHBondContact O-CD2 3.49Å; I310-F314 PolarHBondContact O-N 2.96Å; I311-F314 PolarHBondContact O-N 3.15Å; K312-F314 VanDerWaalsContact C-N 3.3Å; K312-F314 PolarHBondContact O-N 3.22Å; F314-L316 HydrophobicContact CB-CD1 3.72Å; F314-L316 HydrophobicContact CB-CG 4.29Å; F314-L316 HydrophobicContact CG-CD1 4.45Å; F314-L316 PolarHBondContact O-N 3.42Å
315	H	57	Low	51	Low	123 Å²	123	84.2 Å²	84.2	57%	0.569	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	18.1	-179.9	-71.9	-56.4	0	0	0	114.9	I311 K312 E317 N318 L319	I311-H315 PolarHBondContact O-N 2.81Å; K312-H315 PolarHBondContact O-N 2.78Å; H315-E317 PolarHBondContact O-N 2.96Å; H315-N318 PolarHBondContact O-N 3.35Å; H315-L319 WeakPolarHBondContact O-CG 3.44Å; H315-L319 PolarHBondContact O-N 3.46Å
316	L	51.9	Low	50.6	Low	21 Å²	21	76.4 Å²	76.4	11%	0.11	37%	0.373	C	S	.	.	H	α-helix	trans	-66.8	-37.5	-169.2	-96.3	151.3	0	0	0	112.6	Y254 K258 L261 F314 L319 Y320	Y254-L316 HydrophobicContact CD2-CD2 3.92Å; Y254-L316 HydrophobicContact CE2-CD2 3.54Å; K258-L316 HydrophobicContact CB-CD2 4.19Å; L261-L316 HydrophobicContact CB-CD1 4Å; L261-L316 HydrophobicContact CD2-CD1 3.3Å; L261-L316 HydrophobicContact CG-CD1 4.22Å; F314-L316 HydrophobicContact CB-CD1 3.72Å; F314-L316 HydrophobicContact CB-CG 4.29Å; F314-L316 HydrophobicContact CG-CD1 4.45Å; F314-L316 PolarHBondContact O-N 3.42Å; L316-L319 PolarHBondContact O-N 3.19Å; L316-Y320 VanDerWaalsContact O-CB 3.28Å; L316-Y320 WeakPolarHBondContact O-CB 3.16Å; L316-Y320 PolarHBondContact O-N 2.88Å
317	E	49.9	Very low	50.5	Low	128 Å²	128	74.7 Å²	74.7	60%	0.598	37%	0.365	S	S	*	.	H	α-helix	trans	-65.1	-42.7	175.2	-172.8	174.7	-168.6	0	0	111.4	H315 Y320 N321	H315-E317 PolarHBondContact O-N 2.96Å; E317-Y320 PolarHBondContact O-N 3.04Å; E317-N321 WeakPolarHBondContact O-CB 3.28Å; E317-N321 PolarHBondContact O-N 3.16Å; E317-N321 PolarHBondContact O-ND2 3.01Å
318	N	53.3	Low	50.7	Low	81 Å²	81	81.3 Å²	81.3	43%	0.433	39%	0.39	S	S	.	.	H	α-helix	trans	-64.2	-45.1	176.1	-170.9	18.5	0	0	0	111.3	H315 Y320 N321 Q322	H315-N318 PolarHBondContact O-N 3.35Å; N318-Y320 PolarHBondContact O-N 2.97Å; N318-N321 PolarHBondContact O-N 2.59Å; N318-Q322 WeakPolarHBondContact O-CB 3.48Å; N318-Q322 VanDerWaalsContact O-CG 3.25Å; N318-Q322 WeakPolarHBondContact O-CG 3.38Å; N318-Q322 PolarHBondContact O-N 3.41Å; N318-Q322 PolarHBondContact OD1-NE2 3.07Å; N318-Q322 VanDerWaalsContact OD1-NE2 3.15Å
319	L	49.6	Very low	50.4	Low	32 Å²	32	79.2 Å²	79.2	17%	0.168	38%	0.384	C	S	.	.	H	α-helix	trans	-63.6	-41.1	177.4	-71.3	172.2	0	0	0	112.2	T253 Y254 H257 H315 L316 Q322 M323	T253-L319 HydrophobicContact CG2-CD2 4.47Å; Y254-L319 HydrophobicContact CD2-CB 4.28Å; H257-L319 HydrophobicContact CB-CD1 4.28Å; H315-L319 WeakPolarHBondContact O-CG 3.44Å; H315-L319 PolarHBondContact O-N 3.46Å; L316-L319 PolarHBondContact O-N 3.19Å; L319-Q322 PolarHBondContact O-N 3.26Å; L319-M323 WeakPolarHBondContact O-CB 3.41Å; L319-M323 PolarHBondContact O-N 3.24Å
320	Y	46.7	Very low	50	Low	124 Å²	124	74.4 Å²	74.4	49%	0.486	37%	0.366	S	S	.	.	H	α-helix	trans	-64	-46	175.6	-178.9	-96.7	0	0	0	111.7	Y254 L316 E317 N318 Q322 M323 S324	Y254-Y320 HydrophobicContact CE2-CD2 4.37Å; L316-Y320 VanDerWaalsContact O-CB 3.28Å; L316-Y320 WeakPolarHBondContact O-CB 3.16Å; L316-Y320 PolarHBondContact O-N 2.88Å; E317-Y320 PolarHBondContact O-N 3.04Å; N318-Y320 PolarHBondContact O-N 2.97Å; Y320-Q322 PolarHBondContact O-N 3Å; Y320-M323 HydrophobicContact CD2-CE 3.87Å; Y320-M323 HydrophobicContact CE2-CE 4.13Å; Y320-M323 WeakPolarHBondContact O-CB 3.49Å; Y320-M323 PolarHBondContact O-N 2.85Å; Y320-S324 PolarHBondContact O-N 2.87Å
321	N	50	Low	50.3	Low	77 Å²	77	77.6 Å²	77.6	41%	0.412	38%	0.38	S	S	.	.	H	α-helix	trans	-60.9	-45.7	176.8	-71.8	-17.9	0	0	0	111	E317 N318 M323 S324 V325	E317-N321 WeakPolarHBondContact O-CB 3.28Å; E317-N321 PolarHBondContact O-N 3.16Å; E317-N321 PolarHBondContact O-ND2 3.01Å; N318-N321 PolarHBondContact O-N 2.59Å; N321-M323 VanDerWaalsContact C-N 3.32Å; N321-M323 PolarHBondContact O-N 2.95Å; N321-S324 PolarHBondContact O-N 3.38Å; N321-S324 PolarHBondContact O-OG 2.95Å; N321-V325 WeakPolarHBondContact O-CG2 3.41Å; N321-V325 PolarHBondContact O-N 3.43Å
322	Q	49.7	Very low	50.6	Low	75 Å²	75	79.3 Å²	79.3	35%	0.35	39%	0.392	S	S	.	.	H	α-helix	trans	-60.7	-38.8	175.7	-73.2	178.4	20	0	0	113.1	N318 L319 Y320 S326	N318-Q322 WeakPolarHBondContact O-CB 3.48Å; N318-Q322 VanDerWaalsContact O-CG 3.25Å; N318-Q322 WeakPolarHBondContact O-CG 3.38Å; N318-Q322 PolarHBondContact O-N 3.41Å; N318-Q322 PolarHBondContact OD1-NE2 3.07Å; N318-Q322 VanDerWaalsContact OD1-NE2 3.15Å; L319-Q322 PolarHBondContact O-N 3.26Å; Y320-Q322 PolarHBondContact O-N 3Å; Q322-S326 WeakPolarHBondContact O-CB 3.47Å; Q322-S326 PolarHBondContact O-N 3.23Å; Q322-S326 PolarHBondContact O-OG 3.39Å
323	M	51.7	Low	50.4	Low	21 Å²	21	71.5 Å²	71.5	10%	0.103	36%	0.359	C	S	.	.	H	α-helix	trans	-65.6	-46.7	175.8	-176.7	178.4	71.6	0	0	111.1	L247 M251 L319 Y320 N321 V325 S326 Q327	L247-M323 HydrophobicContact CD1-CG 4.16Å; M251-M323 HydrophobicContact SD-CE 4.44Å; M251-M323 HydrophobicContact SD-SD 3.38Å; L319-M323 WeakPolarHBondContact O-CB 3.41Å; L319-M323 PolarHBondContact O-N 3.24Å; Y320-M323 HydrophobicContact CD2-CE 3.87Å; Y320-M323 HydrophobicContact CE2-CE 4.13Å; Y320-M323 WeakPolarHBondContact O-CB 3.49Å; Y320-M323 PolarHBondContact O-N 2.85Å; N321-M323 VanDerWaalsContact C-N 3.32Å; N321-M323 PolarHBondContact O-N 2.95Å; M323-V325 VanDerWaalsContact C-N 3.34Å; M323-V325 PolarHBondContact O-N 3.44Å; M323-S326 PolarHBondContact O-N 3.48Å; M323-Q327 WeakPolarHBondContact O-CB 3.38Å; M323-Q327 PolarHBondContact O-N 2.9Å
324	S	48.2	Very low	50.8	Low	31 Å²	31	69.9 Å²	69.9	22%	0.217	34%	0.344	C	S	.	.	H	α-helix	trans	-61.2	-40.3	179.2	76	0	0	0	0	112.7	Y320 N321 Q327 R328	Y320-S324 PolarHBondContact O-N 2.87Å; N321-S324 PolarHBondContact O-N 3.38Å; N321-S324 PolarHBondContact O-OG 2.95Å; S324-Q327 PolarHBondContact O-N 3.41Å; S324-R328 WeakPolarHBondContact O-CG 3.34Å; S324-R328 PolarHBondContact O-N 3.29Å
325	V	47.2	Very low	51.7	Low	94 Å²	94	76.1 Å²	76.1	57%	0.57	37%	0.37	S	S	*	.	H	α-helix	trans	-65.1	-45	174.7	172.2	0	0	0	0	110.6	N321 M323 Q327 R328 L329	N321-V325 WeakPolarHBondContact O-CG2 3.41Å; N321-V325 PolarHBondContact O-N 3.43Å; M323-V325 VanDerWaalsContact C-N 3.34Å; M323-V325 PolarHBondContact O-N 3.44Å; V325-Q327 VanDerWaalsContact C-N 3.31Å; V325-Q327 PolarHBondContact O-N 3.39Å; V325-R328 PolarHBondContact O-N 3.33Å; V325-L329 WeakPolarHBondContact O-CB 3.28Å; V325-L329 PolarHBondContact O-N 3.41Å
326	S	43.9	Very low	51.7	Low	19 Å²	19	73.4 Å²	73.4	13%	0.133	36%	0.358	C	S	.	.	H	α-helix	trans	-63.4	-38.3	178.7	-53.1	0	0	0	0	111.6	K250 Q322 M323 L329 A330	K250-S326 PolarHBondContact NZ-OG 3.41Å; Q322-S326 WeakPolarHBondContact O-CB 3.47Å; Q322-S326 PolarHBondContact O-N 3.23Å; Q322-S326 PolarHBondContact O-OG 3.39Å; M323-S326 PolarHBondContact O-N 3.48Å; S326-L329 PolarHBondContact O-N 2.89Å; S326-A330 WeakPolarHBondContact O-CB 3.29Å; S326-A330 PolarHBondContact O-N 3.29Å
327	Q	52.2	Low	52.3	Low	86 Å²	86	74.1 Å²	74.1	40%	0.402	36%	0.359	S	S	.	.	H	α-helix	trans	-66.3	-45.3	176	-175.5	179.7	2.1	0	0	112	M323 S324 V325 L329 A330 Q331	M323-Q327 WeakPolarHBondContact O-CB 3.38Å; M323-Q327 PolarHBondContact O-N 2.9Å; S324-Q327 PolarHBondContact O-N 3.41Å; V325-Q327 VanDerWaalsContact C-N 3.31Å; V325-Q327 PolarHBondContact O-N 3.39Å; Q327-L329 VanDerWaalsContact C-N 3.33Å; Q327-L329 PolarHBondContact O-N 2.92Å; Q327-A330 PolarHBondContact O-N 3.27Å; Q327-Q331 WeakPolarHBondContact O-CG 3.22Å; Q327-Q331 PolarHBondContact O-N 2.97Å
328	R	53.7	Low	53.2	Low	181 Å²	181	73.3 Å²	73.3	68%	0.683	35%	0.354	S	S	*	.	H	α-helix	trans	-59.8	-44	175.6	-75.6	-178.5	-174	-179.6	2.8	111.5	S324 V325 A330 Q331 T332	S324-R328 WeakPolarHBondContact O-CG 3.34Å; S324-R328 PolarHBondContact O-N 3.29Å; V325-R328 PolarHBondContact O-N 3.33Å; R328-A330 PolarHBondContact O-N 2.98Å; R328-Q331 PolarHBondContact O-N 3.46Å; R328-T332 PolarHBondContact O-N 2.84Å; R328-T332 PolarHBondContact O-OG1 3.02Å
329	L	47.6	Very low	53.9	Low	70 Å²	70	73.6 Å²	73.6	37%	0.366	35%	0.351	S	S	.	.	H	α-helix	trans	-62.9	-40.6	178.1	-170.9	71	0	0	0	112.5	M243 V325 S326 Q327 T332 T333 F381	M243-L329 HydrophobicContact SD-CD2 3.89Å; M243-L329 HydrophobicContact SD-CG 3.93Å; V325-L329 WeakPolarHBondContact O-CB 3.28Å; V325-L329 PolarHBondContact O-N 3.41Å; S326-L329 PolarHBondContact O-N 2.89Å; Q327-L329 VanDerWaalsContact C-N 3.33Å; Q327-L329 PolarHBondContact O-N 2.92Å; L329-T332 WeakPolarHBondContact CA-OG1 2.86Å; L329-T332 PolarHBondContact O-OG1 3.25Å; L329-T333 WeakPolarHBondContact O-CB 3.26Å; L329-T333 PolarHBondContact O-N 3.14Å; L329-T333 PolarHBondContact O-OG1 3.05Å; L329-F381 HydrophobicContact CD2-CZ 4.18Å
330	A	47	Very low	54.4	Low	27 Å²	27	72.5 Å²	72.5	22%	0.223	35%	0.346	C	S	.	.	H	α-helix	trans	-64	-43.2	175.1	0	0	0	0	0	111.5	S326 Q327 R328 T333 F334	S326-A330 WeakPolarHBondContact O-CB 3.29Å; S326-A330 PolarHBondContact O-N 3.29Å; Q327-A330 PolarHBondContact O-N 3.27Å; R328-A330 PolarHBondContact O-N 2.98Å; A330-T333 PolarHBondContact O-N 3.06Å; A330-F334 WeakPolarHBondContact O-CB 3.36Å; A330-F334 PolarHBondContact O-N 3.33Å
331	Q	57.6	Low	55.4	Low	105 Å²	105	72.8 Å²	72.8	49%	0.491	35%	0.346	S	S	.	.	H	α-helix	trans	-63.6	-43.5	177.7	-73.5	175.2	-10.8	0	0	112.6	Q327 R328 F334 K335	Q327-Q331 WeakPolarHBondContact O-CG 3.22Å; Q327-Q331 PolarHBondContact O-N 2.97Å; R328-Q331 PolarHBondContact O-N 3.46Å; Q331-F334 PolarHBondContact O-N 3.25Å; Q331-K335 WeakPolarHBondContact O-CG 3.1Å; Q331-K335 PolarHBondContact O-N 2.89Å; Q331-K335 VanDerWaalsContact O-N 3.07Å
332	T	57	Low	56.2	Low	74 Å²	74	73.9 Å²	73.9	45%	0.454	35%	0.349	S	S	.	.	H	α-helix	trans	-65.1	-40.7	176.8	50.1	0	0	0	0	111.4	R328 L329 K335 Q336	R328-T332 PolarHBondContact O-N 2.84Å; R328-T332 PolarHBondContact O-OG1 3.02Å; L329-T332 WeakPolarHBondContact CA-OG1 2.86Å; L329-T332 PolarHBondContact O-OG1 3.25Å; T332-K335 PolarHBondContact O-N 3.49Å; T332-Q336 WeakPolarHBondContact O-CG 3.44Å; T332-Q336 PolarHBondContact O-N 2.89Å; T332-Q336 VanDerWaalsContact O-N 3.12Å
333	T	45.8	Very low	56.7	Low	7 Å²	7	71.7 Å²	71.7	4%	0.043	34%	0.338	C	S	.	.	H	α-helix	trans	-67.6	-40.5	178.4	-48.9	0	0	0	0	111.7	L236 M240 M243 L329 A330 K335 Q336 W337	L236-T333 HydrophobicContact CD2-CG2 3.85Å; M240-T333 HydrophobicContact CG-CG2 4.03Å; M243-T333 HydrophobicContact CE-CG2 3.66Å; M243-T333 WeakPolarHBondContact CE-OG1 3.45Å; L329-T333 WeakPolarHBondContact O-CB 3.26Å; L329-T333 PolarHBondContact O-N 3.14Å; L329-T333 PolarHBondContact O-OG1 3.05Å; A330-T333 PolarHBondContact O-N 3.06Å; T333-K335 PolarHBondContact O-N 3.32Å; T333-Q336 WeakPolarHBondContact O-CB 3.4Å; T333-Q336 PolarHBondContact O-N 3.22Å; T333-W337 PolarHBondContact O-N 3.3Å
334	F	58.9	Low	57.2	Low	67 Å²	67	73.2 Å²	73.2	29%	0.294	34%	0.344	S	S	.	.	H	α-helix	trans	-60.5	-43.3	175	-179.1	-100.3	0	0	0	112.2	H160 M240 A330 Q331 Q336 W337 K338	H160-F334 AromaticContact NE2-CE2 3.89Å; H160-F334 AromaticContact NE2-CZ 3.25Å; H160-F334 WeakPolarHBondContact NE2-CZ 3.36Å; M240-F334 HydrophobicContact CE-CD2 3.67Å; M240-F334 HydrophobicContact CE-CE2 4.38Å; A330-F334 WeakPolarHBondContact O-CB 3.36Å; A330-F334 PolarHBondContact O-N 3.33Å; Q331-F334 PolarHBondContact O-N 3.25Å; F334-Q336 VanDerWaalsContact C-N 3.31Å; F334-Q336 PolarHBondContact O-N 3.11Å; F334-W337 HydrophobicContact CD2-CE3 4.25Å; F334-W337 AromaticContact CE2-CE3 3.98Å; F334-W337 HydrophobicContact CE2-CE3 3.98Å; F334-W337 AromaticContact CE2-CZ3 3.83Å; F334-W337 HydrophobicContact CE2-CZ3 3.83Å; F334-W337 HydrophobicContact CZ-CZ3 4.38Å; F334-W337 PolarHBondContact O-N 3.28Å; F334-K338 WeakPolarHBondContact O-CB 3.43Å; F334-K338 PolarHBondContact O-N 3.49Å
335	K	67.4	Low	58.1	Low	155 Å²	155	76.9 Å²	76.9	67%	0.674	36%	0.358	S	S	*	.	H	α-helix	trans	-59.6	-41.1	174.6	-75.1	-179.7	179.6	-175.3	0	112.1	Q331 T332 T333 K339	Q331-K335 WeakPolarHBondContact O-CG 3.1Å; Q331-K335 PolarHBondContact O-N 2.89Å; Q331-K335 VanDerWaalsContact O-N 3.07Å; T332-K335 PolarHBondContact O-N 3.49Å; T333-K335 PolarHBondContact O-N 3.32Å; K335-K339 PolarHBondContact O-N 2.91Å; K335-K339 VanDerWaalsContact O-N 3.15Å
336	Q	57.2	Low	58.8	Low	66 Å²	66	75.4 Å²	75.4	31%	0.308	35%	0.349	S	S	.	.	H	α-helix	trans	-66.1	-45.1	176.7	-71.9	177.2	-8.5	0	0	112.2	T332 T333 F334 K338 K339 L340 L378	T332-Q336 WeakPolarHBondContact O-CG 3.44Å; T332-Q336 PolarHBondContact O-N 2.89Å; T332-Q336 VanDerWaalsContact O-N 3.12Å; T333-Q336 WeakPolarHBondContact O-CB 3.4Å; T333-Q336 PolarHBondContact O-N 3.22Å; F334-Q336 VanDerWaalsContact C-N 3.31Å; F334-Q336 PolarHBondContact O-N 3.11Å; Q336-K338 VanDerWaalsContact C-N 3.35Å; Q336-K338 PolarHBondContact O-N 2.99Å; Q336-K339 PolarHBondContact O-N 3.43Å; Q336-L340 PolarHBondContact O-N 2.93Å; Q336-L378 HydrophobicContact CG-CD1 4.47Å
337	W	63.4	Low	59.2	Low	36 Å²	36	77.3 Å²	77.3	14%	0.136	36%	0.357	C	S	.	.	H	α-helix	trans	-60.4	-43.4	176.6	173.6	88.8	0	0	0	112	E237 M240 T333 F334 K339 L340 R341	E237-W337 VanDerWaalsContact CG-NE1 3.27Å; E237-W337 PolarHBondContact OE1-NE1 2.93Å; E237-W337 VanDerWaalsContact OE1-NE1 3.17Å; M240-W337 HydrophobicContact CE-CD2 4.45Å; M240-W337 HydrophobicContact SD-CB 3.71Å; M240-W337 HydrophobicContact SD-CD2 4.19Å; M240-W337 HydrophobicContact SD-CG 3.74Å; T333-W337 PolarHBondContact O-N 3.3Å; F334-W337 HydrophobicContact CD2-CE3 4.25Å; F334-W337 AromaticContact CE2-CE3 3.98Å; F334-W337 HydrophobicContact CE2-CE3 3.98Å; F334-W337 AromaticContact CE2-CZ3 3.83Å; F334-W337 HydrophobicContact CE2-CZ3 3.83Å; F334-W337 HydrophobicContact CZ-CZ3 4.38Å; F334-W337 PolarHBondContact O-N 3.28Å; W337-K339 PolarHBondContact O-N 3.14Å; W337-L340 PolarHBondContact O-N 3.43Å; W337-R341 PolarHBondContact O-N 2.97Å
338	K	68.7	Low	59.4	Low	112 Å²	112	76.9 Å²	76.9	49%	0.487	36%	0.355	S	S	.	.	H	α-helix	trans	-59.5	-46.8	176.9	-172.6	177.4	179.2	179.9	0	111.4	F334 Q336 L340 R341 E342	F334-K338 WeakPolarHBondContact O-CB 3.43Å; F334-K338 PolarHBondContact O-N 3.49Å; Q336-K338 VanDerWaalsContact C-N 3.35Å; Q336-K338 PolarHBondContact O-N 2.99Å; K338-L340 PolarHBondContact O-N 2.98Å; K338-R341 PolarHBondContact O-N 3Å; K338-E342 VanDerWaalsContact CE-OE1 3.26Å; K338-E342 WeakPolarHBondContact CE-OE1 3.49Å; K338-E342 WeakPolarHBondContact O-CG 3.49Å; K338-E342 PolarHBondContact O-N 3Å
339	K	68.6	Low	59.6	Low	87 Å²	87	73.2 Å²	73.2	38%	0.378	35%	0.348	S	S	.	.	H	α-helix	trans	-62.1	-42.2	178.1	-172.6	174	179.1	-179.7	0	112.5	K335 Q336 W337 R341 E342 E343 T374	K335-K339 PolarHBondContact O-N 2.91Å; K335-K339 VanDerWaalsContact O-N 3.15Å; Q336-K339 PolarHBondContact O-N 3.43Å; W337-K339 PolarHBondContact O-N 3.14Å; K339-R341 VanDerWaalsContact C-N 3.32Å; K339-R341 PolarHBondContact O-N 3.4Å; K339-E342 PolarHBondContact O-N 2.83Å; K339-E343 VanDerWaalsContact CE-OE1 3.3Å; K339-E343 WeakPolarHBondContact CE-OE1 3.06Å; K339-E343 WeakPolarHBondContact O-CG 3.09Å; K339-E343 PolarHBondContact O-N 2.79Å; K339-T374 HydrophobicContact CD-CG2 3.82Å; K339-T374 WeakPolarHBondContact CE-OG1 3.49Å; K339-T374 PolarHBondContact NZ-OG1 3.36Å
340	L	60.1	Low	59.7	Low	9 Å²	9	71.9 Å²	71.9	5%	0.047	34%	0.34	C	S	.	.	H	α-helix	trans	-65.8	-34.6	177	-76.9	166.1	0	0	0	112.7	L236 Q336 W337 K338 E343 K344 L375	L236-L340 HydrophobicContact CD1-CD1 3.26Å; Q336-L340 PolarHBondContact O-N 2.93Å; W337-L340 PolarHBondContact O-N 3.43Å; K338-L340 PolarHBondContact O-N 2.98Å; L340-E343 PolarHBondContact O-N 3.42Å; L340-K344 WeakPolarHBondContact O-CB 3.36Å; L340-K344 PolarHBondContact O-N 3.04Å; L340-L375 HydrophobicContact CD2-CD2 4.33Å
341	R	66.9	Low	59.8	Low	129 Å²	129	71.8 Å²	71.8	49%	0.487	34%	0.338	S	S	.	.	H	α-helix	trans	-68.7	-38.6	175.5	-173.1	176.1	-82.4	-155.1	-9.5	111.9	E237 W337 K338 K339 K344 H345	E237-R341 IonicContact OE1-NH2 3.2Å; E237-R341 PolarHBondContact OE1-NH2 2.87Å; E237-R341 VanDerWaalsContact OE1-NH2 3.17Å; W337-R341 PolarHBondContact O-N 2.97Å; K338-R341 PolarHBondContact O-N 3Å; K339-R341 VanDerWaalsContact C-N 3.32Å; K339-R341 PolarHBondContact O-N 3.4Å; R341-K344 PolarHBondContact O-N 3.26Å; R341-H345 PolarHBondContact O-N 2.95Å
342	E	67.8	Low	59.4	Low	101 Å²	101	70.4 Å²	70.4	47%	0.472	33%	0.332	S	S	.	.	H	α-helix	trans	-64.5	-41.8	172.2	-70.5	166.7	-174.8	0	0	111.5	K338 K339 H345 T346	K338-E342 VanDerWaalsContact CE-OE1 3.26Å; K338-E342 WeakPolarHBondContact CE-OE1 3.49Å; K338-E342 WeakPolarHBondContact O-CG 3.49Å; K338-E342 PolarHBondContact O-N 3Å; K339-E342 PolarHBondContact O-N 2.83Å; E342-H345 PolarHBondContact O-N 2.99Å; E342-T346 PolarHBondContact O-N 3.07Å; E342-T346 PolarHBondContact O-OG1 3.03Å
343	E	59	Low	58.8	Low	29 Å²	29	73 Å²	73	14%	0.136	33%	0.334	C	S	.	.	H	α-helix	trans	-62.7	-44.3	174.4	-74.1	174.4	-170.3	0	0	111.4	K339 L340 H345 T346 I347 P372 T374	K339-E343 VanDerWaalsContact CE-OE1 3.3Å; K339-E343 WeakPolarHBondContact CE-OE1 3.06Å; K339-E343 WeakPolarHBondContact O-CG 3.09Å; K339-E343 PolarHBondContact O-N 2.79Å; L340-E343 PolarHBondContact O-N 3.42Å; E343-H345 PolarHBondContact O-N 3.38Å; E343-T346 WeakPolarHBondContact O-CB 3.48Å; E343-T346 PolarHBondContact O-N 2.98Å; E343-I347 WeakPolarHBondContact O-CG1 3.38Å; E343-I347 PolarHBondContact O-N 3.34Å; E343-P372 HydrophobicContact CG-CG 4.21Å; E343-P372 VanDerWaalsContact OE1-CG 3.29Å; E343-P372 WeakPolarHBondContact OE1-CG 2.97Å; E343-P372 WeakPolarHBondContact OE2-CG 3.34Å; E343-T374 PolarHBondContact OE1-OG1 3.32Å; E343-T374 VanDerWaalsContact OE1-OG1 3.14Å
344	K	63.7	Low	58.6	Low	53 Å²	53	76.4 Å²	76.4	23%	0.23	35%	0.351	C	S	.	.	H	α-helix	trans	-56	-50	173.6	177.4	175.9	169.9	167.7	0	111.3	V229 D230 L340 R341 T346 I347 E348	V229-K344 HydrophobicContact CG1-CB 3.93Å; V229-K344 HydrophobicContact CG1-CG 4.36Å; D230-K344 WeakPolarHBondContact OD1-CE 3.44Å; D230-K344 IonicContact OD1-NZ 3.3Å; D230-K344 PolarHBondContact OD1-NZ 2.95Å; L340-K344 WeakPolarHBondContact O-CB 3.36Å; L340-K344 PolarHBondContact O-N 3.04Å; R341-K344 PolarHBondContact O-N 3.26Å; K344-T346 VanDerWaalsContact C-N 3.27Å; K344-T346 PolarHBondContact O-N 3.16Å; K344-I347 PolarHBondContact O-N 3.22Å; K344-I347 VanDerWaalsContact O-N 3.16Å; K344-E348 WeakPolarHBondContact CE-OE1 3.41Å; K344-E348 IonicContact NZ-OE1 2.59Å; K344-E348 WeakPolarHBondContact O-CG 3.38Å; K344-E348 PolarHBondContact O-N 3.46Å
345	H	66.5	Low	58	Low	107 Å²	107	80.7 Å²	80.7	50%	0.495	37%	0.365	S	S	.	.	H	α-helix	trans	-60.7	-37.9	179.6	-172.7	56.3	0	0	0	112.3	R341 E342 E343 E348 L349	R341-H345 PolarHBondContact O-N 2.95Å; E342-H345 PolarHBondContact O-N 2.99Å; E343-H345 PolarHBondContact O-N 3.38Å; H345-E348 PolarHBondContact O-N 2.77Å; H345-L349 WeakPolarHBondContact O-CG 3.27Å; H345-L349 PolarHBondContact O-N 2.88Å
346	T	61.5	Low	56.7	Low	64 Å²	64	79.8 Å²	79.8	39%	0.393	37%	0.367	S	S	.	.	H	α-helix	trans	-64.2	-41.7	176.4	-54.2	0	0	0	0	111.7	E342 E343 K344 H350 Y369	E342-T346 PolarHBondContact O-N 3.07Å; E342-T346 PolarHBondContact O-OG1 3.03Å; E343-T346 WeakPolarHBondContact O-CB 3.48Å; E343-T346 PolarHBondContact O-N 2.98Å; K344-T346 VanDerWaalsContact C-N 3.27Å; K344-T346 PolarHBondContact O-N 3.16Å; T346-H350 WeakPolarHBondContact O-CB 3.4Å; T346-H350 PolarHBondContact O-N 2.68Å; T346-Y369 HydrophobicContact CG2-CE1 4.29Å
347	I	53.1	Low	56.1	Low	59 Å²	59	81.3 Å²	81.3	30%	0.303	37%	0.373	S	S	.	.	H	α-helix	trans	-65.5	-42	177	-67	165.9	0	0	0	110.9	Y222 L226 E343 K344 H350 S351	Y222-I347 HydrophobicContact CD2-CG2 4.47Å; Y222-I347 HydrophobicContact CE2-CG2 3.83Å; L226-I347 HydrophobicContact CD2-CG2 4.45Å; L226-I347 HydrophobicContact CG-CG2 4.27Å; E343-I347 WeakPolarHBondContact O-CG1 3.38Å; E343-I347 PolarHBondContact O-N 3.34Å; K344-I347 PolarHBondContact O-N 3.22Å; K344-I347 VanDerWaalsContact O-N 3.16Å; I347-H350 PolarHBondContact O-N 3.26Å; I347-S351 PolarHBondContact O-N 3.19Å
348	E	55.6	Low	55.1	Low	76 Å²	76	88.1 Å²	88.1	36%	0.355	40%	0.403	S	S	.	.	H	α-helix	trans	-64	-44.1	176.9	-71.5	172.8	167.3	0	0	112.3	L226 K344 H345 H350 S351 E352	L226-E348 HydrophobicContact CD2-CG 4.47Å; K344-E348 WeakPolarHBondContact CE-OE1 3.41Å; K344-E348 IonicContact NZ-OE1 2.59Å; K344-E348 WeakPolarHBondContact O-CG 3.38Å; K344-E348 PolarHBondContact O-N 3.46Å; H345-E348 PolarHBondContact O-N 2.77Å; E348-H350 VanDerWaalsContact C-N 3.29Å; E348-H350 PolarHBondContact O-N 3.25Å; E348-S351 PolarHBondContact O-N 2.89Å; E348-S351 PolarHBondContact O-OG 3.09Å; E348-E352 PolarHBondContact O-N 2.89Å; E348-E352 VanDerWaalsContact O-N 3.16Å
349	L	57.2	Low	53.5	Low	104 Å²	104	90.2 Å²	90.2	55%	0.545	42%	0.42	S	S	.	.	H	α-helix	trans	-61.9	-39.6	174.5	-77.2	171	0	0	0	111.7	H345 Y353	H345-L349 WeakPolarHBondContact O-CG 3.27Å; H345-L349 PolarHBondContact O-N 2.88Å; L349-Y353 WeakPolarHBondContact O-CB 3.35Å; L349-Y353 PolarHBondContact O-N 3.2Å
350	H	51	Low	51.8	Low	42 Å²	42	91.7 Å²	91.7	19%	0.194	43%	0.432	C	S	.	.	H	α-helix	trans	-68.7	-36	-179.5	-166.2	62.7	0	0	0	112.4	T346 I347 E348 Y353 I354 Y369	T346-H350 WeakPolarHBondContact O-CB 3.4Å; T346-H350 PolarHBondContact O-N 2.68Å; I347-H350 PolarHBondContact O-N 3.26Å; E348-H350 VanDerWaalsContact C-N 3.29Å; E348-H350 PolarHBondContact O-N 3.25Å; H350-Y353 WeakPolarHBondContact O-CB 3.35Å; H350-Y353 PolarHBondContact O-N 3.24Å; H350-I354 WeakPolarHBondContact O-CG1 2.94Å; H350-I354 PolarHBondContact O-N 2.98Å; H350-Y369 AromaticContact CD2-CE2 3.74Å; H350-Y369 AromaticContact CE1-CE2 3.86Å; H350-Y369 AromaticContact CG-CE2 3.86Å; H350-Y369 AromaticContact ND1-CE2 3.93Å; H350-Y369 AromaticContact NE2-CE2 3.73Å
351	S	48.8	Very low	50.8	Low	25 Å²	25	101.1 Å²	101.1	18%	0.175	47%	0.472	C	S	.	.	H	α-helix	trans	-70.8	-39.5	177.2	70.5	0	0	0	0	112.8	Y222 I347 E348 Y353 I354 R355	Y222-S351 VanDerWaalsContact CE2-CB 3.45Å; Y222-S351 WeakPolarHBondContact OH-CB 3.49Å; Y222-S351 PolarHBondContact OH-OG 3.42Å; I347-S351 PolarHBondContact O-N 3.19Å; E348-S351 PolarHBondContact O-N 2.89Å; E348-S351 PolarHBondContact O-OG 3.09Å; S351-Y353 VanDerWaalsContact C-N 3.3Å; S351-Y353 PolarHBondContact O-N 3.27Å; S351-I354 PolarHBondContact O-N 3.09Å; S351-R355 WeakPolarHBondContact O-CB 3.46Å; S351-R355 PolarHBondContact O-N 3.34Å
352	E	49.2	Very low	49.2	Very low	77 Å²	77	99.9 Å²	99.9	36%	0.36	47%	0.474	S	S	.	.	H	α-helix	trans	-61.3	-40.7	171.2	-78.2	-62.7	149.9	0	0	110.9	E348 I354 R355 L356	E348-E352 PolarHBondContact O-N 2.89Å; E348-E352 VanDerWaalsContact O-N 3.16Å; E352-I354 PolarHBondContact O-N 3.09Å; E352-R355 VanDerWaalsContact CD-NH2 3.27Å; E352-R355 PolarHBondContact O-N 3.16Å; E352-R355 IonicContact OE1-CZ 3.42Å; E352-R355 IonicContact OE1-NE 3.67Å; E352-R355 PolarHBondContact OE1-NE 3.01Å; E352-R355 IonicContact OE1-NH1 3.07Å; E352-R355 IonicContact OE1-NH2 3.67Å; E352-R355 PolarHBondContact OE1-NH2 3.07Å; E352-R355 IonicContact OE2-CZ 3.16Å; E352-R355 VanDerWaalsContact OE2-CZ 3.23Å; E352-R355 IonicContact OE2-NE 3.77Å; E352-R355 PolarHBondContact OE2-NE 3.46Å; E352-R355 VanDerWaalsContact OE2-NE 3.11Å; E352-R355 IonicContact OE2-NH2 3.01Å; E352-R355 PolarHBondContact OE2-NH2 3.49Å; E352-L356 WeakPolarHBondContact O-CB 3.34Å; E352-L356 WeakPolarHBondContact O-CD1 3.45Å; E352-L356 WeakPolarHBondContact O-CG 3.33Å; E352-L356 PolarHBondContact O-N 2.82Å
353	Y	43.5	Very low	47.4	Very low	129 Å²	129	101.2 Å²	101.2	51%	0.506	48%	0.48	S	S	.	.	H	α-helix	trans	-60.8	-43.8	175	-174.1	-93.9	0	0	0	113	L349 H350 S351 L356 K357	L349-Y353 WeakPolarHBondContact O-CB 3.35Å; L349-Y353 PolarHBondContact O-N 3.2Å; H350-Y353 WeakPolarHBondContact O-CB 3.35Å; H350-Y353 PolarHBondContact O-N 3.24Å; S351-Y353 VanDerWaalsContact C-N 3.3Å; S351-Y353 PolarHBondContact O-N 3.27Å; Y353-L356 PolarHBondContact O-N 2.64Å; Y353-K357 HydrophobicContact CE1-CD 3.83Å; Y353-K357 PolarHBondContact O-N 3.01Å; Y353-K357 VanDerWaalsContact OH-CE 3.31Å; Y353-K357 WeakPolarHBondContact OH-CE 3.21Å; Y353-K357 PolarHBondContact OH-NZ 2.87Å
354	I	43.2	Very low	46.2	Very low	78 Å²	78	106.5 Å²	106.5	40%	0.4	51%	0.505	S	S	.	.	H	α-helix	trans	-65.6	-43.3	175.8	-68.3	170.7	0	0	0	110.5	H350 S351 E352 L356 K357 L366	H350-I354 WeakPolarHBondContact O-CG1 2.94Å; H350-I354 PolarHBondContact O-N 2.98Å; S351-I354 PolarHBondContact O-N 3.09Å; E352-I354 PolarHBondContact O-N 3.09Å; I354-L356 VanDerWaalsContact C-N 3.26Å; I354-L356 PolarHBondContact O-N 2.97Å; I354-K357 PolarHBondContact O-N 2.69Å; I354-L366 HydrophobicContact CD1-CD1 3.63Å; I354-L366 HydrophobicContact CD1-CD2 4.38Å; I354-L366 HydrophobicContact CD1-CG 3.9Å
355	R	45.3	Very low	44.8	Very low	156 Å²	156	107.1 Å²	107.1	59%	0.589	51%	0.511	S	S	*	.	H	α-helix	trans	-61.9	-32.9	178.8	-167.9	178.1	75.6	151.9	1.5	112.6	S351 E352 K358	S351-R355 WeakPolarHBondContact O-CB 3.46Å; S351-R355 PolarHBondContact O-N 3.34Å; E352-R355 VanDerWaalsContact CD-NH2 3.27Å; E352-R355 PolarHBondContact O-N 3.16Å; E352-R355 IonicContact OE1-CZ 3.42Å; E352-R355 IonicContact OE1-NE 3.67Å; E352-R355 PolarHBondContact OE1-NE 3.01Å; E352-R355 IonicContact OE1-NH1 3.07Å; E352-R355 IonicContact OE1-NH2 3.67Å; E352-R355 PolarHBondContact OE1-NH2 3.07Å; E352-R355 IonicContact OE2-CZ 3.16Å; E352-R355 VanDerWaalsContact OE2-CZ 3.23Å; E352-R355 IonicContact OE2-NE 3.77Å; E352-R355 PolarHBondContact OE2-NE 3.46Å; E352-R355 VanDerWaalsContact OE2-NE 3.11Å; E352-R355 IonicContact OE2-NH2 3.01Å; E352-R355 PolarHBondContact OE2-NH2 3.49Å; R355-K358 WeakPolarHBondContact O-CG 3.36Å
356	L	41.2	Very low	43.3	Very low	136 Å²	136	106 Å²	106	71%	0.712	51%	0.508	S	S	*	.	H	α-helix	trans	-79.5	-25.8	179.5	-71.6	166.1	0	0	0	113.4	E352 Y353 I354 K358	E352-L356 WeakPolarHBondContact O-CB 3.34Å; E352-L356 WeakPolarHBondContact O-CD1 3.45Å; E352-L356 WeakPolarHBondContact O-CG 3.33Å; E352-L356 PolarHBondContact O-N 2.82Å; Y353-L356 PolarHBondContact O-N 2.64Å; I354-L356 VanDerWaalsContact C-N 3.26Å; I354-L356 PolarHBondContact O-N 2.97Å; L356-K358 VanDerWaalsContact C-N 3.34Å; L356-K358 PolarHBondContact O-N 3.27Å
357	K	44	Very low	42.1	Very low	99 Å²	99	109.6 Å²	109.6	43%	0.43	51%	0.514	S	S	.	.			trans	-91.4	34.2	-176.8	-92.1	-167.2	171.2	-175	0	115.3	Y353 I354 N359 N360	Y353-K357 HydrophobicContact CE1-CD 3.83Å; Y353-K357 PolarHBondContact O-N 3.01Å; Y353-K357 VanDerWaalsContact OH-CE 3.31Å; Y353-K357 WeakPolarHBondContact OH-CE 3.21Å; Y353-K357 PolarHBondContact OH-NZ 2.87Å; I354-K357 PolarHBondContact O-N 2.69Å; K357-N359 PolarHBondContact O-N 2.96Å; K357-N360 PolarHBondContact O-N 2.83Å
358	K	42.2	Very low	41.3	Very low	179 Å²	179	111.2 Å²	111.2	78%	0.778	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.4	-8.8	-173.5	-91.7	178.6	178	-174.9	0	120.3	R355 L356	R355-K358 WeakPolarHBondContact O-CG 3.36Å; L356-K358 VanDerWaalsContact C-N 3.34Å; L356-K358 PolarHBondContact O-N 3.27Å
359	N	35.6	Very low	40.5	Very low	155 Å²	155	113.7 Å²	113.7	83%	0.829	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.8	11.6	-169.5	-86.6	-0.1	0	0	0	117.2	K357	K357-N359 PolarHBondContact O-N 2.96Å
360	N	33.5	Very low	39.5	Very low	119 Å²	119	112.6 Å²	112.6	64%	0.636	52%	0.521	S	S	*	.	S	Bend	trans	-125.6	136.9	177.5	-82	-31.2	0	0	0	112.4	K357 I362	K357-N360 PolarHBondContact O-N 2.83Å; N360-I362 HydrophobicContact CB-CD1 4.2Å; N360-I362 HydrophobicContact CB-CG1 4.09Å; N360-I362 PolarHBondContact O-N 3.38Å
361	K	38.1	Very low	39	Very low	206 Å²	206	115.7 Å²	115.7	90%	0.896	54%	0.538	S	S	*	.			trans	-56	47.2	174.3	-70.4	173.2	170.3	175	0	114.2	H363	K361-H363 VanDerWaalsContact C-N 3.33Å; K361-H363 PolarHBondContact O-N 3.09Å
362	I	32.4	Very low	38.4	Very low	103 Å²	103	116.9 Å²	116.9	53%	0.528	55%	0.545	S	S	.	.			trans	-100.6	56.6	176.7	-47.7	177	0	0	0	107.5	N360 H364	N360-I362 HydrophobicContact CB-CD1 4.2Å; N360-I362 HydrophobicContact CB-CG1 4.09Å; N360-I362 PolarHBondContact O-N 3.38Å; I362-H364 VanDerWaalsContact C-N 3.31Å; I362-H364 PolarHBondContact O-N 3.38Å
363	H	30.6	Very low	37.8	Very low	129 Å²	129	117.8 Å²	117.8	60%	0.597	55%	0.552	S	S	*	*			trans	-88.3	18.3	-177.9	-97.9	-75.4	0	0	0	114.1	K361	K361-H363 VanDerWaalsContact C-N 3.33Å; K361-H363 PolarHBondContact O-N 3.09Å
364	H	33.7	Very low	37.3	Very low	141 Å²	141	113.8 Å²	113.8	65%	0.653	54%	0.541	S	S	*	.	S	Bend	trans	-127.2	5.6	-166.5	-74.2	-33.3	0	0	0	118.8	I362	I362-H364 VanDerWaalsContact C-N 3.31Å; I362-H364 PolarHBondContact O-N 3.38Å
365	N	33.9	Very low	36.8	Very low	66 Å²	66	112.1 Å²	112.1	35%	0.353	53%	0.533	S	S	.	.			trans	-114.3	6.5	-172.3	-71.7	-13.3	0	0	0	117.3	W367 K368	N365-W367 PolarHBondContact O-N 3.09Å; N365-K368 WeakPolarHBondContact O-CB 3.46Å; N365-K368 PolarHBondContact O-N 3.28Å
366	L	36	Very low	36.2	Very low	83 Å²	83	109.6 Å²	109.6	44%	0.435	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-71.1	-14.7	174.1	-98.7	151.6	0	0	0	113.8	I354 K368	I354-L366 HydrophobicContact CD1-CD1 3.63Å; I354-L366 HydrophobicContact CD1-CD2 4.38Å; I354-L366 HydrophobicContact CD1-CG 3.9Å; L366-K368 PolarHBondContact O-N 2.98Å
367	W	35.7	Very low	35.6	Very low	140 Å²	140	109.2 Å²	109.2	53%	0.53	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-76.9	-11.8	170	-64	63	0	0	0	111.6	N365 Y369 D370 R439 F443	N365-W367 PolarHBondContact O-N 3.09Å; W367-Y369 PolarHBondContact O-N 3.34Å; W367-D370 PolarHBondContact O-N 3.2Å; W367-R439 VanDerWaalsContact CZ3-CZ 3.46Å; W367-F443 WeakPolarHBondContact O-CE2 3.43Å; W367-F443 WeakPolarHBondContact O-CZ 2.99Å
368	K	37.8	Very low	34.9	Very low	93 Å²	93	106.8 Å²	106.8	40%	0.404	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-70.3	-12.3	-179.3	-147.4	173.4	-179.1	176.4	0	113.2	N365 L366 F443 Y447	N365-K368 WeakPolarHBondContact O-CB 3.46Å; N365-K368 PolarHBondContact O-N 3.28Å; L366-K368 PolarHBondContact O-N 2.98Å; K368-F443 HydrophobicContact CG-CZ 4.46Å; K368-Y447 HydrophobicContact CD-CD1 3.79Å; K368-Y447 HydrophobicContact CD-CE1 4.28Å; K368-Y447 HydrophobicContact CD-CG 4.46Å; K368-Y447 VanDerWaalsContact CE-CD1 3.47Å; K368-Y447 HydrophobicContact CG-CD1 4.17Å; K368-Y447 HydrophobicContact CG-CG 4.4Å
369	Y	37.6	Very low	34.2	Very low	128 Å²	128	105.5 Å²	105.5	50%	0.502	51%	0.512	S	S	.	.	S	Bend	trans	-101.6	71.5	166.2	-63.7	-81.4	0	0	0	108.9	T346 H350 W367 I371	T346-Y369 HydrophobicContact CG2-CE1 4.29Å; H350-Y369 AromaticContact CD2-CE2 3.74Å; H350-Y369 AromaticContact CE1-CE2 3.86Å; H350-Y369 AromaticContact CG-CE2 3.86Å; H350-Y369 AromaticContact ND1-CE2 3.93Å; H350-Y369 AromaticContact NE2-CE2 3.73Å; W367-Y369 PolarHBondContact O-N 3.34Å; Y369-I371 PolarHBondContact O-N 2.93Å
370	D	37	Very low	33.8	Very low	81 Å²	81	100.5 Å²	100.5	43%	0.433	49%	0.485	S	S	.	.			trans	-47.7	124.8	156.9	-121.8	-15.9	0	0	0	106.7	W367 P372 F443	W367-D370 PolarHBondContact O-N 3.2Å; D370-P372 WeakPolarHBondContact O-CD 3.25Å; D370-F443 HydrophobicContact CB-CE1 4.01Å; D370-F443 HydrophobicContact CB-CZ 4.32Å
371	I	39.8	Very low	33.4	Very low	106 Å²	106	102.1 Å²	102.1	54%	0.544	49%	0.486	S	S	.	.			trans	-34.8	108.3	170.4	-71.5	172.8	0	0	0	107.3	Y369 D373 L375	Y369-I371 PolarHBondContact O-N 2.93Å; I371-D373 PolarHBondContact O-N 3.01Å; I371-L375 HydrophobicContact CG2-CB 3.32Å; I371-L375 HydrophobicContact CG2-CD1 3.67Å; I371-L375 HydrophobicContact CG2-CG 4.11Å
372	P	37.3	Very low	33	Very low	50 Å²	50	97.6 Å²	97.6	33%	0.325	48%	0.476	S	S	.	.			trans	-54.7	139.5	-170.1	14.1	-26.7	0	0	0	108	E343 D370 T374 L375	E343-P372 HydrophobicContact CG-CG 4.21Å; E343-P372 VanDerWaalsContact OE1-CG 3.29Å; E343-P372 WeakPolarHBondContact OE1-CG 2.97Å; E343-P372 WeakPolarHBondContact OE2-CG 3.34Å; D370-P372 WeakPolarHBondContact O-CD 3.25Å; P372-T374 CarbonylContact O-C 3.35Å; P372-T374 PolarHBondContact O-N 3.09Å; P372-L375 PolarHBondContact O-N 3.11Å
373	D	36.1	Very low	32.6	Very low	97 Å²	97	96.6 Å²	96.6	52%	0.519	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-52.1	-12.7	-173.7	-74.3	-44.4	0	0	0	113.4	I371 K376	I371-D373 PolarHBondContact O-N 3.01Å; D373-K376 WeakPolarHBondContact O-CB 3.3Å; D373-K376 PolarHBondContact O-N 2.99Å; D373-K376 IonicContact OD1-NZ 2.65Å; D373-K376 PolarHBondContact OD1-NZ 3.11Å
374	T	33.3	Very low	32.6	Very low	44 Å²	44	100.9 Å²	100.9	27%	0.27	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-65.2	-26.6	166.9	17.1	0	0	0	0	116.8	K339 E343 P372 K376	K339-T374 HydrophobicContact CD-CG2 3.82Å; K339-T374 WeakPolarHBondContact CE-OG1 3.49Å; K339-T374 PolarHBondContact NZ-OG1 3.36Å; E343-T374 PolarHBondContact OE1-OG1 3.32Å; E343-T374 VanDerWaalsContact OE1-OG1 3.14Å; P372-T374 CarbonylContact O-C 3.35Å; P372-T374 PolarHBondContact O-N 3.09Å; T374-K376 VanDerWaalsContact C-N 3.28Å
375	L	31.3	Very low	32.6	Very low	43 Å²	43	100.4 Å²	100.4	23%	0.225	50%	0.495	C	S	.	.	G	3₁₀ helix	trans	-78.8	-12.4	172.2	-82.6	169	0	0	0	112.6	K232 L340 I371 P372	K232-L375 HydrophobicContact CD-CD2 4.1Å; L340-L375 HydrophobicContact CD2-CD2 4.33Å; I371-L375 HydrophobicContact CG2-CB 3.32Å; I371-L375 HydrophobicContact CG2-CD1 3.67Å; I371-L375 HydrophobicContact CG2-CG 4.11Å; P372-L375 PolarHBondContact O-N 3.11Å
376	K	34.1	Very low	32.6	Very low	103 Å²	103	103.1 Å²	103.1	45%	0.448	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-82.6	-6.9	171.8	-68.8	174.3	-172.6	150.5	0	113.8	D373 T374	D373-K376 WeakPolarHBondContact O-CB 3.3Å; D373-K376 PolarHBondContact O-N 2.99Å; D373-K376 IonicContact OD1-NZ 2.65Å; D373-K376 PolarHBondContact OD1-NZ 3.11Å; T374-K376 VanDerWaalsContact C-N 3.28Å
377	I	27.5	Very low	32.8	Very low	128 Å²	128	100.9 Å²	100.9	66%	0.656	50%	0.498	S	S	*	.			trans	-120.6	-0.8	-165.5	-63.7	172.9	0	0	0	114.5	E379	I377-E379 PolarHBondContact O-N 2.76Å
378	L	29	Very low	32.8	Very low	48 Å²	48	99 Å²	99	25%	0.251	50%	0.497	S	S	.	.			trans	-83	88.8	-174.1	-111.6	105.2	0	0	0	115	Q336 I380	Q336-L378 HydrophobicContact CG-CD1 4.47Å; L378-I380 HydrophobicContact CD2-CD1 3.89Å; L378-I380 HydrophobicContact CD2-CG1 4.37Å
379	E	27	Very low	32.8	Very low	152 Å²	152	97.3 Å²	97.3	71%	0.71	50%	0.497	S	S	*	.			trans	-63.2	118.8	155	-93.6	-179.1	147.7	0	0	111.5	I377	I377-E379 PolarHBondContact O-N 2.76Å
380	I	28	Very low	33.1	Very low	51 Å²	51	91.7 Å²	91.7	26%	0.262	48%	0.475	S	S	.	.			trans	-141.9	103.3	161.8	-71.2	-174	0	0	0	109.5	L236 M239 L378	L236-I380 HydrophobicContact CD2-CD1 3.84Å; M239-I380 HydrophobicContact CE-CD1 3.87Å; M239-I380 HydrophobicContact CE-CG1 4.39Å; M239-I380 HydrophobicContact CE-CG2 3.56Å; M239-I380 HydrophobicContact SD-CD1 3.8Å; M239-I380 HydrophobicContact SD-CG2 3.62Å; L378-I380 HydrophobicContact CD2-CD1 3.89Å; L378-I380 HydrophobicContact CD2-CG1 4.37Å
381	F	26.1	Very low	33.3	Very low	152 Å²	152	92.9 Å²	92.9	67%	0.667	48%	0.477	S	S	*	.	S	Bend	trans	86.5	7.4	137.8	-86.2	-99.7	0	0	0	124.2	M239 L329	M239-F381 HydrophobicContact CE-CD2 3.96Å; M239-F381 HydrophobicContact CE-CE2 3.85Å; L329-F381 HydrophobicContact CD2-CZ 4.18Å
382	T	27.9	Very low	33.2	Very low	112 Å²	112	92.8 Å²	92.8	69%	0.687	48%	0.476	S	S	*	.	S	Bend	trans	-148.6	69.7	175.7	56.5	0	0	0	0	113.8	W384	T382-W384 WeakPolarHBondContact O-CA 3.26Å; T382-W384 WeakPolarHBondContact O-CB 3.49Å; T382-W384 VanDerWaalsContact O-CD1 3.27Å; T382-W384 PolarHBondContact O-N 2.59Å
383	G	25.5	Very low	33.4	Very low	81 Å²	81	92.2 Å²	92.2	84%	0.835	47%	0.472	S	S	*	.	S	Bend	trans	44	7.5	154.7	0	0	0	0	0	121.8
384	W	29.7	Very low	33.7	Very low	220 Å²	220	89.9 Å²	89.9	83%	0.833	46%	0.459	S	S	*	.			trans	-144.9	106.3	-165.8	-66.9	69.7	0	0	0	106.3	T382 L386	T382-W384 WeakPolarHBondContact O-CA 3.26Å; T382-W384 WeakPolarHBondContact O-CB 3.49Å; T382-W384 VanDerWaalsContact O-CD1 3.27Å; T382-W384 PolarHBondContact O-N 2.59Å; W384-L386 PolarHBondContact O-N 3Å; W384-L386 VanDerWaalsContact O-N 3.16Å
385	Y	33.4	Very low	33.9	Very low	130 Å²	130	89.5 Å²	89.5	51%	0.51	46%	0.461	S	S	.	.			trans	-76.2	103	-177.8	-49	-107.4	0	0	0	109.8	N387 T417	Y385-N387 PolarHBondContact O-N 2.99Å; Y385-T417 VanDerWaalsContact CB-OG1 3.24Å; Y385-T417 WeakPolarHBondContact CB-OG1 3.38Å; Y385-T417 WeakPolarHBondContact CD2-OG1 3.18Å; Y385-T417 WeakPolarHBondContact O-CB 3.27Å; Y385-T417 VanDerWaalsContact O-CG2 3.27Å; Y385-T417 WeakPolarHBondContact O-CG2 3.5Å
386	L	34.9	Very low	34.2	Very low	124 Å²	124	90 Å²	90	65%	0.649	47%	0.471	S	S	*	.			trans	-88.5	90.6	165.1	-163.8	80.2	0	0	0	108.7	W384 I388 F391	W384-L386 PolarHBondContact O-N 3Å; W384-L386 VanDerWaalsContact O-N 3.16Å; L386-I388 PolarHBondContact O-N 3.17Å; L386-I388 VanDerWaalsContact O-N 3.17Å; L386-F391 HydrophobicContact CD1-CB 4.42Å; L386-F391 HydrophobicContact CD1-CD2 4.01Å; L386-F391 HydrophobicContact CD2-CB 4.47Å; L386-F391 HydrophobicContact CD2-CD2 4.13Å; L386-F391 HydrophobicContact CD2-CG 4.3Å; L386-F391 HydrophobicContact CG-CB 4.27Å; L386-F391 HydrophobicContact CG-CD2 4.4Å
387	N	40.5	Very low	34.3	Very low	36 Å²	36	86.2 Å²	86.2	19%	0.193	46%	0.455	C	S	.	.			trans	-68.7	112	171.4	177.5	-41.1	0	0	0	108.2	Y385 S389 L390 F391 Y421	Y385-N387 PolarHBondContact O-N 2.99Å; N387-S389 PolarHBondContact O-N 2.93Å; N387-S389 WeakPolarHBondContact OD1-CA 3.31Å; N387-S389 WeakPolarHBondContact OD1-CB 3.48Å; N387-S389 PolarHBondContact OD1-N 3.02Å; N387-L390 HydrophobicContact CB-CB 3.64Å; N387-L390 HydrophobicContact CB-CD2 4.21Å; N387-L390 CarbonylContact O-C 3.59Å; N387-L390 WeakPolarHBondContact O-CA 3.27Å; N387-L390 VanDerWaalsContact O-CB 3.26Å; N387-L390 WeakPolarHBondContact O-CB 3.25Å; N387-L390 PolarHBondContact O-N 3.32Å; N387-L390 PolarHBondContact OD1-N 3.36Å; N387-F391 PolarHBondContact O-N 3.28Å; N387-Y421 WeakPolarHBondContact ND2-CD2 3.2Å; N387-Y421 VanDerWaalsContact ND2-CE2 3.34Å; N387-Y421 WeakPolarHBondContact ND2-CE2 3.5Å
388	I	35.5	Very low	34.6	Very low	101 Å²	101	82.8 Å²	82.8	52%	0.518	45%	0.446	S	S	.	.	H	α-helix	trans	-64.7	-29.7	-174.2	-65.7	171.9	0	0	0	111.7	L386 F391 I392	L386-I388 PolarHBondContact O-N 3.17Å; L386-I388 VanDerWaalsContact O-N 3.17Å; I388-F391 PolarHBondContact O-N 2.6Å; I388-I392 HydrophobicContact CG2-CD1 3.82Å; I388-I392 HydrophobicContact CG2-CG1 4.28Å; I388-I392 WeakPolarHBondContact O-CB 3.4Å; I388-I392 WeakPolarHBondContact O-CD1 3.34Å; I388-I392 WeakPolarHBondContact O-CG1 3.39Å; I388-I392 PolarHBondContact O-N 3.21Å
389	S	37.4	Very low	34.9	Very low	56 Å²	56	88.8 Å²	88.8	39%	0.392	47%	0.473	S	S	.	.	H	α-helix	trans	-68.5	-40.8	172.6	-58	0	0	0	0	110.9	N387 I392 V393	N387-S389 PolarHBondContact O-N 2.93Å; N387-S389 WeakPolarHBondContact OD1-CA 3.31Å; N387-S389 WeakPolarHBondContact OD1-CB 3.48Å; N387-S389 PolarHBondContact OD1-N 3.02Å; S389-I392 PolarHBondContact O-N 2.71Å; S389-V393 WeakPolarHBondContact O-CB 3.5Å; S389-V393 WeakPolarHBondContact O-CG2 3.16Å; S389-V393 PolarHBondContact O-N 3.35Å
390	L	42.8	Very low	35.2	Very low	10 Å²	10	90.1 Å²	90.1	5%	0.052	47%	0.471	C	S	.	.	H	α-helix	trans	-64.8	-38.1	170.9	175.3	65.6	0	0	0	111.7	N387 V393 L394 L420 I424	N387-L390 HydrophobicContact CB-CB 3.64Å; N387-L390 HydrophobicContact CB-CD2 4.21Å; N387-L390 CarbonylContact O-C 3.59Å; N387-L390 WeakPolarHBondContact O-CA 3.27Å; N387-L390 VanDerWaalsContact O-CB 3.26Å; N387-L390 WeakPolarHBondContact O-CB 3.25Å; N387-L390 PolarHBondContact O-N 3.32Å; N387-L390 PolarHBondContact OD1-N 3.36Å; L390-V393 PolarHBondContact O-N 3.02Å; L390-L394 HydrophobicContact CD1-CD1 3.9Å; L390-L394 HydrophobicContact CD1-CG 4Å; L390-L394 HydrophobicContact CD2-CD1 4.42Å; L390-L394 HydrophobicContact CG-CD1 3.73Å; L390-L394 HydrophobicContact CG-CG 4.25Å; L390-L394 WeakPolarHBondContact O-CB 3.46Å; L390-L394 WeakPolarHBondContact O-CG 3.43Å; L390-L394 PolarHBondContact O-N 3.17Å; L390-L420 HydrophobicContact CD1-CD2 3.62Å; L390-L420 HydrophobicContact CD1-CG 3.63Å; L390-L420 HydrophobicContact CD2-CB 4.39Å; L390-L420 HydrophobicContact CD2-CD2 3.94Å; L390-L420 HydrophobicContact CD2-CG 4.18Å; L390-L420 HydrophobicContact CG-CD2 4.33Å; L390-I424 HydrophobicContact CD1-CD1 3.21Å; L390-I424 HydrophobicContact CD1-CG1 4.47Å
391	F	41.4	Very low	35.5	Very low	106 Å²	106	91.5 Å²	91.5	47%	0.465	48%	0.475	S	S	.	.	H	α-helix	trans	-67.9	-41.1	176.6	177	-96.8	0	0	0	111.5	L386 N387 I388 L394 A395	L386-F391 HydrophobicContact CD1-CB 4.42Å; L386-F391 HydrophobicContact CD1-CD2 4.01Å; L386-F391 HydrophobicContact CD2-CB 4.47Å; L386-F391 HydrophobicContact CD2-CD2 4.13Å; L386-F391 HydrophobicContact CD2-CG 4.3Å; L386-F391 HydrophobicContact CG-CB 4.27Å; L386-F391 HydrophobicContact CG-CD2 4.4Å; N387-F391 PolarHBondContact O-N 3.28Å; I388-F391 PolarHBondContact O-N 2.6Å; F391-L394 PolarHBondContact O-N 3.41Å; F391-A395 WeakPolarHBondContact O-CA 3.44Å; F391-A395 WeakPolarHBondContact O-CB 3.3Å; F391-A395 PolarHBondContact O-N 3.04Å
392	I	39.4	Very low	35.9	Very low	105 Å²	105	96 Å²	96	54%	0.538	49%	0.49	S	S	.	.	H	α-helix	trans	-67.6	-40.4	175.7	-69.8	165.1	0	0	0	110.3	I388 S389 A396	I388-I392 HydrophobicContact CG2-CD1 3.82Å; I388-I392 HydrophobicContact CG2-CG1 4.28Å; I388-I392 WeakPolarHBondContact O-CB 3.4Å; I388-I392 WeakPolarHBondContact O-CD1 3.34Å; I388-I392 WeakPolarHBondContact O-CG1 3.39Å; I388-I392 PolarHBondContact O-N 3.21Å; S389-I392 PolarHBondContact O-N 2.71Å; I392-A396 WeakPolarHBondContact O-CB 3.49Å; I392-A396 PolarHBondContact O-N 2.83Å
393	V	41.5	Very low	36.1	Very low	38 Å²	38	92.6 Å²	92.6	23%	0.23	48%	0.477	C	S	.	.	H	α-helix	trans	-65.7	-45.6	174	171.5	0	0	0	0	110.5	S389 L390 A396 L397 I424	S389-V393 WeakPolarHBondContact O-CB 3.5Å; S389-V393 WeakPolarHBondContact O-CG2 3.16Å; S389-V393 PolarHBondContact O-N 3.35Å; L390-V393 PolarHBondContact O-N 3.02Å; V393-A396 PolarHBondContact O-N 2.91Å; V393-L397 HydrophobicContact CG1-CD1 3.71Å; V393-L397 HydrophobicContact CG1-CG 4.38Å; V393-L397 VanDerWaalsContact O-CB 3.23Å; V393-L397 WeakPolarHBondContact O-CB 3.39Å; V393-L397 WeakPolarHBondContact O-CD1 3.21Å; V393-L397 WeakPolarHBondContact O-CG 3.45Å; V393-L397 PolarHBondContact O-N 3.05Å; V393-I424 HydrophobicContact CG1-CD1 4.1Å
394	L	41.9	Very low	36.6	Very low	48 Å²	48	89.6 Å²	89.6	25%	0.251	44%	0.441	S	S	.	.	H	α-helix	trans	-66.4	-34.8	176.1	-75.3	171.4	0	0	0	112.8	L390 F391 L397 A398 L404 I408	L390-L394 HydrophobicContact CD1-CD1 3.9Å; L390-L394 HydrophobicContact CD1-CG 4Å; L390-L394 HydrophobicContact CD2-CD1 4.42Å; L390-L394 HydrophobicContact CG-CD1 3.73Å; L390-L394 HydrophobicContact CG-CG 4.25Å; L390-L394 WeakPolarHBondContact O-CB 3.46Å; L390-L394 WeakPolarHBondContact O-CG 3.43Å; L390-L394 PolarHBondContact O-N 3.17Å; F391-L394 PolarHBondContact O-N 3.41Å; L394-L397 PolarHBondContact O-N 3.05Å; L394-A398 WeakPolarHBondContact O-CB 3.42Å; L394-A398 PolarHBondContact O-N 3.23Å; L394-L404 HydrophobicContact CD2-CD2 4.34Å; L394-I408 HydrophobicContact CD2-CG1 4.49Å
395	A	38	Very low	36.9	Very low	36 Å²	36	87.1 Å²	87.1	30%	0.298	44%	0.439	S	S	.	.	H	α-helix	trans	-72.6	-42.1	176.2	0	0	0	0	0	110.9	F391 L397 A398 E399	F391-A395 WeakPolarHBondContact O-CA 3.44Å; F391-A395 WeakPolarHBondContact O-CB 3.3Å; F391-A395 PolarHBondContact O-N 3.04Å; A395-L397 VanDerWaalsContact C-N 3.29Å; A395-L397 PolarHBondContact O-N 2.99Å; A395-A398 PolarHBondContact O-N 2.89Å; A395-E399 PolarHBondContact O-N 3.35Å
396	A	37.1	Very low	37.1	Very low	53 Å²	53	84.3 Å²	84.3	44%	0.438	44%	0.438	S	S	.	.	H	α-helix	trans	-65.3	-32.9	172.3	0	0	0	0	0	112.3	I392 V393	I392-A396 WeakPolarHBondContact O-CB 3.49Å; I392-A396 PolarHBondContact O-N 2.83Å; V393-A396 PolarHBondContact O-N 2.91Å
397	L	35.3	Very low	37.3	Very low	24 Å²	24	83 Å²	83	13%	0.126	43%	0.431	C	S	.	.	H	α-helix	trans	-71.6	-41.7	171.3	-74.5	166	0	0	0	111.4	V393 L394 A395 R400 F401 L404 V529	V393-L397 HydrophobicContact CG1-CD1 3.71Å; V393-L397 HydrophobicContact CG1-CG 4.38Å; V393-L397 VanDerWaalsContact O-CB 3.23Å; V393-L397 WeakPolarHBondContact O-CB 3.39Å; V393-L397 WeakPolarHBondContact O-CD1 3.21Å; V393-L397 WeakPolarHBondContact O-CG 3.45Å; V393-L397 PolarHBondContact O-N 3.05Å; L394-L397 PolarHBondContact O-N 3.05Å; A395-L397 VanDerWaalsContact C-N 3.29Å; A395-L397 PolarHBondContact O-N 2.99Å; L397-R400 PolarHBondContact O-N 3.43Å; L397-F401 WeakPolarHBondContact O-CD2 3.31Å; L397-F401 PolarHBondContact O-N 2.94Å; L397-L404 HydrophobicContact CB-CD1 3.89Å; L397-L404 HydrophobicContact CB-CD2 3.81Å; L397-L404 HydrophobicContact CD2-CD1 4.45Å; L397-V529 HydrophobicContact CD2-CB 4.09Å; L397-V529 HydrophobicContact CD2-CG1 3.36Å; L397-V529 HydrophobicContact CD2-CG2 3.72Å
398	A	34.1	Very low	37.2	Very low	55 Å²	55	84.2 Å²	84.2	46%	0.455	44%	0.437	S	S	.	.	H	α-helix	trans	-68.6	-34.4	-180	0	0	0	0	0	113	L394 A395 R400	L394-A398 WeakPolarHBondContact O-CB 3.42Å; L394-A398 PolarHBondContact O-N 3.23Å; A395-A398 PolarHBondContact O-N 2.89Å; A398-R400 PolarHBondContact O-N 3.31Å
399	E	34.9	Very low	37.2	Very low	175 Å²	175	81.4 Å²	81.4	82%	0.818	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-14.2	176	-81.2	-175	168.8	0	0	113.7	A395	A395-E399 PolarHBondContact O-N 3.35Å
400	R	33.5	Very low	37.4	Very low	180 Å²	180	84.1 Å²	84.1	68%	0.679	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	-5.4	-179.3	-83.6	-171.1	161.3	169.6	-1.3	115.5	L397 A398	L397-R400 PolarHBondContact O-N 3.43Å; A398-R400 PolarHBondContact O-N 3.31Å
401	F	33.9	Very low	37.1	Very low	80 Å²	80	86.1 Å²	86.1	35%	0.351	45%	0.454	S	S	.	.			trans	-137.1	110.4	-173.3	-75.9	-88.4	0	0	0	113.5	L397 G403 L404 V529 E533	L397-F401 WeakPolarHBondContact O-CD2 3.31Å; L397-F401 PolarHBondContact O-N 2.94Å; F401-G403 PolarHBondContact O-N 3.21Å; F401-G403 VanDerWaalsContact O-N 3.13Å; F401-L404 HydrophobicContact CB-CB 4.21Å; F401-L404 HydrophobicContact CB-CD1 3.54Å; F401-L404 HydrophobicContact CD2-CD1 3.82Å; F401-L404 HydrophobicContact CG-CD1 3.77Å; F401-V529 HydrophobicContact CE2-CG1 3.9Å; F401-V529 HydrophobicContact CZ-CG1 4.46Å; F401-E533 WeakPolarHBondContact CZ-OE1 3.41Å
402	Y	34.7	Very low	36.9	Very low	247 Å²	247	84.6 Å²	84.6	97%	0.969	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-3.1	155.7	-96.4	-90.1	0	0	0	113.1
403	G	32.4	Very low	36.8	Very low	40 Å²	40	87.5 Å²	87.5	41%	0.412	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-6.3	-176.5	0	0	0	0	0	116.3	F401 E405 S406	F401-G403 PolarHBondContact O-N 3.21Å; F401-G403 VanDerWaalsContact O-N 3.13Å; G403-E405 PolarHBondContact O-N 3.35Å; G403-S406 PolarHBondContact O-N 2.9Å; G403-S406 PolarHBondContact O-OG 3.4Å
404	L	37.2	Very low	36.7	Very low	17 Å²	17	94.1 Å²	94.1	9%	0.089	49%	0.489	C	S	.	.	H	α-helix	trans	-71.1	-13.3	-178.7	-118.3	103.4	0	0	0	113.1	L394 L397 F401 S406 I407 I408	L394-L404 HydrophobicContact CD2-CD2 4.34Å; L397-L404 HydrophobicContact CB-CD1 3.89Å; L397-L404 HydrophobicContact CB-CD2 3.81Å; L397-L404 HydrophobicContact CD2-CD1 4.45Å; F401-L404 HydrophobicContact CB-CB 4.21Å; F401-L404 HydrophobicContact CB-CD1 3.54Å; F401-L404 HydrophobicContact CD2-CD1 3.82Å; F401-L404 HydrophobicContact CG-CD1 3.77Å; L404-S406 PolarHBondContact O-N 2.87Å; L404-I407 PolarHBondContact O-N 3.43Å; L404-I407 VanDerWaalsContact O-N 3.16Å; L404-I408 HydrophobicContact CB-CD1 4.09Å; L404-I408 HydrophobicContact CB-CG1 4.48Å; L404-I408 HydrophobicContact CD2-CD1 3.65Å; L404-I408 HydrophobicContact CD2-CG1 3.87Å; L404-I408 HydrophobicContact CG-CD1 4.42Å; L404-I408 VanDerWaalsContact O-CB 3.29Å; L404-I408 WeakPolarHBondContact O-CB 3.45Å; L404-I408 VanDerWaalsContact O-CG1 3.27Å; L404-I408 WeakPolarHBondContact O-CG1 3.45Å; L404-I408 PolarHBondContact O-N 2.88Å
405	E	35.9	Very low	36.9	Very low	168 Å²	168	92.5 Å²	92.5	79%	0.785	48%	0.481	S	S	*	.	H	α-helix	trans	-57.9	-34.9	175.7	-125.6	168.8	-172	0	0	112.1	G403 G409	G403-E405 PolarHBondContact O-N 3.35Å; E405-G409 WeakPolarHBondContact O-CA 3.35Å; E405-G409 PolarHBondContact O-N 2.82Å
406	S	37.9	Very low	37.1	Very low	71 Å²	71	92.9 Å²	92.9	50%	0.497	49%	0.488	S	S	.	.	H	α-helix	trans	-74.4	-35	177.3	80.6	0	0	0	0	112.7	G403 L404 N410	G403-S406 PolarHBondContact O-N 2.9Å; G403-S406 PolarHBondContact O-OG 3.4Å; L404-S406 PolarHBondContact O-N 2.87Å; S406-N410 WeakPolarHBondContact O-CB 2.92Å; S406-N410 PolarHBondContact O-N 3.37Å; S406-N410 PolarHBondContact O-ND2 3.3Å
407	I	37.4	Very low	37.4	Very low	97 Å²	97	92.5 Å²	92.5	50%	0.497	48%	0.481	S	S	.	.	H	α-helix	trans	-77.9	-42.5	-179.6	-61.4	175.2	0	0	0	110.2	L404 N411	L404-I407 PolarHBondContact O-N 3.43Å; L404-I407 VanDerWaalsContact O-N 3.16Å; I407-N411 WeakPolarHBondContact O-CB 3.42Å; I407-N411 PolarHBondContact O-N 3.48Å; I407-N411 PolarHBondContact O-ND2 3.3Å
408	I	39.5	Very low	37.9	Very low	62 Å²	62	96.2 Å²	96.2	32%	0.318	50%	0.497	S	S	.	.	H	α-helix	trans	-68.4	-47.3	176.1	-67	174.2	0	0	0	109.6	L394 L404 N410 N411 V412	L394-I408 HydrophobicContact CD2-CG1 4.49Å; L404-I408 HydrophobicContact CB-CD1 4.09Å; L404-I408 HydrophobicContact CB-CG1 4.48Å; L404-I408 HydrophobicContact CD2-CD1 3.65Å; L404-I408 HydrophobicContact CD2-CG1 3.87Å; L404-I408 HydrophobicContact CG-CD1 4.42Å; L404-I408 VanDerWaalsContact O-CB 3.29Å; L404-I408 WeakPolarHBondContact O-CB 3.45Å; L404-I408 VanDerWaalsContact O-CG1 3.27Å; L404-I408 WeakPolarHBondContact O-CG1 3.45Å; L404-I408 PolarHBondContact O-N 2.88Å; I408-N410 VanDerWaalsContact C-N 3.33Å; I408-N410 PolarHBondContact O-N 2.92Å; I408-N411 PolarHBondContact O-N 3.3Å; I408-V412 HydrophobicContact CB-CG2 4.31Å; I408-V412 HydrophobicContact CG2-CG2 3.64Å; I408-V412 WeakPolarHBondContact O-CB 3.12Å; I408-V412 VanDerWaalsContact O-CG2 3.23Å; I408-V412 WeakPolarHBondContact O-CG2 3.32Å; I408-V412 PolarHBondContact O-N 3.26Å
409	G	35.9	Very low	38.8	Very low	42 Å²	42	95.3 Å²	95.3	43%	0.433	49%	0.488	S	S	.	.	H	α-helix	trans	-61	-37.7	178.1	0	0	0	0	0	113.4	E405	E405-G409 WeakPolarHBondContact O-CA 3.35Å; E405-G409 PolarHBondContact O-N 2.82Å
410	N	40	Very low	39.6	Very low	112 Å²	112	89.1 Å²	89.1	60%	0.599	46%	0.46	S	S	*	.	H	α-helix	trans	-85.2	-24.5	-179.3	-71.3	-26.8	0	0	0	114.5	S406 I408	S406-N410 WeakPolarHBondContact O-CB 2.92Å; S406-N410 PolarHBondContact O-N 3.37Å; S406-N410 PolarHBondContact O-ND2 3.3Å; I408-N410 VanDerWaalsContact C-N 3.33Å; I408-N410 PolarHBondContact O-N 2.92Å
411	N	37.7	Very low	40.4	Very low	53 Å²	53	84 Å²	84	28%	0.283	44%	0.441	S	S	.	.	H	α-helix	trans	-111.1	-26.2	-172.2	-65.3	-56.2	0	0	0	115	I407 I408 H413 K414 I415	I407-N411 WeakPolarHBondContact O-CB 3.42Å; I407-N411 PolarHBondContact O-N 3.48Å; I407-N411 PolarHBondContact O-ND2 3.3Å; I408-N411 PolarHBondContact O-N 3.3Å; N411-H413 PolarHBondContact O-N 2.96Å; N411-K414 PolarHBondContact O-N 2.98Å; N411-I415 HydrophobicContact CB-CD1 4.04Å; N411-I415 WeakPolarHBondContact O-CB 3.49Å; N411-I415 PolarHBondContact O-N 3.24Å
412	V	37.3	Very low	41.4	Very low	73 Å²	73	83.2 Å²	83.2	44%	0.442	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-27.7	-178.5	172.8	0	0	0	0	112.1	I408	I408-V412 HydrophobicContact CB-CG2 4.31Å; I408-V412 HydrophobicContact CG2-CG2 3.64Å; I408-V412 WeakPolarHBondContact O-CB 3.12Å; I408-V412 VanDerWaalsContact O-CG2 3.23Å; I408-V412 WeakPolarHBondContact O-CG2 3.32Å; I408-V412 PolarHBondContact O-N 3.26Å
413	H	37	Very low	42.6	Very low	167 Å²	167	72.7 Å²	72.7	77%	0.773	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-16.7	175.7	-71.4	-65.6	0	0	0	114.5	N411	N411-H413 PolarHBondContact O-N 2.96Å
414	K	40	Very low	44.1	Very low	176 Å²	176	72.1 Å²	72.1	77%	0.765	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	-25.3	-175.2	-81.3	-178	176.1	176.2	0	114.4	N411	N411-K414 PolarHBondContact O-N 2.98Å
415	I	45.4	Very low	45.3	Very low	15 Å²	15	77 Å²	77	8%	0.077	40%	0.403	C	S	.	.	S	Bend	trans	-115.7	110.2	-175.9	-61.6	177.7	0	0	0	106.3	I9 N411 T417 L420	I9-I415 HydrophobicContact CG1-CD1 4.4Å; I9-I415 HydrophobicContact CG2-CG1 4.44Å; N411-I415 HydrophobicContact CB-CD1 4.04Å; N411-I415 WeakPolarHBondContact O-CB 3.49Å; N411-I415 PolarHBondContact O-N 3.24Å; I415-T417 PolarHBondContact O-N 3.13Å; I415-L420 HydrophobicContact CG2-CB 4.18Å
416	G	41.8	Very low	46.6	Very low	43 Å²	43	70.3 Å²	70.3	44%	0.443	37%	0.371	S	S	.	.			trans	-50.2	140.3	174.1	0	0	0	0	0	110.1	Q418 S419 L420	G416-Q418 PolarHBondContact O-N 2.96Å; G416-S419 WeakPolarHBondContact O-CA 3.48Å; G416-S419 WeakPolarHBondContact O-CB 3.49Å; G416-S419 PolarHBondContact O-N 3.28Å; G416-L420 PolarHBondContact O-N 3.47Å
417	T	44.1	Very low	48.1	Very low	46 Å²	46	67 Å²	67	28%	0.282	35%	0.348	S	S	.	.	H	α-helix	trans	-49.8	-31.3	177.1	43.8	0	0	0	0	113	Y385 I415 Y421	Y385-T417 VanDerWaalsContact CB-OG1 3.24Å; Y385-T417 WeakPolarHBondContact CB-OG1 3.38Å; Y385-T417 WeakPolarHBondContact CD2-OG1 3.18Å; Y385-T417 WeakPolarHBondContact O-CB 3.27Å; Y385-T417 VanDerWaalsContact O-CG2 3.27Å; Y385-T417 WeakPolarHBondContact O-CG2 3.5Å; I415-T417 PolarHBondContact O-N 3.13Å; T417-Y421 WeakPolarHBondContact O-CB 3.41Å; T417-Y421 PolarHBondContact O-N 2.72Å
418	Q	46.1	Very low	49.5	Very low	101 Å²	101	66.3 Å²	66.3	47%	0.472	34%	0.339	S	S	.	.	H	α-helix	trans	-66	-45.4	172.5	-170.8	63.8	6.9	0	0	112.9	G416 L420 Y421 M422	G416-Q418 PolarHBondContact O-N 2.96Å; Q418-L420 VanDerWaalsContact C-N 3.34Å; Q418-Y421 PolarHBondContact O-N 3.11Å; Q418-M422 WeakPolarHBondContact O-CG 3.32Å; Q418-M422 PolarHBondContact O-N 2.8Å
419	S	51.3	Low	50.8	Low	37 Å²	37	67 Å²	67	26%	0.259	34%	0.341	S	S	.	.	H	α-helix	trans	-62.8	-42.1	175.1	-60	0	0	0	0	110.8	G416 Y421 M422 K423	G416-S419 WeakPolarHBondContact O-CA 3.48Å; G416-S419 WeakPolarHBondContact O-CB 3.49Å; G416-S419 PolarHBondContact O-N 3.28Å; S419-Y421 PolarHBondContact O-N 3.01Å; S419-M422 PolarHBondContact O-N 3Å; S419-K423 VanDerWaalsContact O-CG 3.28Å; S419-K423 WeakPolarHBondContact O-CG 3.39Å; S419-K423 PolarHBondContact O-N 3.29Å
420	L	51.8	Low	52.5	Low	44 Å²	44	65 Å²	65	23%	0.23	32%	0.321	C	S	.	.	H	α-helix	trans	-64.7	-39.1	177.1	-172.1	57.2	0	0	0	112.3	L390 I415 G416 Q418 K423 I424	L390-L420 HydrophobicContact CD1-CD2 3.62Å; L390-L420 HydrophobicContact CD1-CG 3.63Å; L390-L420 HydrophobicContact CD2-CB 4.39Å; L390-L420 HydrophobicContact CD2-CD2 3.94Å; L390-L420 HydrophobicContact CD2-CG 4.18Å; L390-L420 HydrophobicContact CG-CD2 4.33Å; I415-L420 HydrophobicContact CG2-CB 4.18Å; G416-L420 PolarHBondContact O-N 3.47Å; Q418-L420 VanDerWaalsContact C-N 3.34Å; L420-K423 PolarHBondContact O-N 3.36Å; L420-I424 WeakPolarHBondContact O-CG1 3.06Å; L420-I424 PolarHBondContact O-N 3.16Å
421	Y	50.2	Low	53.9	Low	74 Å²	74	60 Å²	60	29%	0.29	29%	0.293	S	S	.	.	H	α-helix	trans	-60.5	-47.6	171.9	167.8	-113.3	0	0	0	112.4	N387 T417 Q418 S419 K423 I424 R425	N387-Y421 WeakPolarHBondContact ND2-CD2 3.2Å; N387-Y421 VanDerWaalsContact ND2-CE2 3.34Å; N387-Y421 WeakPolarHBondContact ND2-CE2 3.5Å; T417-Y421 WeakPolarHBondContact O-CB 3.41Å; T417-Y421 PolarHBondContact O-N 2.72Å; Q418-Y421 PolarHBondContact O-N 3.11Å; S419-Y421 PolarHBondContact O-N 3.01Å; Y421-K423 VanDerWaalsContact C-N 3.29Å; Y421-K423 PolarHBondContact O-N 3.47Å; Y421-I424 PolarHBondContact O-N 3.42Å; Y421-R425 WeakPolarHBondContact O-CB 3.46Å; Y421-R425 PolarHBondContact O-N 2.87Å
422	M	56.3	Low	55.3	Low	63 Å²	63	59.4 Å²	59.4	31%	0.31	29%	0.29	S	S	.	.	H	α-helix	trans	-61.4	-39	178.4	-70.8	-57.8	-65.1	0	0	111.5	Q418 S419 R425 K426	Q418-M422 WeakPolarHBondContact O-CG 3.32Å; Q418-M422 PolarHBondContact O-N 2.8Å; S419-M422 PolarHBondContact O-N 3Å; M422-R425 PolarHBondContact O-N 2.72Å; M422-K426 WeakPolarHBondContact O-CG 3.13Å; M422-K426 PolarHBondContact O-N 2.99Å
423	K	60.4	Low	56.8	Low	25 Å²	25	60.8 Å²	60.8	11%	0.109	29%	0.294	C	S	.	.	H	α-helix	trans	-59.9	-50.7	173.6	-71.7	-176.6	-165.4	-146.6	0	112.4	P8 I12 S419 L420 Y421 R425 K426 A427	P8-K423 PolarHBondContact O-NZ 3.01Å; I12-K423 HydrophobicContact CB-CG 4.42Å; I12-K423 HydrophobicContact CG1-CG 3.99Å; I12-K423 HydrophobicContact CG2-CD 3.77Å; I12-K423 HydrophobicContact CG2-CG 3.54Å; S419-K423 VanDerWaalsContact O-CG 3.28Å; S419-K423 WeakPolarHBondContact O-CG 3.39Å; S419-K423 PolarHBondContact O-N 3.29Å; L420-K423 PolarHBondContact O-N 3.36Å; Y421-K423 VanDerWaalsContact C-N 3.29Å; Y421-K423 PolarHBondContact O-N 3.47Å; K423-R425 VanDerWaalsContact C-N 3.29Å; K423-R425 PolarHBondContact O-N 3.37Å; K423-K426 PolarHBondContact O-N 3.49Å; K423-A427 VanDerWaalsContact O-CB 3.22Å; K423-A427 WeakPolarHBondContact O-CB 3.19Å; K423-A427 PolarHBondContact O-N 3.34Å
424	I	62.2	Low	58.5	Low	28 Å²	28	53.5 Å²	53.5	14%	0.144	26%	0.261	C	S	.	.	H	α-helix	trans	-64.2	-37.7	179.4	-67.5	-179.5	0	0	0	111.1	L390 V393 L420 Y421 R428	L390-I424 HydrophobicContact CD1-CD1 3.21Å; L390-I424 HydrophobicContact CD1-CG1 4.47Å; V393-I424 HydrophobicContact CG1-CD1 4.1Å; L420-I424 WeakPolarHBondContact O-CG1 3.06Å; L420-I424 PolarHBondContact O-N 3.16Å; Y421-I424 PolarHBondContact O-N 3.42Å; I424-R428 VanDerWaalsContact O-CB 3.3Å; I424-R428 WeakPolarHBondContact O-CB 3.46Å; I424-R428 PolarHBondContact O-N 3.07Å
425	R	62.6	Low	59.7	Low	119 Å²	119	46.2 Å²	46.2	45%	0.449	24%	0.235	S	C	.	.	H	α-helix	trans	-62.1	-52.1	176.4	-179.5	178.8	173.2	159.9	-2.8	111.4	Y421 M422 K423 A427 R428 E429	Y421-R425 WeakPolarHBondContact O-CB 3.46Å; Y421-R425 PolarHBondContact O-N 2.87Å; M422-R425 PolarHBondContact O-N 2.72Å; K423-R425 VanDerWaalsContact C-N 3.29Å; K423-R425 PolarHBondContact O-N 3.37Å; R425-A427 VanDerWaalsContact C-N 3.34Å; R425-A427 PolarHBondContact O-N 2.85Å; R425-R428 WeakPolarHBondContact O-CB 3.23Å; R425-R428 PolarHBondContact O-N 3.02Å; R425-E429 WeakPolarHBondContact CG-OE1 3.04Å; R425-E429 IonicContact CZ-OE1 2.68Å; R425-E429 IonicContact NE-OE1 2.76Å; R425-E429 PolarHBondContact NE-OE1 2.99Å; R425-E429 VanDerWaalsContact NE-OE1 3.09Å; R425-E429 IonicContact NH2-OE1 3.06Å; R425-E429 WeakPolarHBondContact O-CG 3.22Å; R425-E429 PolarHBondContact O-N 3.29Å
426	K	64.5	Low	60.7	Low	29 Å²	29	45.7 Å²	45.7	13%	0.126	23%	0.234	C	C	.	.	H	α-helix	trans	-63.4	-39.9	178.2	-69.9	-174	-176.3	-172.8	0	111.9	I12 D13 Y15 M422 K423 R428 E429 L430	I12-K426 WeakPolarHBondContact O-CD 3.15Å; I12-K426 PolarHBondContact O-NZ 3.31Å; D13-K426 PolarHBondContact O-NZ 3Å; Y15-K426 HydrophobicContact CD1-CD 4.32Å; Y15-K426 WeakPolarHBondContact O-CE 3.39Å; Y15-K426 PolarHBondContact O-NZ 3.11Å; M422-K426 WeakPolarHBondContact O-CG 3.13Å; M422-K426 PolarHBondContact O-N 2.99Å; K423-K426 PolarHBondContact O-N 3.49Å; K426-R428 VanDerWaalsContact C-N 3.32Å; K426-R428 PolarHBondContact O-N 3.29Å; K426-E429 PolarHBondContact O-N 3.08Å; K426-L430 PolarHBondContact O-N 3.17Å
427	A	68.7	Low	61.6	Low	1 Å²	1	45.3 Å²	45.3	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-60.6	-41.8	175	0	0	0	0	0	112	K423 R425 L430 F431 F531 L532 L535	K423-A427 VanDerWaalsContact O-CB 3.22Å; K423-A427 WeakPolarHBondContact O-CB 3.19Å; K423-A427 PolarHBondContact O-N 3.34Å; R425-A427 VanDerWaalsContact C-N 3.34Å; R425-A427 PolarHBondContact O-N 2.85Å; A427-L430 PolarHBondContact O-N 3.19Å; A427-F431 VanDerWaalsContact O-CB 3.27Å; A427-F431 WeakPolarHBondContact O-CB 3.34Å; A427-F431 PolarHBondContact O-N 3.39Å; A427-F531 HydrophobicContact CB-CE1 4.21Å; A427-F531 VanDerWaalsContact O-CE1 3.25Å; A427-F531 WeakPolarHBondContact O-CE1 3.36Å; A427-L532 HydrophobicContact CB-CD2 3.53Å; A427-L535 HydrophobicContact CB-CD1 3.64Å; A427-L535 HydrophobicContact CB-CD2 3.78Å; A427-L535 HydrophobicContact CB-CG 4.37Å
428	R	66.7	Low	62.4	Low	83 Å²	83	44.5 Å²	44.5	31%	0.313	22%	0.215	S	C	.	.	H	α-helix	trans	-65.7	-41	175.6	178.9	-179	170.6	-179.6	5.6	112.4	I424 R425 K426 F431 I432 D438 F528	I424-R428 VanDerWaalsContact O-CB 3.3Å; I424-R428 WeakPolarHBondContact O-CB 3.46Å; I424-R428 PolarHBondContact O-N 3.07Å; R425-R428 WeakPolarHBondContact O-CB 3.23Å; R425-R428 PolarHBondContact O-N 3.02Å; K426-R428 VanDerWaalsContact C-N 3.32Å; K426-R428 PolarHBondContact O-N 3.29Å; R428-F431 WeakPolarHBondContact O-CB 3.13Å; R428-F431 PolarHBondContact O-N 3.43Å; R428-I432 HydrophobicContact CG-CD1 4.03Å; R428-I432 WeakPolarHBondContact O-CD1 3.4Å; R428-I432 VanDerWaalsContact O-CG1 3.25Å; R428-I432 WeakPolarHBondContact O-CG1 3.35Å; R428-I432 PolarHBondContact O-N 2.87Å; R428-D438 IonicContact CZ-OD1 3.23Å; R428-D438 IonicContact CZ-OD2 3.69Å; R428-D438 IonicContact NE-OD1 2.72Å; R428-D438 IonicContact NE-OD2 3.72Å; R428-D438 PolarHBondContact NE-OD2 2.73Å; R428-D438 IonicContact NH2-OD1 3.11Å; R428-D438 PolarHBondContact NH2-OD1 3.44Å; R428-D438 IonicContact NH2-OD2 3Å; R428-D438 PolarHBondContact NH2-OD2 2.71Å; R428-F528 HydrophobicContact CB-CE2 4.33Å; R428-F528 HydrophobicContact CB-CZ 4.15Å
429	E	66.1	Low	62.6	Low	76 Å²	76	46.4 Å²	46.4	36%	0.355	22%	0.218	S	C	.	.	H	α-helix	trans	-61.7	-44.6	176	-70.5	166.9	-173.3	0	0	110.6	I17 R425 K426 I432 L433	I17-E429 HydrophobicContact CD1-CB 3.2Å; I17-E429 HydrophobicContact CD1-CG 4.22Å; I17-E429 VanDerWaalsContact CD1-OE2 3.23Å; I17-E429 WeakPolarHBondContact CD1-OE2 3.47Å; R425-E429 WeakPolarHBondContact CG-OE1 3.04Å; R425-E429 IonicContact CZ-OE1 2.68Å; R425-E429 IonicContact NE-OE1 2.76Å; R425-E429 PolarHBondContact NE-OE1 2.99Å; R425-E429 VanDerWaalsContact NE-OE1 3.09Å; R425-E429 IonicContact NH2-OE1 3.06Å; R425-E429 WeakPolarHBondContact O-CG 3.22Å; R425-E429 PolarHBondContact O-N 3.29Å; K426-E429 PolarHBondContact O-N 3.08Å; E429-I432 PolarHBondContact O-N 2.99Å; E429-L433 WeakPolarHBondContact O-CB 3.44Å; E429-L433 PolarHBondContact O-N 2.91Å
430	L	72.3	Confident	62.4	Low	1 Å²	1	48 Å²	48	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-41.7	173.7	-178.9	57.8	0	0	0	112.7	K426 A427 I432 L433 I434 F531 F538 V539 H542	K426-L430 PolarHBondContact O-N 3.17Å; A427-L430 PolarHBondContact O-N 3.19Å; L430-I432 VanDerWaalsContact C-N 3.32Å; L430-I432 PolarHBondContact O-N 2.83Å; L430-L433 HydrophobicContact CD1-CD2 4.39Å; L430-L433 WeakPolarHBondContact O-CB 3.5Å; L430-L433 PolarHBondContact O-N 3.36Å; L430-I434 HydrophobicContact CD1-CD1 4.07Å; L430-I434 HydrophobicContact CD1-CG1 4.25Å; L430-I434 HydrophobicContact CG-CD1 3.97Å; L430-I434 VanDerWaalsContact O-CG1 3.31Å; L430-I434 WeakPolarHBondContact O-CG1 3.29Å; L430-I434 PolarHBondContact O-N 3.33Å; L430-F531 HydrophobicContact CB-CZ 4.25Å; L430-F531 HydrophobicContact CD2-CZ 4.1Å; L430-F531 HydrophobicContact CG-CZ 3.98Å; L430-F538 HydrophobicContact CD2-CB 3.9Å; L430-V539 HydrophobicContact CD2-CG2 4.03Å; L430-H542 HydrophobicContact CD1-CB 3.94Å; L430-H542 WeakPolarHBondContact CD1-CD2 3.14Å
431	F	70.3	Confident	62.1	Low	5 Å²	5	49.4 Å²	49.4	2%	0.022	23%	0.226	C	C	.	.	H	α-helix	trans	-58.4	-44.6	176.9	-179.4	-95.1	0	0	0	112	A427 R428 G436 I492 F528 F531	A427-F431 VanDerWaalsContact O-CB 3.27Å; A427-F431 WeakPolarHBondContact O-CB 3.34Å; A427-F431 PolarHBondContact O-N 3.39Å; R428-F431 WeakPolarHBondContact O-CB 3.13Å; R428-F431 PolarHBondContact O-N 3.43Å; F431-G436 VanDerWaalsContact CE1-CA 3.44Å; F431-G436 VanDerWaalsContact O-CA 3.32Å; F431-G436 WeakPolarHBondContact O-CA 3.47Å; F431-G436 PolarHBondContact O-N 3.23Å; F431-I492 HydrophobicContact CD2-CD1 3.34Å; F431-I492 HydrophobicContact CD2-CG1 3.71Å; F431-I492 HydrophobicContact CE1-CG1 4.32Å; F431-I492 HydrophobicContact CE2-CD1 3.44Å; F431-I492 VanDerWaalsContact CE2-CD1 3.44Å; F431-I492 HydrophobicContact CE2-CG1 3.34Å; F431-I492 HydrophobicContact CG-CD1 4.14Å; F431-I492 HydrophobicContact CG-CG1 4.37Å; F431-I492 HydrophobicContact CZ-CD1 4.26Å; F431-I492 HydrophobicContact CZ-CG1 3.67Å; F431-F528 HydrophobicContact CB-CD2 4.01Å; F431-F528 HydrophobicContact CB-CE2 3.83Å; F431-F528 AromaticContact CD1-CD2 3.91Å; F431-F528 HydrophobicContact CD1-CD2 3.91Å; F431-F528 HydrophobicContact CD1-CE2 4.4Å; F431-F528 AromaticContact CD2-CD2 3.46Å; F431-F528 HydrophobicContact CD2-CD2 3.46Å; F431-F528 VanDerWaalsContact CD2-CD2 3.46Å; F431-F528 HydrophobicContact CD2-CE2 4.11Å; F431-F528 HydrophobicContact CD2-CG 4.5Å; F431-F528 HydrophobicContact CE1-CD2 4.19Å; F431-F528 HydrophobicContact CE2-CB 4.01Å; F431-F528 AromaticContact CE2-CD2 3.73Å; F431-F528 HydrophobicContact CE2-CD2 3.73Å; F431-F528 HydrophobicContact CE2-CG 4.39Å; F431-F528 AromaticContact CG-CD2 3.53Å; F431-F528 HydrophobicContact CG-CD2 3.53Å; F431-F528 AromaticContact CG-CE2 3.88Å; F431-F528 HydrophobicContact CG-CE2 3.88Å; F431-F528 HydrophobicContact CZ-CB 4.04Å; F431-F528 HydrophobicContact CZ-CD2 4.1Å; F431-F531 HydrophobicContact CB-CD1 4.18Å; F431-F531 HydrophobicContact CB-CE1 3.9Å; F431-F531 HydrophobicContact CB-CZ 4.11Å; F431-F531 HydrophobicContact CD2-CB 3.89Å; F431-F531 AromaticContact CD2-CD1 3.79Å; F431-F531 HydrophobicContact CD2-CD1 3.79Å; F431-F531 AromaticContact CD2-CD2 3.92Å; F431-F531 HydrophobicContact CD2-CD2 3.92Å; F431-F531 HydrophobicContact CD2-CE1 4.3Å; F431-F531 HydrophobicContact CD2-CE2 4.42Å; F431-F531 AromaticContact CD2-CG 3.58Å; F431-F531 HydrophobicContact CD2-CG 3.58Å; F431-F531 HydrophobicContact CE2-CB 4.05Å; F431-F531 HydrophobicContact CE2-CG 4.24Å; F431-F531 HydrophobicContact CG-CD1 4.46Å
432	I	65.6	Low	61.8	Low	41 Å²	41	50.6 Å²	50.6	21%	0.21	23%	0.23	C	C	.	.	H	α-helix	trans	-64	-44.3	175.7	-69	164.3	0	0	0	110.4	R428 E429 L430 I434 G435 D438	R428-I432 HydrophobicContact CG-CD1 4.03Å; R428-I432 WeakPolarHBondContact O-CD1 3.4Å; R428-I432 VanDerWaalsContact O-CG1 3.25Å; R428-I432 WeakPolarHBondContact O-CG1 3.35Å; R428-I432 PolarHBondContact O-N 2.87Å; E429-I432 PolarHBondContact O-N 2.99Å; L430-I432 VanDerWaalsContact C-N 3.32Å; L430-I432 PolarHBondContact O-N 2.83Å; I432-I434 VanDerWaalsContact C-N 3.29Å; I432-I434 PolarHBondContact O-N 2.88Å; I432-G435 PolarHBondContact O-N 2.96Å; I432-D438 HydrophobicContact CD1-CB 3.62Å; I432-D438 WeakPolarHBondContact CD1-OD2 3.3Å; I432-D438 HydrophobicContact CG1-CB 3.63Å
433	L	69	Low	60.9	Low	103 Å²	103	49.2 Å²	49.2	54%	0.539	22%	0.223	S	C	.	.	H	α-helix	trans	-59.3	-38.8	-179.4	-174.3	68.2	0	0	0	112.6	I17 E429 L430 G435 H542	I17-L433 HydrophobicContact CG2-CD2 4.01Å; E429-L433 WeakPolarHBondContact O-CB 3.44Å; E429-L433 PolarHBondContact O-N 2.91Å; L430-L433 HydrophobicContact CD1-CD2 4.39Å; L430-L433 WeakPolarHBondContact O-CB 3.5Å; L430-L433 PolarHBondContact O-N 3.36Å; L433-G435 PolarHBondContact O-N 3.07Å; L433-H542 WeakPolarHBondContact CD2-NE2 3.32Å
434	I	72.8	Confident	59.9	Low	14 Å²	14	52.2 Å²	52.2	7%	0.072	24%	0.237	C	C	.	.	H	α-helix	trans	-69.1	-22.2	178.4	-64.6	165.2	0	0	0	111.9	L430 I432 I492 L497 F500 F531 F538	L430-I434 HydrophobicContact CD1-CD1 4.07Å; L430-I434 HydrophobicContact CD1-CG1 4.25Å; L430-I434 HydrophobicContact CG-CD1 3.97Å; L430-I434 VanDerWaalsContact O-CG1 3.31Å; L430-I434 WeakPolarHBondContact O-CG1 3.29Å; L430-I434 PolarHBondContact O-N 3.33Å; I432-I434 VanDerWaalsContact C-N 3.29Å; I432-I434 PolarHBondContact O-N 2.88Å; I434-I492 HydrophobicContact CB-CD1 4.29Å; I434-I492 HydrophobicContact CG2-CD1 4.09Å; I434-I492 HydrophobicContact CG2-CG2 3.94Å; I434-L497 HydrophobicContact CG2-CD2 4.05Å; I434-F500 HydrophobicContact CD1-CD1 4.26Å; I434-F500 HydrophobicContact CD1-CD2 4.28Å; I434-F500 HydrophobicContact CD1-CE1 4.09Å; I434-F500 HydrophobicContact CD1-CE2 4.09Å; I434-F500 HydrophobicContact CD1-CG 4.34Å; I434-F500 HydrophobicContact CD1-CZ 3.99Å; I434-F500 HydrophobicContact CG1-CD1 4.39Å; I434-F500 HydrophobicContact CG1-CD2 3.67Å; I434-F500 HydrophobicContact CG1-CE2 3.79Å; I434-F500 HydrophobicContact CG1-CG 3.97Å; I434-F500 HydrophobicContact CG1-CZ 4.22Å; I434-F500 HydrophobicContact CG2-CB 4.04Å; I434-F500 HydrophobicContact CG2-CG 4.18Å; I434-F531 HydrophobicContact CD1-CE2 3.66Å; I434-F531 HydrophobicContact CD1-CZ 4.31Å; I434-F538 HydrophobicContact CD1-CD1 3.76Å; I434-F538 HydrophobicContact CD1-CE1 4.3Å; I434-F538 HydrophobicContact CD1-CG 4.49Å
435	G	65.7	Low	58.8	Low	22 Å²	22	55.1 Å²	55.1	23%	0.227	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	124.7	6.2	-177.8	0	0	0	0	0	114.2	I432 L433	I432-G435 PolarHBondContact O-N 2.96Å; L433-G435 PolarHBondContact O-N 3.07Å
436	G	66.6	Low	57.7	Low	4 Å²	4	51.5 Å²	51.5	4%	0.041	24%	0.243	C	C	.	.			trans	-66.9	131.8	177.1	0	0	0	0	0	112.5	F431 D438 H491	F431-G436 VanDerWaalsContact CE1-CA 3.44Å; F431-G436 VanDerWaalsContact O-CA 3.32Å; F431-G436 WeakPolarHBondContact O-CA 3.47Å; F431-G436 PolarHBondContact O-N 3.23Å; G436-D438 PolarHBondContact O-N 3.46Å; G436-H491 WeakPolarHBondContact CA-O 3.23Å
437	L	61.5	Low	56.2	Low	35 Å²	35	53.9 Å²	53.9	18%	0.183	25%	0.252	C	S	.	.			trans	-82.8	101.6	-179.6	-70.7	172.3	0	0	0	111.2	K485 N487 F489 G490 H491	L437-K485 HydrophobicContact CD1-CB 4.27Å; L437-N487 HydrophobicContact CD1-CB 4.09Å; L437-F489 HydrophobicContact CB-CD1 4.4Å; L437-G490 PolarHBondContact O-N 3.49Å; L437-H491 PolarHBondContact N-O 3.03Å
438	D	60.7	Low	54.6	Low	29 Å²	29	58.8 Å²	58.8	16%	0.155	28%	0.281	C	S	.	.			trans	-80.7	123.5	169.4	179.4	8.5	0	0	0	110.7	R428 I432 G436 K440 Q441 Y442	R428-D438 IonicContact CZ-OD1 3.23Å; R428-D438 IonicContact CZ-OD2 3.69Å; R428-D438 IonicContact NE-OD1 2.72Å; R428-D438 IonicContact NE-OD2 3.72Å; R428-D438 PolarHBondContact NE-OD2 2.73Å; R428-D438 IonicContact NH2-OD1 3.11Å; R428-D438 PolarHBondContact NH2-OD1 3.44Å; R428-D438 IonicContact NH2-OD2 3Å; R428-D438 PolarHBondContact NH2-OD2 2.71Å; I432-D438 HydrophobicContact CD1-CB 3.62Å; I432-D438 WeakPolarHBondContact CD1-OD2 3.3Å; I432-D438 HydrophobicContact CG1-CB 3.63Å; G436-D438 PolarHBondContact O-N 3.46Å; D438-K440 PolarHBondContact O-N 3.1Å; D438-K440 VanDerWaalsContact O-N 3.11Å; D438-K440 WeakPolarHBondContact OD1-CB 3.44Å; D438-K440 PolarHBondContact OD1-N 3.18Å; D438-Q441 HydrophobicContact CB-CB 4.35Å; D438-Q441 PolarHBondContact O-N 3.49Å; D438-Y442 PolarHBondContact O-N 3.44Å; D438-Y442 VanDerWaalsContact O-N 3.11Å
439	R	49.2	Very low	52.7	Low	141 Å²	141	62.5 Å²	62.5	53%	0.532	30%	0.3	S	S	.	.	H	α-helix	trans	-55.5	-31.3	178.5	-154	177.8	-162.1	174	6	112.2	W367 F443 F489	W367-R439 VanDerWaalsContact CZ3-CZ 3.46Å; R439-F443 VanDerWaalsContact O-CB 3.27Å; R439-F443 WeakPolarHBondContact O-CB 3.49Å; R439-F443 PolarHBondContact O-N 3.36Å; R439-F443 VanDerWaalsContact O-N 3.09Å; R439-F489 HydrophobicContact CB-CD1 4.2Å; R439-F489 HydrophobicContact CB-CG 4.43Å; R439-F489 HydrophobicContact CG-CD1 4.14Å; R439-F489 HydrophobicContact CG-CE1 4.47Å; R439-F489 HydrophobicContact CG-CG 4.16Å
440	K	46.9	Very low	51	Low	72 Å²	72	64.2 Å²	64.2	31%	0.313	31%	0.308	S	S	.	.	H	α-helix	trans	-68.2	-41.3	176.7	-170.9	-173.7	177.8	-168.1	0	112.2	D438 F443 Q444	D438-K440 PolarHBondContact O-N 3.1Å; D438-K440 VanDerWaalsContact O-N 3.11Å; D438-K440 WeakPolarHBondContact OD1-CB 3.44Å; D438-K440 PolarHBondContact OD1-N 3.18Å; K440-F443 PolarHBondContact O-N 2.92Å; K440-Q444 WeakPolarHBondContact O-CG 3.45Å; K440-Q444 PolarHBondContact O-N 2.98Å
441	Q	46.6	Very low	48.9	Very low	73 Å²	73	68 Å²	68	34%	0.341	33%	0.333	S	S	.	.	H	α-helix	trans	-73.8	-40.5	-177.9	-157.5	-178.4	20.4	0	0	111.1	D438 F443 Q444 Q445	D438-Q441 HydrophobicContact CB-CB 4.35Å; D438-Q441 PolarHBondContact O-N 3.49Å; Q441-F443 VanDerWaalsContact C-N 3.26Å; Q441-F443 PolarHBondContact O-N 3.09Å; Q441-Q444 PolarHBondContact O-N 3.15Å; Q441-Q445 WeakPolarHBondContact O-CB 3.11Å; Q441-Q445 WeakPolarHBondContact O-CG 3.39Å; Q441-Q445 PolarHBondContact O-N 3.05Å
442	Y	43.4	Very low	47.1	Very low	98 Å²	98	75.2 Å²	75.2	38%	0.384	37%	0.37	S	S	.	.	H	α-helix	trans	-58.2	-41.3	170.5	-179.7	-94.3	0	0	0	111.5	D438 S446 F489	D438-Y442 PolarHBondContact O-N 3.44Å; D438-Y442 VanDerWaalsContact O-N 3.11Å; Y442-S446 WeakPolarHBondContact CE1-OG 3.17Å; Y442-S446 WeakPolarHBondContact O-CB 3.44Å; Y442-S446 PolarHBondContact O-N 3.35Å; Y442-S446 PolarHBondContact O-OG 3.5Å; Y442-F489 AromaticContact CD1-CE1 3.81Å; Y442-F489 HydrophobicContact CD1-CE1 3.81Å; Y442-F489 AromaticContact CD1-CZ 3.57Å; Y442-F489 HydrophobicContact CD1-CZ 3.57Å; Y442-F489 HydrophobicContact CD2-CE1 4.08Å; Y442-F489 HydrophobicContact CD2-CZ 4.22Å; Y442-F489 AromaticContact CE1-CZ 3.89Å; Y442-F489 HydrophobicContact CE1-CZ 3.89Å; Y442-F489 HydrophobicContact CE2-CZ 4.48Å; Y442-F489 AromaticContact CG-CE1 3.55Å; Y442-F489 HydrophobicContact CG-CE1 3.55Å; Y442-F489 AromaticContact CG-CZ 3.75Å; Y442-F489 HydrophobicContact CG-CZ 3.75Å
443	F	36.9	Very low	45.4	Very low	35 Å²	35	79.4 Å²	79.4	15%	0.154	39%	0.392	C	S	.	.	H	α-helix	trans	-65.5	-44.6	177.3	-176.6	-95.7	0	0	0	112.4	W367 K368 D370 R439 K440 Q441 S446 Y447	W367-F443 WeakPolarHBondContact O-CE2 3.43Å; W367-F443 WeakPolarHBondContact O-CZ 2.99Å; K368-F443 HydrophobicContact CG-CZ 4.46Å; D370-F443 HydrophobicContact CB-CE1 4.01Å; D370-F443 HydrophobicContact CB-CZ 4.32Å; R439-F443 VanDerWaalsContact O-CB 3.27Å; R439-F443 WeakPolarHBondContact O-CB 3.49Å; R439-F443 PolarHBondContact O-N 3.36Å; R439-F443 VanDerWaalsContact O-N 3.09Å; K440-F443 PolarHBondContact O-N 2.92Å; Q441-F443 VanDerWaalsContact C-N 3.26Å; Q441-F443 PolarHBondContact O-N 3.09Å; F443-S446 PolarHBondContact O-N 3.4Å; F443-Y447 AromaticContact CD2-CD2 3.84Å; F443-Y447 HydrophobicContact CD2-CD2 3.84Å; F443-Y447 HydrophobicContact CD2-CE2 4.28Å; F443-Y447 HydrophobicContact CE2-CD2 4.05Å; F443-Y447 HydrophobicContact CE2-CE2 4.47Å; F443-Y447 HydrophobicContact CG-CD2 4.46Å; F443-Y447 WeakPolarHBondContact O-CB 3.42Å; F443-Y447 PolarHBondContact O-N 3.34Å; F443-Y447 VanDerWaalsContact O-N 3.07Å
444	Q	40.8	Very low	43.7	Very low	88 Å²	88	81.9 Å²	81.9	41%	0.411	40%	0.398	S	S	.	.	H	α-helix	trans	-62.3	-45	175.1	-72.8	176.4	-38	0	0	112.1	K440 Q441 V448	K440-Q444 WeakPolarHBondContact O-CG 3.45Å; K440-Q444 PolarHBondContact O-N 2.98Å; Q441-Q444 PolarHBondContact O-N 3.15Å; Q444-V448 VanDerWaalsContact O-CB 3.25Å; Q444-V448 WeakPolarHBondContact O-CB 3.2Å; Q444-V448 PolarHBondContact O-N 3.16Å
445	Q	38.4	Very low	41.8	Very low	89 Å²	89	88.9 Å²	88.9	42%	0.416	44%	0.435	S	S	.	.	H	α-helix	trans	-70.1	-34.9	179.2	-70.6	173.7	-7.4	0	0	112.7	Q441	Q441-Q445 WeakPolarHBondContact O-CB 3.11Å; Q441-Q445 WeakPolarHBondContact O-CG 3.39Å; Q441-Q445 PolarHBondContact O-N 3.05Å
446	S	39	Very low	40.2	Very low	43 Å²	43	98.1 Å²	98.1	30%	0.301	46%	0.463	S	S	.	.	H	α-helix	trans	-80.5	-21.3	-178.7	-58.5	0	0	0	0	114	Y442 F443	Y442-S446 WeakPolarHBondContact CE1-OG 3.17Å; Y442-S446 WeakPolarHBondContact O-CB 3.44Å; Y442-S446 PolarHBondContact O-N 3.35Å; Y442-S446 PolarHBondContact O-OG 3.5Å; F443-S446 PolarHBondContact O-N 3.4Å
447	Y	33.2	Very low	38.6	Very low	78 Å²	78	102.2 Å²	102.2	31%	0.306	49%	0.491	S	S	.	.	H	α-helix	trans	-132.7	-16.7	-168.4	-72.6	-74.6	0	0	0	116.4	K368 F443	K368-Y447 HydrophobicContact CD-CD1 3.79Å; K368-Y447 HydrophobicContact CD-CE1 4.28Å; K368-Y447 HydrophobicContact CD-CG 4.46Å; K368-Y447 VanDerWaalsContact CE-CD1 3.47Å; K368-Y447 HydrophobicContact CG-CD1 4.17Å; K368-Y447 HydrophobicContact CG-CG 4.4Å; F443-Y447 AromaticContact CD2-CD2 3.84Å; F443-Y447 HydrophobicContact CD2-CD2 3.84Å; F443-Y447 HydrophobicContact CD2-CE2 4.28Å; F443-Y447 HydrophobicContact CE2-CD2 4.05Å; F443-Y447 HydrophobicContact CE2-CE2 4.47Å; F443-Y447 HydrophobicContact CG-CD2 4.46Å; F443-Y447 WeakPolarHBondContact O-CB 3.42Å; F443-Y447 PolarHBondContact O-N 3.34Å; F443-Y447 VanDerWaalsContact O-N 3.07Å
448	V	34.6	Very low	37.3	Very low	104 Å²	104	107.8 Å²	107.8	63%	0.63	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-22.2	178	-176.4	0	0	0	0	111.9	Q444	Q444-V448 VanDerWaalsContact O-CB 3.25Å; Q444-V448 WeakPolarHBondContact O-CB 3.2Å; Q444-V448 PolarHBondContact O-N 3.16Å
449	F	28.3	Very low	36.1	Very low	162 Å²	162	114.2 Å²	114.2	71%	0.711	55%	0.55	S	S	*	.			trans	-106.1	17.7	178.2	-75.1	-80.5	0	0	0	114.3	P451	F449-P451 WeakPolarHBondContact O-CD 3.45Å; F449-P451 VanDerWaalsContact O-N 3.08Å
450	E	29.3	Very low	35.2	Very low	111 Å²	111	114 Å²	114	52%	0.519	56%	0.564	S	S	.	*			trans	-66.1	106.1	159.7	-124.2	-172.6	169.4	0	0	105.7	K454	E450-K454 IonicContact OE1-NZ 3.89Å; E450-K454 PolarHBondContact OE1-NZ 3.28Å
451	P	28.7	Very low	34.6	Very low	80 Å²	80	116.2 Å²	116.2	52%	0.519	58%	0.584	S	S	.	*			trans	-66	157.2	-179.4	-7.8	25.8	0	0	0	107.4	F449 I453	F449-P451 WeakPolarHBondContact O-CD 3.45Å; F449-P451 VanDerWaalsContact O-N 3.08Å; P451-I453 HydrophobicContact CB-CD1 3.75Å; P451-I453 HydrophobicContact CB-CG1 3.97Å; P451-I453 HydrophobicContact CG-CD1 4.04Å; P451-I453 PolarHBondContact O-N 3.29Å
452	I	31.8	Very low	33.9	Very low	158 Å²	158	119.5 Å²	119.5	81%	0.81	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-56.1	22.3	177.5	-69.4	158.4	0	0	0	113.9
453	I	30.7	Very low	33.4	Very low	129 Å²	129	122.3 Å²	122.3	66%	0.662	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-85.3	-16	-172.1	-63.2	169.1	0	0	0	112.9	P451 L455	P451-I453 HydrophobicContact CB-CD1 3.75Å; P451-I453 HydrophobicContact CB-CG1 3.97Å; P451-I453 HydrophobicContact CG-CD1 4.04Å; P451-I453 PolarHBondContact O-N 3.29Å; I453-L455 VanDerWaalsContact C-N 3.31Å; I453-L455 PolarHBondContact O-N 3.41Å
454	K	33.5	Very low	33.3	Very low	155 Å²	155	128.3 Å²	128.3	67%	0.674	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-81.7	4.4	178.5	-95	178.6	-173.8	161.4	0	116.3	E450	E450-K454 IonicContact OE1-NZ 3.89Å; E450-K454 PolarHBondContact OE1-NZ 3.28Å
455	L	32.5	Very low	33.1	Very low	161 Å²	161	129.8 Å²	129.8	84%	0.843	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-103.7	-1.1	179.1	-85.5	157.1	0	0	0	114.5	I453	I453-L455 VanDerWaalsContact C-N 3.31Å; I453-L455 PolarHBondContact O-N 3.41Å
456	R	30.9	Very low	33.1	Very low	216 Å²	216	131.3 Å²	131.3	82%	0.815	69%	0.687	S	S	*	*	S	Bend	trans	-112.2	-3.6	-179	-137	179.6	-168.9	-174.2	2.7	115.4	N458	R456-N458 VanDerWaalsContact C-N 3.33Å; R456-N458 PolarHBondContact O-N 3.04Å
457	S	33.6	Very low	33.3	Very low	90 Å²	90	136 Å²	136	63%	0.629	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	14.7	-174.4	63.9	0	0	0	0	115.2
458	N	33.6	Very low	33.7	Very low	151 Å²	151	138.8 Å²	138.8	81%	0.807	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	7.2	177.3	-72.4	-2.9	0	0	0	113.3	R456	R456-N458 VanDerWaalsContact C-N 3.33Å; R456-N458 PolarHBondContact O-N 3.04Å
459	E	35.8	Very low	33.5	Very low	164 Å²	164	137.9 Å²	137.9	77%	0.766	74%	0.74	S	S	*	*	S	Bend	trans	-101.1	105.4	170.1	-73.6	179.6	173.1	0	0	109.1	T461	E459-T461 PolarHBondContact O-N 3.39Å
460	T	30.7	Very low	33.7	Very low	137 Å²	137	135.2 Å²	135.2	84%	0.84	73%	0.734	S	S	*	*			trans	-47.8	108.1	166.5	12.2	0	0	0	0	111.4
461	T	34.8	Very low	33.8	Very low	119 Å²	119	135.3 Å²	135.3	73%	0.73	74%	0.744	S	S	*	*			trans	-145	106.6	149.6	51.6	0	0	0	0	110.3	E459	E459-T461 PolarHBondContact O-N 3.39Å
462	N	32.4	Very low	34	Very low	142 Å²	142	134.4 Å²	134.4	76%	0.759	74%	0.743	S	S	*	*			trans	-50.1	150.3	157.8	-63	-39.8	0	0	0	110.4
463	N	32.4	Very low	34	Very low	157 Å²	157	131.5 Å²	131.5	84%	0.84	74%	0.737	S	S	*	*			trans	74.2	81.7	164.2	-52.2	-20	0	0	0	116.6
464	L	34.9	Very low	33.9	Very low	160 Å²	160	129.6 Å²	129.6	84%	0.838	74%	0.735	S	S	*	*			trans	-129.5	122.8	152.2	-87.4	152.7	0	0	0	108.6
465	N	36.3	Very low	33.7	Very low	120 Å²	120	128.5 Å²	128.5	64%	0.642	74%	0.735	S	S	*	*			trans	-68.6	141.6	-169.5	-132.4	-7.6	0	0	0	110.6	N467	N465-N467 PolarHBondContact O-N 2.82Å
466	P	38.5	Very low	33.4	Very low	121 Å²	121	124.6 Å²	124.6	79%	0.786	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	5.1	-176.1	-14.1	29	0	0	0	115.7
467	N	43.3	Very low	33.2	Very low	141 Å²	141	124.1 Å²	124.1	75%	0.754	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	1.7	-168.1	-70.5	-17.7	0	0	0	114.6	N465	N465-N467 PolarHBondContact O-N 2.82Å
468	D	41.6	Very low	33	Very low	136 Å²	136	129.5 Å²	129.5	73%	0.727	73%	0.733	S	S	*	*	S	Bend	trans	-96.4	110.8	175.3	-73.1	-35	0	0	0	110	D470	D468-D470 PolarHBondContact O-N 2.84Å
469	G	30.3	Very low	32.8	Very low	85 Å²	85	127 Å²	127	88%	0.876	72%	0.719	S	S	*	*			trans	-66.6	120.7	-177.6	0	0	0	0	0	112.9
470	D	31.9	Very low	32.8	Very low	106 Å²	106	128.6 Å²	128.6	57%	0.567	72%	0.724	S	S	*	*			trans	-128	109.1	157.8	-159.6	-7.1	0	0	0	109	D468 A472 S473	D468-D470 PolarHBondContact O-N 2.84Å; D470-A472 PolarHBondContact O-N 2.92Å; D470-S473 PolarHBondContact O-N 3.43Å; D470-S473 VanDerWaalsContact O-N 3.15Å; D470-S473 PolarHBondContact O-OG 3.39Å; D470-S473 VanDerWaalsContact O-OG 3.04Å
471	P	32.4	Very low	32.8	Very low	113 Å²	113	125.3 Å²	125.3	73%	0.734	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-0.8	-179.5	25.6	-32.1	0	0	0	113.6	S474	P471-S474 PolarHBondContact O-OG 3.02Å
472	A	32.7	Very low	32.8	Very low	61 Å²	61	124.8 Å²	124.8	50%	0.504	70%	0.703	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.9	-15.9	172.6	0	0	0	0	0	114.2	D470	D470-A472 PolarHBondContact O-N 2.92Å
473	S	30.8	Very low	32.9	Very low	97 Å²	97	123.8 Å²	123.8	68%	0.678	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-4.1	179.2	62.3	0	0	0	0	114.3	D470 I475	D470-S473 PolarHBondContact O-N 3.43Å; D470-S473 VanDerWaalsContact O-N 3.15Å; D470-S473 PolarHBondContact O-OG 3.39Å; D470-S473 VanDerWaalsContact O-OG 3.04Å; S473-I475 VanDerWaalsContact C-N 3.32Å
474	S	28.9	Very low	33	Very low	90 Å²	90	124.6 Å²	124.6	63%	0.629	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	14	175.8	67	0	0	0	0	113.7	P471 C476	P471-S474 PolarHBondContact O-OG 3.02Å; S474-C476 VanDerWaalsContact C-N 3.29Å; S474-C476 PolarHBondContact O-N 3.03Å
475	I	28.7	Very low	33.5	Very low	132 Å²	132	121.1 Å²	121.1	68%	0.677	67%	0.669	S	S	*	*	S	Bend	trans	-67.4	95.7	170.9	-62.8	174.4	0	0	0	107.8	S473 F477	S473-I475 VanDerWaalsContact C-N 3.32Å; I475-F477 PolarHBondContact O-N 3.07Å
476	C	27.6	Very low	34	Very low	79 Å²	79	120.9 Å²	120.9	53%	0.534	68%	0.677	S	S	.	*			trans	5.3	105.7	168.6	-61.5	0	0	0	0	114	S474 Y478	S474-C476 VanDerWaalsContact C-N 3.29Å; S474-C476 PolarHBondContact O-N 3.03Å; C476-Y478 VanDerWaalsContact C-N 3.26Å; C476-Y478 HydrophobicContact CB-CE2 4.48Å; C476-Y478 WeakPolarHBondContact O-CD2 3.16Å; C476-Y478 PolarHBondContact O-N 3.46Å
477	F	26.3	Very low	34.7	Very low	205 Å²	205	116 Å²	116	90%	0.899	64%	0.644	S	S	*	*			trans	-50.4	98.2	154.7	-85.2	-92.2	0	0	0	108	I475 N479	I475-F477 PolarHBondContact O-N 3.07Å; F477-N479 PolarHBondContact O-N 2.89Å
478	Y	28.6	Very low	35.4	Very low	203 Å²	203	112.7 Å²	112.7	80%	0.796	63%	0.63	S	S	*	*			trans	-66.5	91.3	168.9	-80.9	-83.6	0	0	0	106.8	C476 K480	C476-Y478 VanDerWaalsContact C-N 3.26Å; C476-Y478 HydrophobicContact CB-CE2 4.48Å; C476-Y478 WeakPolarHBondContact O-CD2 3.16Å; C476-Y478 PolarHBondContact O-N 3.46Å; Y478-K480 PolarHBondContact O-N 3.05Å
479	N	30	Very low	36.5	Very low	99 Å²	99	110.1 Å²	110.1	53%	0.529	61%	0.613	S	S	.	*			trans	-66.1	109.9	-177.7	-145.7	-11.3	0	0	0	107.5	F477 S481 T482	F477-N479 PolarHBondContact O-N 2.89Å; N479-S481 PolarHBondContact ND2-OG 3.3Å; N479-S481 PolarHBondContact O-N 3.16Å; N479-S481 PolarHBondContact OD1-OG 3.26Å; N479-T482 PolarHBondContact O-N 3.18Å; N479-T482 PolarHBondContact O-OG1 3.26Å
480	K	34.7	Very low	38.2	Very low	197 Å²	197	107.2 Å²	107.2	86%	0.857	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-58.5	-17.5	-180	-160.3	174	-176.1	177.7	0	112.2	Y478	Y478-K480 PolarHBondContact O-N 3.05Å
481	S	31.8	Very low	40.3	Very low	69 Å²	69	104 Å²	104	48%	0.483	56%	0.564	S	S	.	*	G	3₁₀ helix	trans	-72.4	-27	174	53.4	0	0	0	0	114.1	N479 F483 Q484	N479-S481 PolarHBondContact ND2-OG 3.3Å; N479-S481 PolarHBondContact O-N 3.16Å; N479-S481 PolarHBondContact OD1-OG 3.26Å; S481-F483 PolarHBondContact O-N 3.3Å; S481-Q484 PolarHBondContact O-N 3.46Å
482	T	34.3	Very low	42.4	Very low	107 Å²	107	98.7 Å²	98.7	66%	0.656	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-70.4	-15.6	-177.5	1.8	0	0	0	0	114.1	N479	N479-T482 PolarHBondContact O-N 3.18Å; N479-T482 PolarHBondContact O-OG1 3.26Å
483	F	35.1	Very low	44.8	Very low	122 Å²	122	96.8 Å²	96.8	54%	0.535	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-107.1	9.3	-179.4	-93.2	-83.5	0	0	0	114.8	S481 K485	S481-F483 PolarHBondContact O-N 3.3Å; F483-K485 PolarHBondContact O-N 3.33Å
484	Q	35.3	Very low	47.4	Very low	173 Å²	173	93 Å²	93	81%	0.808	48%	0.483	S	S	*	.			trans	-73	62	160.7	-87.5	-177.7	-20.7	0	0	110.1	S481 S486	S481-Q484 PolarHBondContact O-N 3.46Å; Q484-S486 PolarHBondContact O-N 2.68Å
485	K	45.3	Very low	49.8	Very low	88 Å²	88	94.1 Å²	94.1	38%	0.383	48%	0.477	S	S	.	.			trans	-68.1	124	157.2	-87.8	-165.9	173	-162.9	0	106.1	L437 F483 N487 E493 D496	L437-K485 HydrophobicContact CD1-CB 4.27Å; F483-K485 PolarHBondContact O-N 3.33Å; K485-N487 PolarHBondContact O-N 3.49Å; K485-E493 IonicContact NZ-OE2 3.95Å; K485-D496 IonicContact NZ-OD2 3.89Å; K485-D496 PolarHBondContact NZ-OD2 2.87Å; K485-D496 VanDerWaalsContact NZ-OD2 3.07Å
486	S	44.9	Very low	52.1	Low	114 Å²	114	89.4 Å²	89.4	80%	0.797	45%	0.453	S	S	*	.			trans	-62.6	0.2	178.1	48.5	0	0	0	0	114.4	Q484	Q484-S486 PolarHBondContact O-N 2.68Å
487	N	54.2	Low	54.7	Low	20 Å²	20	85.7 Å²	85.7	11%	0.107	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-85.4	137.9	-168.2	-53.1	-20.4	0	0	0	111.7	L437 K485 E493	L437-N487 HydrophobicContact CD1-CB 4.09Å; K485-N487 PolarHBondContact O-N 3.49Å; N487-E493 VanDerWaalsContact CG-CD 3.43Å; N487-E493 WeakPolarHBondContact ND2-CG 3.45Å; N487-E493 PolarHBondContact ND2-OE2 2.87Å; N487-E493 VanDerWaalsContact OD1-CD 3.24Å; N487-E493 WeakPolarHBondContact OD1-CG 3.33Å; N487-E493 PolarHBondContact OD1-OE1 3.38Å
488	P	57.6	Low	57.3	Low	70 Å²	70	78.9 Å²	78.9	46%	0.455	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-63.1	140.3	170.5	22.9	-27.8	0	0	0	111	H491	P488-H491 HydrophobicContact CG-CB 4.41Å; P488-H491 WeakPolarHBondContact O-CB 3.07Å; P488-H491 PolarHBondContact O-N 3.42Å; P488-H491 PolarHBondContact O-ND1 3.43Å; P488-H491 VanDerWaalsContact O-ND1 3.12Å
489	F	64.6	Low	59.5	Low	83 Å²	83	73 Å²	73	36%	0.364	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	145.8	172.3	-68.9	-72.7	0	0	0	111.7	L437 R439 Y442 H491	L437-F489 HydrophobicContact CB-CD1 4.4Å; R439-F489 HydrophobicContact CB-CD1 4.2Å; R439-F489 HydrophobicContact CB-CG 4.43Å; R439-F489 HydrophobicContact CG-CD1 4.14Å; R439-F489 HydrophobicContact CG-CE1 4.47Å; R439-F489 HydrophobicContact CG-CG 4.16Å; Y442-F489 AromaticContact CD1-CE1 3.81Å; Y442-F489 HydrophobicContact CD1-CE1 3.81Å; Y442-F489 AromaticContact CD1-CZ 3.57Å; Y442-F489 HydrophobicContact CD1-CZ 3.57Å; Y442-F489 HydrophobicContact CD2-CE1 4.08Å; Y442-F489 HydrophobicContact CD2-CZ 4.22Å; Y442-F489 AromaticContact CE1-CZ 3.89Å; Y442-F489 HydrophobicContact CE1-CZ 3.89Å; Y442-F489 HydrophobicContact CE2-CZ 4.48Å; Y442-F489 AromaticContact CG-CE1 3.55Å; Y442-F489 HydrophobicContact CG-CE1 3.55Å; Y442-F489 AromaticContact CG-CZ 3.75Å; Y442-F489 HydrophobicContact CG-CZ 3.75Å; F489-H491 VanDerWaalsContact C-N 3.35Å; F489-H491 PolarHBondContact O-ND1 3.33Å
490	G	66.7	Low	61.8	Low	24 Å²	24	69.2 Å²	69.2	25%	0.247	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	21.6	-179.4	0	0	0	0	0	114.3	L437 D527 F528	L437-G490 PolarHBondContact O-N 3.49Å; G490-D527 CarbonylContact O-C 3.57Å; G490-D527 WeakPolarHBondContact O-CA 3.45Å; G490-F528 PolarHBondContact O-N 3.43Å
491	H	75.7	Confident	64	Low	39 Å²	39	59.8 Å²	59.8	18%	0.181	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	151.3	176.3	-60.2	69	0	0	0	111.6	G436 L437 P488 F489 T525 I526	G436-H491 WeakPolarHBondContact CA-O 3.23Å; L437-H491 PolarHBondContact N-O 3.03Å; P488-H491 HydrophobicContact CG-CB 4.41Å; P488-H491 WeakPolarHBondContact O-CB 3.07Å; P488-H491 PolarHBondContact O-N 3.42Å; P488-H491 PolarHBondContact O-ND1 3.43Å; P488-H491 VanDerWaalsContact O-ND1 3.12Å; F489-H491 VanDerWaalsContact C-N 3.35Å; F489-H491 PolarHBondContact O-ND1 3.33Å; H491-T525 HydrophobicContact CB-CG2 4.48Å; H491-I526 CarbonylContact C-O 3.58Å; H491-I526 WeakPolarHBondContact CA-O 3.4Å
492	I	76.7	Confident	66.1	Low	0 Å²	0	59 Å²	59	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	136.7	167.2	-53.7	168	0	0	0	107.9	F431 I434 D496 L497 T525 I526 F531	F431-I492 HydrophobicContact CD2-CD1 3.34Å; F431-I492 HydrophobicContact CD2-CG1 3.71Å; F431-I492 HydrophobicContact CE1-CG1 4.32Å; F431-I492 HydrophobicContact CE2-CD1 3.44Å; F431-I492 VanDerWaalsContact CE2-CD1 3.44Å; F431-I492 HydrophobicContact CE2-CG1 3.34Å; F431-I492 HydrophobicContact CG-CD1 4.14Å; F431-I492 HydrophobicContact CG-CG1 4.37Å; F431-I492 HydrophobicContact CZ-CD1 4.26Å; F431-I492 HydrophobicContact CZ-CG1 3.67Å; I434-I492 HydrophobicContact CB-CD1 4.29Å; I434-I492 HydrophobicContact CG2-CD1 4.09Å; I434-I492 HydrophobicContact CG2-CG2 3.94Å; I492-D496 HydrophobicContact CG2-CB 4.08Å; I492-L497 HydrophobicContact CB-CD1 4.12Å; I492-L497 HydrophobicContact CB-CG 4.24Å; I492-L497 HydrophobicContact CD1-CD2 4.21Å; I492-L497 HydrophobicContact CG2-CD1 3.93Å; I492-L497 HydrophobicContact CG2-CD2 4.07Å; I492-L497 HydrophobicContact CG2-CG 3.6Å; I492-T525 CarbonylContact O-C 3.49Å; I492-T525 WeakPolarHBondContact O-CA 3.36Å; I492-T525 WeakPolarHBondContact O-CB 3.42Å; I492-I526 PolarHBondContact N-O 3.14Å; I492-I526 PolarHBondContact O-N 3.36Å; I492-F531 HydrophobicContact CD1-CD2 3.92Å; I492-F531 HydrophobicContact CD1-CE2 4.37Å
493	E	82.6	Confident	67.7	Low	22 Å²	22	55 Å²	55	10%	0.103	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	143.3	171.3	-83	170.2	122.1	0	0	112.2	K485 N487 K495 D496 L497 T525	K485-E493 IonicContact NZ-OE2 3.95Å; N487-E493 VanDerWaalsContact CG-CD 3.43Å; N487-E493 WeakPolarHBondContact ND2-CG 3.45Å; N487-E493 PolarHBondContact ND2-OE2 2.87Å; N487-E493 VanDerWaalsContact OD1-CD 3.24Å; N487-E493 WeakPolarHBondContact OD1-CG 3.33Å; N487-E493 PolarHBondContact OD1-OE1 3.38Å; E493-K495 HydrophobicContact CB-CG 3.76Å; E493-K495 PolarHBondContact O-N 3Å; E493-K495 VanDerWaalsContact O-N 3.15Å; E493-K495 WeakPolarHBondContact OE1-CE 3.13Å; E493-K495 IonicContact OE1-NZ 2.68Å; E493-K495 PolarHBondContact OE1-NZ 3.19Å; E493-K495 WeakPolarHBondContact OE2-CE 3.33Å; E493-K495 IonicContact OE2-NZ 2.86Å; E493-K495 PolarHBondContact OE2-NZ 3.2Å; E493-D496 PolarHBondContact O-N 3.38Å; E493-L497 PolarHBondContact O-N 2.96Å; E493-L497 VanDerWaalsContact O-N 3.09Å; E493-T525 HydrophobicContact CG-CG2 4.33Å
494	V	85.4	Confident	69.6	Low	18 Å²	18	49.5 Å²	49.5	11%	0.109	26%	0.264	C	S	.	.	H	α-helix	trans	-54.7	-33.7	174	164.2	0	0	0	0	112.3	L497 K498 I515 D519 G524	V494-L497 PolarHBondContact O-N 2.68Å; V494-K498 HydrophobicContact CG1-CD 4.31Å; V494-K498 HydrophobicContact CG1-CG 4.42Å; V494-K498 WeakPolarHBondContact O-CG 3.4Å; V494-K498 PolarHBondContact O-N 3.18Å; V494-I515 HydrophobicContact CB-CG2 4.48Å; V494-I515 HydrophobicContact CG1-CD1 4.16Å; V494-I515 HydrophobicContact CG1-CG1 4.35Å; V494-I515 HydrophobicContact CG1-CG2 3.48Å; V494-I515 VanDerWaalsContact CG1-CG2 3.48Å; V494-I515 HydrophobicContact CG2-CG2 4.15Å; V494-D519 HydrophobicContact CG2-CB 4.05Å; V494-G524 VanDerWaalsContact CG2-C 3.49Å; V494-G524 WeakPolarHBondContact CG2-O 3.26Å; V494-G524 PolarHBondContact N-O 3.29Å
495	K	79.6	Confident	71.4	Confident	113 Å²	113	45.5 Å²	45.5	49%	0.491	25%	0.248	S	C	.	.	H	α-helix	trans	-62.9	-42.5	175.2	59.4	172.9	-163.3	-131.7	0	112.4	E493 L497 K498 V499	E493-K495 HydrophobicContact CB-CG 3.76Å; E493-K495 PolarHBondContact O-N 3Å; E493-K495 VanDerWaalsContact O-N 3.15Å; E493-K495 WeakPolarHBondContact OE1-CE 3.13Å; E493-K495 IonicContact OE1-NZ 2.68Å; E493-K495 PolarHBondContact OE1-NZ 3.19Å; E493-K495 WeakPolarHBondContact OE2-CE 3.33Å; E493-K495 IonicContact OE2-NZ 2.86Å; E493-K495 PolarHBondContact OE2-NZ 3.2Å; K495-L497 VanDerWaalsContact C-N 3.32Å; K495-K498 PolarHBondContact O-N 2.98Å; K495-V499 WeakPolarHBondContact O-CG2 3.2Å; K495-V499 PolarHBondContact O-N 2.81Å
496	D	77.6	Confident	73	Confident	33 Å²	33	43 Å²	43	18%	0.176	24%	0.239	C	C	.	.	H	α-helix	trans	-69.4	-36.9	-179.4	-64.6	-20.1	0	0	0	109.4	K485 I492 E493 V499 F500	K485-D496 IonicContact NZ-OD2 3.89Å; K485-D496 PolarHBondContact NZ-OD2 2.87Å; K485-D496 VanDerWaalsContact NZ-OD2 3.07Å; I492-D496 HydrophobicContact CG2-CB 4.08Å; E493-D496 PolarHBondContact O-N 3.38Å; D496-V499 PolarHBondContact O-N 2.86Å; D496-F500 PolarHBondContact O-N 2.89Å
497	L	82.7	Confident	74.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.5	-41.8	174	-70.3	151.7	0	0	0	113.2	I434 I492 E493 V494 K495 V499 F500 F501 I515 I526 F538	I434-L497 HydrophobicContact CG2-CD2 4.05Å; I492-L497 HydrophobicContact CB-CD1 4.12Å; I492-L497 HydrophobicContact CB-CG 4.24Å; I492-L497 HydrophobicContact CD1-CD2 4.21Å; I492-L497 HydrophobicContact CG2-CD1 3.93Å; I492-L497 HydrophobicContact CG2-CD2 4.07Å; I492-L497 HydrophobicContact CG2-CG 3.6Å; E493-L497 PolarHBondContact O-N 2.96Å; E493-L497 VanDerWaalsContact O-N 3.09Å; V494-L497 PolarHBondContact O-N 2.68Å; K495-L497 VanDerWaalsContact C-N 3.32Å; L497-V499 VanDerWaalsContact C-N 3.34Å; L497-V499 PolarHBondContact O-N 3.41Å; L497-F500 WeakPolarHBondContact O-CB 3.27Å; L497-F500 PolarHBondContact O-N 2.87Å; L497-F501 HydrophobicContact CB-CD2 4.43Å; L497-F501 HydrophobicContact CB-CE2 4.11Å; L497-F501 HydrophobicContact CD2-CE2 4.24Å; L497-F501 HydrophobicContact CD2-CZ 4.5Å; L497-F501 WeakPolarHBondContact O-CD2 3.24Å; L497-F501 WeakPolarHBondContact O-CG 3.29Å; L497-F501 PolarHBondContact O-N 2.92Å; L497-I515 HydrophobicContact CB-CD1 3.83Å; L497-I526 HydrophobicContact CD1-CB 4.18Å; L497-I526 HydrophobicContact CD1-CD1 3.17Å; L497-I526 HydrophobicContact CD1-CG1 3.53Å; L497-I526 HydrophobicContact CD2-CD1 4.01Å; L497-I526 HydrophobicContact CG-CD1 4.19Å; L497-F538 HydrophobicContact CD2-CE1 3.53Å; L497-F538 HydrophobicContact CD2-CZ 3.94Å
498	K	79.9	Confident	75.7	Confident	62 Å²	62	46.1 Å²	46.1	27%	0.27	25%	0.246	S	C	.	.	H	α-helix	trans	-59.7	-46.4	176	-76.8	178.6	177.4	-170.6	0	111	V494 K495 F500 F501 H502 V511 I515	V494-K498 HydrophobicContact CG1-CD 4.31Å; V494-K498 HydrophobicContact CG1-CG 4.42Å; V494-K498 WeakPolarHBondContact O-CG 3.4Å; V494-K498 PolarHBondContact O-N 3.18Å; K495-K498 PolarHBondContact O-N 2.98Å; K498-F500 VanDerWaalsContact C-N 3.3Å; K498-F500 PolarHBondContact O-N 3.44Å; K498-F501 PolarHBondContact O-N 3.26Å; K498-H502 WeakPolarHBondContact O-CB 3.4Å; K498-H502 PolarHBondContact O-CD2 2.88Å; K498-H502 PolarHBondContact O-N 3.46Å; K498-V511 HydrophobicContact CB-CG1 4.43Å; K498-V511 HydrophobicContact CG-CG1 3.96Å; K498-I515 HydrophobicContact CG-CD1 4.33Å; K498-I515 HydrophobicContact CG-CG1 4.05Å
499	V	75.4	Confident	76.9	Confident	81 Å²	81	47.3 Å²	47.3	49%	0.491	25%	0.252	S	S	.	.	H	α-helix	trans	-57.2	-46.8	175.5	173.9	0	0	0	0	110.4	K495 D496 L497 F501 H502 A503 V558	K495-V499 WeakPolarHBondContact O-CG2 3.2Å; K495-V499 PolarHBondContact O-N 2.81Å; D496-V499 PolarHBondContact O-N 2.86Å; L497-V499 VanDerWaalsContact C-N 3.34Å; L497-V499 PolarHBondContact O-N 3.41Å; V499-F501 PolarHBondContact O-N 3.12Å; V499-H502 PolarHBondContact O-N 2.94Å; V499-A503 WeakPolarHBondContact O-CB 3.44Å; V499-A503 PolarHBondContact O-N 2.87Å; V499-V558 HydrophobicContact CG2-CG1 4.28Å
500	F	78.5	Confident	77.7	Confident	18 Å²	18	48.5 Å²	48.5	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-58.8	-47.3	177.7	174.6	-101	0	0	0	112.9	I434 D496 L497 K498 A503 A504 F538 H542 I545	I434-F500 HydrophobicContact CD1-CD1 4.26Å; I434-F500 HydrophobicContact CD1-CD2 4.28Å; I434-F500 HydrophobicContact CD1-CE1 4.09Å; I434-F500 HydrophobicContact CD1-CE2 4.09Å; I434-F500 HydrophobicContact CD1-CG 4.34Å; I434-F500 HydrophobicContact CD1-CZ 3.99Å; I434-F500 HydrophobicContact CG1-CD1 4.39Å; I434-F500 HydrophobicContact CG1-CD2 3.67Å; I434-F500 HydrophobicContact CG1-CE2 3.79Å; I434-F500 HydrophobicContact CG1-CG 3.97Å; I434-F500 HydrophobicContact CG1-CZ 4.22Å; I434-F500 HydrophobicContact CG2-CB 4.04Å; I434-F500 HydrophobicContact CG2-CG 4.18Å; D496-F500 PolarHBondContact O-N 2.89Å; L497-F500 WeakPolarHBondContact O-CB 3.27Å; L497-F500 PolarHBondContact O-N 2.87Å; K498-F500 VanDerWaalsContact C-N 3.3Å; K498-F500 PolarHBondContact O-N 3.44Å; F500-A503 WeakPolarHBondContact O-CB 3.47Å; F500-A503 PolarHBondContact O-N 2.87Å; F500-A504 PolarHBondContact O-N 2.86Å; F500-F538 HydrophobicContact CD1-CD1 4.33Å; F500-F538 AromaticContact CE1-CD1 3.81Å; F500-F538 HydrophobicContact CE1-CD1 3.81Å; F500-H542 HydrophobicContact CE2-CB 4.23Å; F500-H542 HydrophobicContact CZ-CB 4.02Å; F500-I545 HydrophobicContact CD2-CD1 3.71Å; F500-I545 HydrophobicContact CE2-CD1 3.55Å; F500-I545 HydrophobicContact CZ-CD1 4.26Å
501	F	81.3	Confident	78.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-71.8	-33.6	-180	-65.4	-51	0	0	0	113.5	L497 K498 V499 A503 A504 N505 I506 V511 L514 I515 L518 F537 F538	L497-F501 HydrophobicContact CB-CD2 4.43Å; L497-F501 HydrophobicContact CB-CE2 4.11Å; L497-F501 HydrophobicContact CD2-CE2 4.24Å; L497-F501 HydrophobicContact CD2-CZ 4.5Å; L497-F501 WeakPolarHBondContact O-CD2 3.24Å; L497-F501 WeakPolarHBondContact O-CG 3.29Å; L497-F501 PolarHBondContact O-N 2.92Å; K498-F501 PolarHBondContact O-N 3.26Å; V499-F501 PolarHBondContact O-N 3.12Å; F501-A503 VanDerWaalsContact C-N 3.34Å; F501-A504 CarbonylContact O-C 3.5Å; F501-A504 PolarHBondContact O-N 3.03Å; F501-N505 PolarHBondContact O-N 3.08Å; F501-I506 HydrophobicContact CB-CB 4.4Å; F501-I506 HydrophobicContact CB-CD1 4.07Å; F501-I506 HydrophobicContact CD1-CD1 3.72Å; F501-I506 HydrophobicContact CG-CD1 4.23Å; F501-I506 WeakPolarHBondContact O-CB 3.5Å; F501-I506 PolarHBondContact O-N 3.49Å; F501-I506 VanDerWaalsContact O-N 3.13Å; F501-V511 HydrophobicContact CB-CG1 4.33Å; F501-V511 HydrophobicContact CB-CG2 3.72Å; F501-L514 HydrophobicContact CD1-CD2 4.12Å; F501-L514 HydrophobicContact CD2-CD2 3.65Å; F501-L514 HydrophobicContact CE1-CD2 3.72Å; F501-L514 HydrophobicContact CE2-CD2 3.19Å; F501-L514 HydrophobicContact CG-CD2 4.1Å; F501-L514 HydrophobicContact CZ-CD2 3.22Å; F501-I515 HydrophobicContact CD2-CD1 4.37Å; F501-I515 HydrophobicContact CE2-CD1 4.23Å; F501-L518 HydrophobicContact CE2-CD1 4.06Å; F501-L518 HydrophobicContact CZ-CD1 4.12Å; F501-F537 AromaticContact CD1-CE1 3.88Å; F501-F537 HydrophobicContact CD1-CE1 3.88Å; F501-F537 AromaticContact CE1-CD1 3.8Å; F501-F537 HydrophobicContact CE1-CD1 3.8Å; F501-F537 AromaticContact CE1-CE1 3.33Å; F501-F537 HydrophobicContact CE1-CE1 3.33Å; F501-F537 HydrophobicContact CE1-CZ 4.46Å; F501-F537 HydrophobicContact CZ-CD1 4.21Å; F501-F537 AromaticContact CZ-CE1 3.89Å; F501-F537 HydrophobicContact CZ-CE1 3.89Å; F501-F538 HydrophobicContact CE1-CD1 4.13Å; F501-F538 HydrophobicContact CE1-CE1 4.03Å; F501-F538 HydrophobicContact CE2-CE1 4.3Å; F501-F538 AromaticContact CZ-CD1 3.98Å; F501-F538 HydrophobicContact CZ-CD1 3.98Å; F501-F538 AromaticContact CZ-CE1 3.4Å; F501-F538 HydrophobicContact CZ-CE1 3.4Å; F501-F538 VanDerWaalsContact CZ-CE1 3.4Å; F501-F538 HydrophobicContact CZ-CZ 4.04Å
502	H	75.5	Confident	78.8	Confident	53 Å²	53	50 Å²	50	25%	0.245	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-41.1	170.8	-74	-50.4	0	0	0	111.4	K498 V499 A504 N505 N552	K498-H502 WeakPolarHBondContact O-CB 3.4Å; K498-H502 PolarHBondContact O-CD2 2.88Å; K498-H502 PolarHBondContact O-N 3.46Å; V499-H502 PolarHBondContact O-N 2.94Å; H502-A504 PolarHBondContact O-N 3.02Å; H502-N505 WeakPolarHBondContact O-CA 3.31Å; H502-N505 PolarHBondContact O-N 2.84Å; H502-N552 PolarHBondContact O-OD1 2.8Å
503	A	68.2	Low	79.2	Confident	21 Å²	21	55.8 Å²	55.8	17%	0.174	29%	0.286	C	S	.	.	H	α-helix	trans	-61.8	-32.9	173.9	0	0	0	0	0	112.2	V499 F500 F501 N505 I545 N552	V499-A503 WeakPolarHBondContact O-CB 3.44Å; V499-A503 PolarHBondContact O-N 2.87Å; F500-A503 WeakPolarHBondContact O-CB 3.47Å; F500-A503 PolarHBondContact O-N 2.87Å; F501-A503 VanDerWaalsContact C-N 3.34Å; A503-N505 PolarHBondContact O-N 3.36Å; A503-I545 HydrophobicContact CB-CD1 3.96Å; A503-I545 HydrophobicContact CB-CG1 4.12Å; A503-N552 PolarHBondContact O-ND2 2.91Å
504	A	73.7	Confident	79.3	Confident	8 Å²	8	56 Å²	56	7%	0.066	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	7.2	173.3	0	0	0	0	0	114.2	F500 F501 H502 I506 S541 I545	F500-A504 PolarHBondContact O-N 2.86Å; F501-A504 CarbonylContact O-C 3.5Å; F501-A504 PolarHBondContact O-N 3.03Å; H502-A504 PolarHBondContact O-N 3.02Å; A504-I506 VanDerWaalsContact C-N 3.3Å; A504-I506 HydrophobicContact CB-CD1 4.38Å; A504-I506 HydrophobicContact CB-CG1 4.19Å; A504-I506 PolarHBondContact O-N 3.26Å; A504-S541 WeakPolarHBondContact CB-O 3.24Å; A504-I545 HydrophobicContact CB-CD1 4.19Å; A504-I545 HydrophobicContact CB-CG1 3.91Å
505	N	73.8	Confident	79.4	Confident	89 Å²	89	55.9 Å²	55.9	48%	0.476	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	62	31.7	179.7	-158.3	29.5	0	0	0	114.2	F501 H502 A503	F501-N505 PolarHBondContact O-N 3.08Å; H502-N505 WeakPolarHBondContact O-CA 3.31Å; H502-N505 PolarHBondContact O-N 2.84Å; A503-N505 PolarHBondContact O-N 3.36Å
506	I	78.3	Confident	79.6	Confident	36 Å²	36	55 Å²	55	19%	0.185	29%	0.29	C	S	.	.			trans	-81.3	134.4	173.9	-55.7	-176.2	0	0	0	109	F501 A504 H510 V511 F537	F501-I506 HydrophobicContact CB-CB 4.4Å; F501-I506 HydrophobicContact CB-CD1 4.07Å; F501-I506 HydrophobicContact CD1-CD1 3.72Å; F501-I506 HydrophobicContact CG-CD1 4.23Å; F501-I506 WeakPolarHBondContact O-CB 3.5Å; F501-I506 PolarHBondContact O-N 3.49Å; F501-I506 VanDerWaalsContact O-N 3.13Å; A504-I506 VanDerWaalsContact C-N 3.3Å; A504-I506 HydrophobicContact CB-CD1 4.38Å; A504-I506 HydrophobicContact CB-CG1 4.19Å; A504-I506 PolarHBondContact O-N 3.26Å; I506-H510 HydrophobicContact CG2-CB 3.77Å; I506-V511 HydrophobicContact CB-CG2 3.88Å; I506-V511 HydrophobicContact CG2-CG2 3.72Å; I506-F537 HydrophobicContact CD1-CE1 4.17Å; I506-F537 HydrophobicContact CD1-CZ 3.73Å
507	S	79.4	Confident	80	Confident	53 Å²	53	56 Å²	56	37%	0.371	30%	0.3	S	S	.	.			trans	-60	145.4	-179.6	79.4	0	0	0	0	111.2	V509 H510 V511	S507-V509 PolarHBondContact O-N 2.75Å; S507-V509 VanDerWaalsContact O-N 3.16Å; S507-H510 PolarHBondContact O-N 3.4Å; S507-H510 WeakPolarHBondContact OG-CB 3.22Å; S507-H510 PolarHBondContact OG-N 3.3Å; S507-H510 PolarHBondContact OG-ND1 2.92Å; S507-V511 WeakPolarHBondContact O-CG2 3.27Å; S507-V511 PolarHBondContact O-N 3.3Å
508	Q	77.2	Confident	80.2	Confident	145 Å²	145	56 Å²	56	68%	0.678	30%	0.3	S	S	*	.	H	α-helix	trans	-56.4	-35.4	-178.8	-173.9	177	-0.4	0	0	113	Q512	Q508-Q512 PolarHBondContact O-N 3.16Å; Q508-Q512 VanDerWaalsContact O-N 3.11Å
509	V	81.5	Confident	80.5	Confident	96 Å²	96	54 Å²	54	58%	0.582	29%	0.292	S	S	*	.	H	α-helix	trans	-62.4	-50.8	175.8	-179	0	0	0	0	110.5	S507 V511 Q512 E513	S507-V509 PolarHBondContact O-N 2.75Å; S507-V509 VanDerWaalsContact O-N 3.16Å; V509-V511 PolarHBondContact O-N 2.86Å; V509-Q512 WeakPolarHBondContact O-CB 3.27Å; V509-Q512 PolarHBondContact O-N 3.07Å; V509-Q512 VanDerWaalsContact O-N 3.16Å; V509-E513 PolarHBondContact O-N 3.05Å; V509-E513 VanDerWaalsContact O-N 3.12Å
510	H	81.7	Confident	80.6	Confident	107 Å²	107	55.5 Å²	55.5	50%	0.495	29%	0.294	S	S	.	.	H	α-helix	trans	-67.8	-34.4	-180	-63.7	162.6	0	0	0	112.4	I506 S507 Q512 E513 L514	I506-H510 HydrophobicContact CG2-CB 3.77Å; S507-H510 PolarHBondContact O-N 3.4Å; S507-H510 WeakPolarHBondContact OG-CB 3.22Å; S507-H510 PolarHBondContact OG-N 3.3Å; S507-H510 PolarHBondContact OG-ND1 2.92Å; H510-Q512 VanDerWaalsContact C-N 3.29Å; H510-Q512 PolarHBondContact O-N 2.66Å; H510-E513 IonicContact CD2-OE2 3.09Å; H510-E513 PolarHBondContact O-N 3.46Å; H510-L514 WeakPolarHBondContact O-CB 3.4Å; H510-L514 PolarHBondContact O-N 3.25Å
511	V	81.5	Confident	80.6	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.5	-43.8	172.7	174.4	0	0	0	0	110.1	K498 F501 I506 S507 V509 L514 I515	K498-V511 HydrophobicContact CB-CG1 4.43Å; K498-V511 HydrophobicContact CG-CG1 3.96Å; F501-V511 HydrophobicContact CB-CG1 4.33Å; F501-V511 HydrophobicContact CB-CG2 3.72Å; I506-V511 HydrophobicContact CB-CG2 3.88Å; I506-V511 HydrophobicContact CG2-CG2 3.72Å; S507-V511 WeakPolarHBondContact O-CG2 3.27Å; S507-V511 PolarHBondContact O-N 3.3Å; V509-V511 PolarHBondContact O-N 2.86Å; V511-L514 PolarHBondContact O-N 3.33Å; V511-I515 HydrophobicContact CG1-CG1 4.15Å; V511-I515 WeakPolarHBondContact O-CB 3.29Å; V511-I515 VanDerWaalsContact O-CG1 3.24Å; V511-I515 WeakPolarHBondContact O-CG1 3.38Å; V511-I515 PolarHBondContact O-N 3.44Å
512	Q	83.9	Confident	80.6	Confident	96 Å²	96	68.4 Å²	68.4	45%	0.449	35%	0.35	S	S	.	.	H	α-helix	trans	-66.4	-41.8	-178.3	-147.7	77.7	-8.1	0	0	112.2	Q508 V509 H510 T516	Q508-Q512 PolarHBondContact O-N 3.16Å; Q508-Q512 VanDerWaalsContact O-N 3.11Å; V509-Q512 WeakPolarHBondContact O-CB 3.27Å; V509-Q512 PolarHBondContact O-N 3.07Å; V509-Q512 VanDerWaalsContact O-N 3.16Å; H510-Q512 VanDerWaalsContact C-N 3.29Å; H510-Q512 PolarHBondContact O-N 2.66Å; Q512-T516 WeakPolarHBondContact O-CB 3.08Å; Q512-T516 PolarHBondContact O-N 3.36Å; Q512-T516 PolarHBondContact O-OG1 3.44Å
513	E	84.9	Confident	80.9	Confident	120 Å²	120	69.8 Å²	69.8	56%	0.561	36%	0.359	S	S	*	.	H	α-helix	trans	-61.7	-45.8	174	-70.2	173.7	171.3	0	0	111.3	V509 H510 T516 S517	V509-E513 PolarHBondContact O-N 3.05Å; V509-E513 VanDerWaalsContact O-N 3.12Å; H510-E513 IonicContact CD2-OE2 3.09Å; H510-E513 PolarHBondContact O-N 3.46Å; E513-T516 WeakPolarHBondContact O-CB 3.31Å; E513-T516 PolarHBondContact O-N 2.9Å; E513-S517 PolarHBondContact O-N 3.11Å
514	L	84.9	Confident	81.6	Confident	28 Å²	28	70.3 Å²	70.3	15%	0.147	37%	0.366	C	S	.	.	H	α-helix	trans	-64.7	-45.8	179.8	-169.1	99.3	0	0	0	111.9	F501 H510 V511 T516 S517 L518 F537	F501-L514 HydrophobicContact CD1-CD2 4.12Å; F501-L514 HydrophobicContact CD2-CD2 3.65Å; F501-L514 HydrophobicContact CE1-CD2 3.72Å; F501-L514 HydrophobicContact CE2-CD2 3.19Å; F501-L514 HydrophobicContact CG-CD2 4.1Å; F501-L514 HydrophobicContact CZ-CD2 3.22Å; H510-L514 WeakPolarHBondContact O-CB 3.4Å; H510-L514 PolarHBondContact O-N 3.25Å; V511-L514 PolarHBondContact O-N 3.33Å; L514-T516 PolarHBondContact O-N 3.43Å; L514-S517 PolarHBondContact O-N 3.12Å; L514-S517 VanDerWaalsContact O-N 3.07Å; L514-S517 PolarHBondContact O-OG 2.74Å; L514-L518 HydrophobicContact CD2-CD1 3.64Å; L514-L518 HydrophobicContact CG-CD1 3.85Å; L514-L518 HydrophobicContact CG-CG 4.36Å; L514-L518 WeakPolarHBondContact O-CB 3.16Å; L514-L518 VanDerWaalsContact O-CG 3.31Å; L514-L518 WeakPolarHBondContact O-CG 3.5Å; L514-L518 PolarHBondContact O-N 3Å; L514-F537 HydrophobicContact CD1-CD1 3.96Å; L514-F537 HydrophobicContact CD1-CE1 3.4Å; L514-F537 HydrophobicContact CD1-CE2 4.05Å; L514-F537 HydrophobicContact CD1-CG 4.49Å; L514-F537 HydrophobicContact CD1-CZ 3.43Å; L514-F537 VanDerWaalsContact CD1-CZ 3.43Å; L514-F537 HydrophobicContact CD2-CD1 4.08Å; L514-F537 HydrophobicContact CD2-CE1 3.3Å; L514-F537 HydrophobicContact CD2-CZ 3.94Å; L514-F537 HydrophobicContact CG-CE1 3.96Å; L514-F537 HydrophobicContact CG-CZ 4.3Å
515	I	87.1	Confident	82.2	Confident	14 Å²	14	70.7 Å²	70.7	7%	0.072	37%	0.368	C	S	.	.	H	α-helix	trans	-59	-39.4	174.9	-70.9	-58.3	0	0	0	110.8	V494 L497 K498 F501 V511 S517 L518 D519	V494-I515 HydrophobicContact CB-CG2 4.48Å; V494-I515 HydrophobicContact CG1-CD1 4.16Å; V494-I515 HydrophobicContact CG1-CG1 4.35Å; V494-I515 HydrophobicContact CG1-CG2 3.48Å; V494-I515 VanDerWaalsContact CG1-CG2 3.48Å; V494-I515 HydrophobicContact CG2-CG2 4.15Å; L497-I515 HydrophobicContact CB-CD1 3.83Å; K498-I515 HydrophobicContact CG-CD1 4.33Å; K498-I515 HydrophobicContact CG-CG1 4.05Å; F501-I515 HydrophobicContact CD2-CD1 4.37Å; F501-I515 HydrophobicContact CE2-CD1 4.23Å; V511-I515 HydrophobicContact CG1-CG1 4.15Å; V511-I515 WeakPolarHBondContact O-CB 3.29Å; V511-I515 VanDerWaalsContact O-CG1 3.24Å; V511-I515 WeakPolarHBondContact O-CG1 3.38Å; V511-I515 PolarHBondContact O-N 3.44Å; I515-S517 VanDerWaalsContact C-N 3.3Å; I515-S517 PolarHBondContact O-N 3.16Å; I515-L518 PolarHBondContact O-N 2.7Å; I515-D519 PolarHBondContact O-N 3.5Å
516	T	85.8	Confident	82.7	Confident	94 Å²	94	66.6 Å²	66.6	58%	0.577	35%	0.346	S	S	*	.	H	α-helix	trans	-64.1	-36.3	176.8	-55.1	0	0	0	0	111.8	Q512 E513 L514	Q512-T516 WeakPolarHBondContact O-CB 3.08Å; Q512-T516 PolarHBondContact O-N 3.36Å; Q512-T516 PolarHBondContact O-OG1 3.44Å; E513-T516 WeakPolarHBondContact O-CB 3.31Å; E513-T516 PolarHBondContact O-N 2.9Å; L514-T516 PolarHBondContact O-N 3.43Å
517	S	84.5	Confident	82.6	Confident	55 Å²	55	65.9 Å²	65.9	39%	0.385	34%	0.343	S	S	.	.	H	α-helix	trans	-71.9	-36.1	175.7	73.7	0	0	0	0	113.1	E513 L514 I515	E513-S517 PolarHBondContact O-N 3.11Å; L514-S517 PolarHBondContact O-N 3.12Å; L514-S517 VanDerWaalsContact O-N 3.07Å; L514-S517 PolarHBondContact O-OG 2.74Å; I515-S517 VanDerWaalsContact C-N 3.3Å; I515-S517 PolarHBondContact O-N 3.16Å
518	L	86.4	Confident	82.3	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-81.6	-47.4	-174.8	-72.8	172	0	0	0	112.7	F501 L514 I515 H520 I526 T530 Y534 F538	F501-L518 HydrophobicContact CE2-CD1 4.06Å; F501-L518 HydrophobicContact CZ-CD1 4.12Å; L514-L518 HydrophobicContact CD2-CD1 3.64Å; L514-L518 HydrophobicContact CG-CD1 3.85Å; L514-L518 HydrophobicContact CG-CG 4.36Å; L514-L518 WeakPolarHBondContact O-CB 3.16Å; L514-L518 VanDerWaalsContact O-CG 3.31Å; L514-L518 WeakPolarHBondContact O-CG 3.5Å; L514-L518 PolarHBondContact O-N 3Å; I515-L518 PolarHBondContact O-N 2.7Å; L518-H520 PolarHBondContact O-N 2.77Å; L518-H520 PolarHBondContact O-ND1 2.74Å; L518-I526 HydrophobicContact CB-CD1 3.41Å; L518-I526 VanDerWaalsContact CB-CD1 3.41Å; L518-I526 HydrophobicContact CB-CG1 4.12Å; L518-I526 HydrophobicContact CD1-CD1 3.7Å; L518-I526 HydrophobicContact CD2-CD1 4.27Å; L518-I526 HydrophobicContact CG-CD1 3.99Å; L518-T530 HydrophobicContact CD2-CG2 4.47Å; L518-Y534 HydrophobicContact CD2-CD1 3.96Å; L518-Y534 HydrophobicContact CD2-CD2 3.44Å; L518-Y534 VanDerWaalsContact CD2-CD2 3.44Å; L518-Y534 HydrophobicContact CD2-CE1 4.32Å; L518-Y534 HydrophobicContact CD2-CE2 3.86Å; L518-Y534 HydrophobicContact CD2-CG 3.49Å; L518-Y534 VanDerWaalsContact CD2-CG 3.49Å; L518-F538 HydrophobicContact CD1-CZ 4.16Å
519	D	87.3	Confident	81.7	Confident	19 Å²	19	60.1 Å²	60.1	10%	0.102	31%	0.311	C	S	.	.			trans	-84.4	60	175.4	-174.7	13.3	0	0	0	110.8	V494 I515 K521 K522 N523 G524	V494-D519 HydrophobicContact CG2-CB 4.05Å; I515-D519 PolarHBondContact O-N 3.5Å; D519-K521 PolarHBondContact O-N 3.36Å; D519-K521 VanDerWaalsContact O-N 3.14Å; D519-K522 PolarHBondContact O-N 3.48Å; D519-K522 VanDerWaalsContact OD1-CA 3.3Å; D519-K522 WeakPolarHBondContact OD1-CA 3.15Å; D519-K522 PolarHBondContact OD1-N 2.85Å; D519-K522 WeakPolarHBondContact OD2-CA 2.87Å; D519-N523 PolarHBondContact OD1-N 2.87Å; D519-N523 PolarHBondContact OD1-OD1 2.73Å; D519-N523 PolarHBondContact OD2-N 2.53Å; D519-G524 WeakPolarHBondContact OD2-CA 3.36Å; D519-G524 PolarHBondContact OD2-N 3.34Å
520	H	78.2	Confident	81.5	Confident	113 Å²	113	56 Å²	56	52%	0.523	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-27	179.3	65.1	-78.6	0	0	0	113	L518	L518-H520 PolarHBondContact O-N 2.77Å; L518-H520 PolarHBondContact O-ND1 2.74Å
521	K	77.3	Confident	81.3	Confident	107 Å²	107	50.9 Å²	50.9	47%	0.465	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-8.1	177.5	-66.8	176.8	-176.1	152.5	0	113.3	D519 N523 D527	D519-K521 PolarHBondContact O-N 3.36Å; D519-K521 VanDerWaalsContact O-N 3.14Å; K521-N523 HydrophobicContact CB-CB 4.39Å; K521-N523 PolarHBondContact O-N 2.88Å; K521-D527 IonicContact NZ-OD2 3.8Å
522	K	81.5	Confident	80.8	Confident	182 Å²	182	52.6 Å²	52.6	79%	0.791	27%	0.272	S	S	*	.			trans	51.3	37.9	-175.6	-58.5	-178	178.3	-179	0	112.6	D519	D519-K522 PolarHBondContact O-N 3.48Å; D519-K522 VanDerWaalsContact OD1-CA 3.3Å; D519-K522 WeakPolarHBondContact OD1-CA 3.15Å; D519-K522 PolarHBondContact OD1-N 2.85Å; D519-K522 WeakPolarHBondContact OD2-CA 2.87Å
523	N	81.1	Confident	80.2	Confident	82 Å²	82	52.9 Å²	52.9	44%	0.439	27%	0.273	S	S	.	.	S	Bend	trans	-100.2	4.9	-177.2	72.1	9.3	0	0	0	112.6	D519 K521 T525	D519-N523 PolarHBondContact OD1-N 2.87Å; D519-N523 PolarHBondContact OD1-OD1 2.73Å; D519-N523 PolarHBondContact OD2-N 2.53Å; K521-N523 HydrophobicContact CB-CB 4.39Å; K521-N523 PolarHBondContact O-N 2.88Å; N523-T525 PolarHBondContact ND2-OG1 2.98Å; N523-T525 PolarHBondContact O-N 3.44Å; N523-T525 WeakPolarHBondContact OD1-CA 3.39Å; N523-T525 PolarHBondContact OD1-N 2.74Å; N523-T525 PolarHBondContact OD1-O 3.44Å; N523-T525 PolarHBondContact OD1-OG1 3.43Å
524	G	84.6	Confident	80	Confident	32 Å²	32	51.4 Å²	51.4	33%	0.33	26%	0.263	S	S	.	.	S	Bend	trans	77.3	8.1	-179.7	0	0	0	0	0	113.7	V494 D519	V494-G524 VanDerWaalsContact CG2-C 3.49Å; V494-G524 WeakPolarHBondContact CG2-O 3.26Å; V494-G524 PolarHBondContact N-O 3.29Å; D519-G524 WeakPolarHBondContact OD2-CA 3.36Å; D519-G524 PolarHBondContact OD2-N 3.34Å
525	T	85.7	Confident	79.7	Confident	16 Å²	16	51 Å²	51	10%	0.098	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	152.3	-177.5	65.6	0	0	0	0	113	H491 I492 E493 N523	H491-T525 HydrophobicContact CB-CG2 4.48Å; I492-T525 CarbonylContact O-C 3.49Å; I492-T525 WeakPolarHBondContact O-CA 3.36Å; I492-T525 WeakPolarHBondContact O-CB 3.42Å; E493-T525 HydrophobicContact CG-CG2 4.33Å; N523-T525 PolarHBondContact ND2-OG1 2.98Å; N523-T525 PolarHBondContact O-N 3.44Å; N523-T525 WeakPolarHBondContact OD1-CA 3.39Å; N523-T525 PolarHBondContact OD1-N 2.74Å; N523-T525 PolarHBondContact OD1-O 3.44Å; N523-T525 PolarHBondContact OD1-OG1 3.43Å
526	I	83.1	Confident	79.2	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.015	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130.3	168.9	-55.4	178.5	0	0	0	107.9	H491 I492 L497 L518 T530	H491-I526 CarbonylContact C-O 3.58Å; H491-I526 WeakPolarHBondContact CA-O 3.4Å; I492-I526 PolarHBondContact N-O 3.14Å; I492-I526 PolarHBondContact O-N 3.36Å; L497-I526 HydrophobicContact CD1-CB 4.18Å; L497-I526 HydrophobicContact CD1-CD1 3.17Å; L497-I526 HydrophobicContact CD1-CG1 3.53Å; L497-I526 HydrophobicContact CD2-CD1 4.01Å; L497-I526 HydrophobicContact CG-CD1 4.19Å; L518-I526 HydrophobicContact CB-CD1 3.41Å; L518-I526 VanDerWaalsContact CB-CD1 3.41Å; L518-I526 HydrophobicContact CB-CG1 4.12Å; L518-I526 HydrophobicContact CD1-CD1 3.7Å; L518-I526 HydrophobicContact CD2-CD1 4.27Å; L518-I526 HydrophobicContact CG-CD1 3.99Å; I526-T530 HydrophobicContact CG2-CG2 3.63Å
527	D	76.4	Confident	78.9	Confident	21 Å²	21	51.3 Å²	51.3	11%	0.112	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	160.5	172.7	70.3	35.1	0	0	0	111.7	G490 K521 V529 T530 F531	G490-D527 CarbonylContact O-C 3.57Å; G490-D527 WeakPolarHBondContact O-CA 3.45Å; K521-D527 IonicContact NZ-OD2 3.8Å; D527-V529 PolarHBondContact O-N 2.98Å; D527-V529 VanDerWaalsContact O-N 3.08Å; D527-V529 WeakPolarHBondContact OD1-CA 3.3Å; D527-V529 WeakPolarHBondContact OD1-CB 3.38Å; D527-V529 PolarHBondContact OD1-N 2.94Å; D527-T530 PolarHBondContact O-N 2.9Å; D527-T530 PolarHBondContact OD1-N 3.46Å; D527-T530 PolarHBondContact OD1-OG1 2.95Å; D527-F531 PolarHBondContact O-N 3.39Å
528	F	73	Confident	78.7	Confident	40 Å²	40	48.7 Å²	48.7	18%	0.175	24%	0.241	C	C	.	.	H	α-helix	trans	-57.7	-25.7	-179.4	-174.5	-113.3	0	0	0	113.4	R428 F431 G490 F531 L532	R428-F528 HydrophobicContact CB-CE2 4.33Å; R428-F528 HydrophobicContact CB-CZ 4.15Å; F431-F528 HydrophobicContact CB-CD2 4.01Å; F431-F528 HydrophobicContact CB-CE2 3.83Å; F431-F528 AromaticContact CD1-CD2 3.91Å; F431-F528 HydrophobicContact CD1-CD2 3.91Å; F431-F528 HydrophobicContact CD1-CE2 4.4Å; F431-F528 AromaticContact CD2-CD2 3.46Å; F431-F528 HydrophobicContact CD2-CD2 3.46Å; F431-F528 VanDerWaalsContact CD2-CD2 3.46Å; F431-F528 HydrophobicContact CD2-CE2 4.11Å; F431-F528 HydrophobicContact CD2-CG 4.5Å; F431-F528 HydrophobicContact CE1-CD2 4.19Å; F431-F528 HydrophobicContact CE2-CB 4.01Å; F431-F528 AromaticContact CE2-CD2 3.73Å; F431-F528 HydrophobicContact CE2-CD2 3.73Å; F431-F528 HydrophobicContact CE2-CG 4.39Å; F431-F528 AromaticContact CG-CD2 3.53Å; F431-F528 HydrophobicContact CG-CD2 3.53Å; F431-F528 AromaticContact CG-CE2 3.88Å; F431-F528 HydrophobicContact CG-CE2 3.88Å; F431-F528 HydrophobicContact CZ-CB 4.04Å; F431-F528 HydrophobicContact CZ-CD2 4.1Å; G490-F528 PolarHBondContact O-N 3.43Å; F528-F531 HydrophobicContact CD2-CD1 4.19Å; F528-F531 HydrophobicContact CE2-CD1 4.08Å; F528-F531 HydrophobicContact CE2-CE1 4.47Å; F528-L532 HydrophobicContact CD1-CD1 4.01Å; F528-L532 HydrophobicContact CD1-CG 4.38Å; F528-L532 HydrophobicContact CE1-CD1 3.6Å; F528-L532 HydrophobicContact CE1-CD2 4.37Å; F528-L532 HydrophobicContact CE1-CG 4.01Å; F528-L532 HydrophobicContact CZ-CD1 4.12Å; F528-L532 HydrophobicContact CZ-CD2 4.04Å; F528-L532 HydrophobicContact CZ-CG 4.08Å; F528-L532 WeakPolarHBondContact O-CG 3.19Å; F528-L532 PolarHBondContact O-N 3.43Å; F528-L532 VanDerWaalsContact O-N 3.1Å
529	V	66	Low	78.2	Confident	36 Å²	36	48.7 Å²	48.7	22%	0.218	24%	0.241	C	C	.	.	H	α-helix	trans	-72.5	-50.4	-179.9	172.7	0	0	0	0	110.2	L397 F401 D527 F531 L532 E533	L397-V529 HydrophobicContact CD2-CB 4.09Å; L397-V529 HydrophobicContact CD2-CG1 3.36Å; L397-V529 HydrophobicContact CD2-CG2 3.72Å; F401-V529 HydrophobicContact CE2-CG1 3.9Å; F401-V529 HydrophobicContact CZ-CG1 4.46Å; D527-V529 PolarHBondContact O-N 2.98Å; D527-V529 VanDerWaalsContact O-N 3.08Å; D527-V529 WeakPolarHBondContact OD1-CA 3.3Å; D527-V529 WeakPolarHBondContact OD1-CB 3.38Å; D527-V529 PolarHBondContact OD1-N 2.94Å; V529-F531 PolarHBondContact O-N 3.43Å; V529-L532 WeakPolarHBondContact O-CB 3.45Å; V529-L532 PolarHBondContact O-N 2.82Å; V529-E533 PolarHBondContact O-N 3.22Å; V529-E533 VanDerWaalsContact O-N 3.16Å
530	T	76	Confident	77.7	Confident	9 Å²	9	52.1 Å²	52.1	6%	0.055	26%	0.257	C	S	.	.	H	α-helix	trans	-60.7	-36.1	173.8	-59.1	0	0	0	0	111.1	L518 I526 D527 L532 E533 Y534	L518-T530 HydrophobicContact CD2-CG2 4.47Å; I526-T530 HydrophobicContact CG2-CG2 3.63Å; D527-T530 PolarHBondContact O-N 2.9Å; D527-T530 PolarHBondContact OD1-N 3.46Å; D527-T530 PolarHBondContact OD1-OG1 2.95Å; T530-L532 VanDerWaalsContact C-N 3.33Å; T530-L532 PolarHBondContact O-N 3.3Å; T530-E533 PolarHBondContact O-N 2.84Å; T530-Y534 HydrophobicContact CG2-CD2 4.3Å; T530-Y534 HydrophobicContact CG2-CE2 4.3Å; T530-Y534 WeakPolarHBondContact O-CD2 3.36Å; T530-Y534 PolarHBondContact O-N 2.98Å
531	F	78	Confident	77.7	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-42.5	172.1	174.2	-93.1	0	0	0	112.9	A427 L430 F431 I434 I492 D527 F528 V529 E533 Y534 L535 F538	A427-F531 HydrophobicContact CB-CE1 4.21Å; A427-F531 VanDerWaalsContact O-CE1 3.25Å; A427-F531 WeakPolarHBondContact O-CE1 3.36Å; L430-F531 HydrophobicContact CB-CZ 4.25Å; L430-F531 HydrophobicContact CD2-CZ 4.1Å; L430-F531 HydrophobicContact CG-CZ 3.98Å; F431-F531 HydrophobicContact CB-CD1 4.18Å; F431-F531 HydrophobicContact CB-CE1 3.9Å; F431-F531 HydrophobicContact CB-CZ 4.11Å; F431-F531 HydrophobicContact CD2-CB 3.89Å; F431-F531 AromaticContact CD2-CD1 3.79Å; F431-F531 HydrophobicContact CD2-CD1 3.79Å; F431-F531 AromaticContact CD2-CD2 3.92Å; F431-F531 HydrophobicContact CD2-CD2 3.92Å; F431-F531 HydrophobicContact CD2-CE1 4.3Å; F431-F531 HydrophobicContact CD2-CE2 4.42Å; F431-F531 AromaticContact CD2-CG 3.58Å; F431-F531 HydrophobicContact CD2-CG 3.58Å; F431-F531 HydrophobicContact CE2-CB 4.05Å; F431-F531 HydrophobicContact CE2-CG 4.24Å; F431-F531 HydrophobicContact CG-CD1 4.46Å; I434-F531 HydrophobicContact CD1-CE2 3.66Å; I434-F531 HydrophobicContact CD1-CZ 4.31Å; I492-F531 HydrophobicContact CD1-CD2 3.92Å; I492-F531 HydrophobicContact CD1-CE2 4.37Å; D527-F531 PolarHBondContact O-N 3.39Å; F528-F531 HydrophobicContact CD2-CD1 4.19Å; F528-F531 HydrophobicContact CE2-CD1 4.08Å; F528-F531 HydrophobicContact CE2-CE1 4.47Å; V529-F531 PolarHBondContact O-N 3.43Å; F531-E533 PolarHBondContact O-N 2.79Å; F531-Y534 CarbonylContact O-C 3.59Å; F531-Y534 PolarHBondContact O-N 3.49Å; F531-L535 HydrophobicContact CE1-CD1 3.8Å; F531-L535 HydrophobicContact CZ-CD1 4.09Å; F531-L535 PolarHBondContact O-N 2.9Å; F531-F538 HydrophobicContact CD2-CD1 4.08Å; F531-F538 AromaticContact CD2-CD2 3.51Å; F531-F538 HydrophobicContact CD2-CD2 3.51Å; F531-F538 AromaticContact CD2-CE1 4Å; F531-F538 HydrophobicContact CD2-CE1 4Å; F531-F538 AromaticContact CD2-CE2 3.43Å; F531-F538 HydrophobicContact CD2-CE2 3.43Å; F531-F538 VanDerWaalsContact CD2-CE2 3.43Å; F531-F538 AromaticContact CD2-CG 3.85Å; F531-F538 HydrophobicContact CD2-CG 3.85Å; F531-F538 AromaticContact CD2-CZ 3.69Å; F531-F538 HydrophobicContact CD2-CZ 3.69Å; F531-F538 HydrophobicContact CE2-CB 3.84Å; F531-F538 AromaticContact CE2-CD1 3.64Å; F531-F538 HydrophobicContact CE2-CD1 3.64Å; F531-F538 AromaticContact CE2-CD2 3.48Å; F531-F538 HydrophobicContact CE2-CD2 3.48Å; F531-F538 VanDerWaalsContact CE2-CD2 3.48Å; F531-F538 HydrophobicContact CE2-CE1 4.01Å; F531-F538 AromaticContact CE2-CE2 3.88Å; F531-F538 HydrophobicContact CE2-CE2 3.88Å; F531-F538 AromaticContact CE2-CG 3.36Å; F531-F538 HydrophobicContact CE2-CG 3.36Å; F531-F538 HydrophobicContact CE2-CZ 4.13Å; F531-F538 HydrophobicContact CG-CD2 4.3Å; F531-F538 HydrophobicContact CG-CE2 4.19Å; F531-F538 HydrophobicContact CZ-CB 4.14Å; F531-F538 HydrophobicContact CZ-CD2 4.26Å; F531-F538 HydrophobicContact CZ-CG 4.13Å
532	L	72.1	Confident	77.8	Confident	36 Å²	36	42.5 Å²	42.5	19%	0.188	21%	0.214	C	C	.	.	H	α-helix	trans	-66.7	-34	178.8	-75	175.7	0	0	0	113	A427 F528 V529 T530 Y534 L535	A427-L532 HydrophobicContact CB-CD2 3.53Å; F528-L532 HydrophobicContact CD1-CD1 4.01Å; F528-L532 HydrophobicContact CD1-CG 4.38Å; F528-L532 HydrophobicContact CE1-CD1 3.6Å; F528-L532 HydrophobicContact CE1-CD2 4.37Å; F528-L532 HydrophobicContact CE1-CG 4.01Å; F528-L532 HydrophobicContact CZ-CD1 4.12Å; F528-L532 HydrophobicContact CZ-CD2 4.04Å; F528-L532 HydrophobicContact CZ-CG 4.08Å; F528-L532 WeakPolarHBondContact O-CG 3.19Å; F528-L532 PolarHBondContact O-N 3.43Å; F528-L532 VanDerWaalsContact O-N 3.1Å; V529-L532 WeakPolarHBondContact O-CB 3.45Å; V529-L532 PolarHBondContact O-N 2.82Å; T530-L532 VanDerWaalsContact C-N 3.33Å; T530-L532 PolarHBondContact O-N 3.3Å; L532-Y534 VanDerWaalsContact C-N 3.26Å; L532-Y534 PolarHBondContact O-N 3.35Å; L532-L535 HydrophobicContact CD2-CD2 4.4Å; L532-L535 VanDerWaalsContact O-CB 3.3Å; L532-L535 WeakPolarHBondContact O-CB 3.35Å; L532-L535 PolarHBondContact O-N 3.31Å
533	E	71.1	Confident	77.4	Confident	102 Å²	102	35.7 Å²	35.7	48%	0.477	19%	0.185	S	C	.	.	H	α-helix	trans	-60.8	-37.9	176.3	-70.5	174.3	171.7	0	0	111.8	F401 V529 T530 F531	F401-E533 WeakPolarHBondContact CZ-OE1 3.41Å; V529-E533 PolarHBondContact O-N 3.22Å; V529-E533 VanDerWaalsContact O-N 3.16Å; T530-E533 PolarHBondContact O-N 2.84Å; F531-E533 PolarHBondContact O-N 2.79Å
534	Y	79.9	Confident	76.9	Confident	89 Å²	89	35.9 Å²	35.9	35%	0.349	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	15.7	-179.8	-65.3	-95.9	0	0	0	112.9	L518 T530 F531 L532 P536 F537 F538	L518-Y534 HydrophobicContact CD2-CD1 3.96Å; L518-Y534 HydrophobicContact CD2-CD2 3.44Å; L518-Y534 VanDerWaalsContact CD2-CD2 3.44Å; L518-Y534 HydrophobicContact CD2-CE1 4.32Å; L518-Y534 HydrophobicContact CD2-CE2 3.86Å; L518-Y534 HydrophobicContact CD2-CG 3.49Å; L518-Y534 VanDerWaalsContact CD2-CG 3.49Å; T530-Y534 HydrophobicContact CG2-CD2 4.3Å; T530-Y534 HydrophobicContact CG2-CE2 4.3Å; T530-Y534 WeakPolarHBondContact O-CD2 3.36Å; T530-Y534 PolarHBondContact O-N 2.98Å; F531-Y534 CarbonylContact O-C 3.59Å; F531-Y534 PolarHBondContact O-N 3.49Å; L532-Y534 VanDerWaalsContact C-N 3.26Å; L532-Y534 PolarHBondContact O-N 3.35Å; Y534-P536 VanDerWaalsContact C-N 3.33Å; Y534-F537 WeakPolarHBondContact O-CB 3.3Å; Y534-F537 PolarHBondContact O-N 3.28Å; Y534-F538 VanDerWaalsContact O-CD2 3.29Å; Y534-F538 WeakPolarHBondContact O-CD2 3.12Å; Y534-F538 PolarHBondContact O-N 2.93Å
535	L	78	Confident	76.2	Confident	21 Å²	21	36.5 Å²	36.5	11%	0.11	18%	0.178	C	C	.	.	H	α-helix	trans	-49.6	-42.3	-177.8	-178.8	65.3	0	0	0	114.4	A427 F531 L532 F537 F538 V539	A427-L535 HydrophobicContact CB-CD1 3.64Å; A427-L535 HydrophobicContact CB-CD2 3.78Å; A427-L535 HydrophobicContact CB-CG 4.37Å; F531-L535 HydrophobicContact CE1-CD1 3.8Å; F531-L535 HydrophobicContact CZ-CD1 4.09Å; F531-L535 PolarHBondContact O-N 2.9Å; L532-L535 HydrophobicContact CD2-CD2 4.4Å; L532-L535 VanDerWaalsContact O-CB 3.3Å; L532-L535 WeakPolarHBondContact O-CB 3.35Å; L532-L535 PolarHBondContact O-N 3.31Å; L535-F537 PolarHBondContact O-N 2.93Å; L535-F538 PolarHBondContact O-N 3.4Å; L535-V539 HydrophobicContact CD1-CG2 4.01Å; L535-V539 HydrophobicContact CG-CG2 4.2Å; L535-V539 WeakPolarHBondContact O-CG2 3.11Å; L535-V539 PolarHBondContact O-N 3.03Å
536	P	76.6	Confident	75.3	Confident	52 Å²	52	36.2 Å²	36.2	34%	0.338	18%	0.176	S	C	.	.	H	α-helix	trans	-50.7	-44.6	175.2	-29.4	37.5	0	0	0	113.3	W6 Y534 V539 E540	W6-P536 HydrophobicContact CE3-CB 3.87Å; W6-P536 HydrophobicContact CH2-CB 4.09Å; W6-P536 HydrophobicContact CH2-CG 4.36Å; W6-P536 HydrophobicContact CZ3-CB 3.33Å; W6-P536 HydrophobicContact CZ3-CG 3.68Å; Y534-P536 VanDerWaalsContact C-N 3.33Å; P536-V539 PolarHBondContact O-N 3.13Å; P536-E540 WeakPolarHBondContact O-CB 3.34Å; P536-E540 PolarHBondContact O-N 2.88Å
537	F	80.2	Confident	74.5	Confident	62 Å²	62	43 Å²	43	27%	0.272	20%	0.203	S	C	.	.	H	α-helix	trans	-70.1	-39.9	-177	-174.7	-97.5	0	0	0	112.2	F501 I506 L514 Y534 L535 V539 E540 S541	F501-F537 AromaticContact CD1-CE1 3.88Å; F501-F537 HydrophobicContact CD1-CE1 3.88Å; F501-F537 AromaticContact CE1-CD1 3.8Å; F501-F537 HydrophobicContact CE1-CD1 3.8Å; F501-F537 AromaticContact CE1-CE1 3.33Å; F501-F537 HydrophobicContact CE1-CE1 3.33Å; F501-F537 HydrophobicContact CE1-CZ 4.46Å; F501-F537 HydrophobicContact CZ-CD1 4.21Å; F501-F537 AromaticContact CZ-CE1 3.89Å; F501-F537 HydrophobicContact CZ-CE1 3.89Å; I506-F537 HydrophobicContact CD1-CE1 4.17Å; I506-F537 HydrophobicContact CD1-CZ 3.73Å; L514-F537 HydrophobicContact CD1-CD1 3.96Å; L514-F537 HydrophobicContact CD1-CE1 3.4Å; L514-F537 HydrophobicContact CD1-CE2 4.05Å; L514-F537 HydrophobicContact CD1-CG 4.49Å; L514-F537 HydrophobicContact CD1-CZ 3.43Å; L514-F537 VanDerWaalsContact CD1-CZ 3.43Å; L514-F537 HydrophobicContact CD2-CD1 4.08Å; L514-F537 HydrophobicContact CD2-CE1 3.3Å; L514-F537 HydrophobicContact CD2-CZ 3.94Å; L514-F537 HydrophobicContact CG-CE1 3.96Å; L514-F537 HydrophobicContact CG-CZ 4.3Å; Y534-F537 WeakPolarHBondContact O-CB 3.3Å; Y534-F537 PolarHBondContact O-N 3.28Å; L535-F537 PolarHBondContact O-N 2.93Å; F537-V539 VanDerWaalsContact C-N 3.34Å; F537-E540 PolarHBondContact O-N 3.2Å; F537-S541 WeakPolarHBondContact O-CB 3.18Å; F537-S541 PolarHBondContact O-N 3.05Å; F537-S541 PolarHBondContact O-OG 2.66Å
538	F	81.3	Confident	73.9	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.7	-39.7	174.3	-72.4	-73.3	0	0	0	112.1	L430 I434 L497 F500 F501 L518 F531 Y534 L535 H542	L430-F538 HydrophobicContact CD2-CB 3.9Å; I434-F538 HydrophobicContact CD1-CD1 3.76Å; I434-F538 HydrophobicContact CD1-CE1 4.3Å; I434-F538 HydrophobicContact CD1-CG 4.49Å; L497-F538 HydrophobicContact CD2-CE1 3.53Å; L497-F538 HydrophobicContact CD2-CZ 3.94Å; F500-F538 HydrophobicContact CD1-CD1 4.33Å; F500-F538 AromaticContact CE1-CD1 3.81Å; F500-F538 HydrophobicContact CE1-CD1 3.81Å; F501-F538 HydrophobicContact CE1-CD1 4.13Å; F501-F538 HydrophobicContact CE1-CE1 4.03Å; F501-F538 HydrophobicContact CE2-CE1 4.3Å; F501-F538 AromaticContact CZ-CD1 3.98Å; F501-F538 HydrophobicContact CZ-CD1 3.98Å; F501-F538 AromaticContact CZ-CE1 3.4Å; F501-F538 HydrophobicContact CZ-CE1 3.4Å; F501-F538 VanDerWaalsContact CZ-CE1 3.4Å; F501-F538 HydrophobicContact CZ-CZ 4.04Å; L518-F538 HydrophobicContact CD1-CZ 4.16Å; F531-F538 HydrophobicContact CD2-CD1 4.08Å; F531-F538 AromaticContact CD2-CD2 3.51Å; F531-F538 HydrophobicContact CD2-CD2 3.51Å; F531-F538 AromaticContact CD2-CE1 4Å; F531-F538 HydrophobicContact CD2-CE1 4Å; F531-F538 AromaticContact CD2-CE2 3.43Å; F531-F538 HydrophobicContact CD2-CE2 3.43Å; F531-F538 VanDerWaalsContact CD2-CE2 3.43Å; F531-F538 AromaticContact CD2-CG 3.85Å; F531-F538 HydrophobicContact CD2-CG 3.85Å; F531-F538 AromaticContact CD2-CZ 3.69Å; F531-F538 HydrophobicContact CD2-CZ 3.69Å; F531-F538 HydrophobicContact CE2-CB 3.84Å; F531-F538 AromaticContact CE2-CD1 3.64Å; F531-F538 HydrophobicContact CE2-CD1 3.64Å; F531-F538 AromaticContact CE2-CD2 3.48Å; F531-F538 HydrophobicContact CE2-CD2 3.48Å; F531-F538 VanDerWaalsContact CE2-CD2 3.48Å; F531-F538 HydrophobicContact CE2-CE1 4.01Å; F531-F538 AromaticContact CE2-CE2 3.88Å; F531-F538 HydrophobicContact CE2-CE2 3.88Å; F531-F538 AromaticContact CE2-CG 3.36Å; F531-F538 HydrophobicContact CE2-CG 3.36Å; F531-F538 HydrophobicContact CE2-CZ 4.13Å; F531-F538 HydrophobicContact CG-CD2 4.3Å; F531-F538 HydrophobicContact CG-CE2 4.19Å; F531-F538 HydrophobicContact CZ-CB 4.14Å; F531-F538 HydrophobicContact CZ-CD2 4.26Å; F531-F538 HydrophobicContact CZ-CG 4.13Å; Y534-F538 VanDerWaalsContact O-CD2 3.29Å; Y534-F538 WeakPolarHBondContact O-CD2 3.12Å; Y534-F538 PolarHBondContact O-N 2.93Å; L535-F538 PolarHBondContact O-N 3.4Å; F538-H542 VanDerWaalsContact O-CB 3.28Å; F538-H542 WeakPolarHBondContact O-CB 3.29Å; F538-H542 PolarHBondContact O-N 3.37Å
539	V	75.5	Confident	73.1	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-65.3	-46.2	177.3	169.6	0	0	0	0	110.9	W6 I12 Y15 L430 L535 P536 F537 H542 Q543	W6-V539 HydrophobicContact CZ2-CB 4.15Å; W6-V539 HydrophobicContact CZ2-CG1 3.72Å; I12-V539 HydrophobicContact CD1-CG2 3.89Å; Y15-V539 HydrophobicContact CD1-CG1 4.45Å; Y15-V539 HydrophobicContact CD2-CG1 3.58Å; Y15-V539 HydrophobicContact CE1-CG2 4.35Å; Y15-V539 HydrophobicContact CE2-CG1 3.73Å; Y15-V539 HydrophobicContact CG-CG1 3.97Å; L430-V539 HydrophobicContact CD2-CG2 4.03Å; L535-V539 HydrophobicContact CD1-CG2 4.01Å; L535-V539 HydrophobicContact CG-CG2 4.2Å; L535-V539 WeakPolarHBondContact O-CG2 3.11Å; L535-V539 PolarHBondContact O-N 3.03Å; P536-V539 PolarHBondContact O-N 3.13Å; F537-V539 VanDerWaalsContact C-N 3.34Å; V539-H542 PolarHBondContact O-N 3.46Å; V539-Q543 WeakPolarHBondContact O-CG 3.31Å; V539-Q543 PolarHBondContact O-N 2.91Å
540	E	77.1	Confident	72.4	Confident	91 Å²	91	52.8 Å²	52.8	43%	0.425	25%	0.245	S	C	.	.	H	α-helix	trans	-60.5	-48.7	176.2	-175.9	174.4	-168	0	0	111.3	P536 F537 H542 Q543 H544	P536-E540 WeakPolarHBondContact O-CB 3.34Å; P536-E540 PolarHBondContact O-N 2.88Å; F537-E540 PolarHBondContact O-N 3.2Å; E540-H542 VanDerWaalsContact C-N 3.29Å; E540-H542 PolarHBondContact O-N 3.06Å; E540-Q543 WeakPolarHBondContact O-CB 3.13Å; E540-Q543 PolarHBondContact O-N 3.48Å; E540-Q543 VanDerWaalsContact O-N 3.11Å; E540-H544 PolarHBondContact O-CD2 3.22Å; E540-H544 VanDerWaalsContact O-CD2 3.26Å; E540-H544 PolarHBondContact O-N 2.78Å
541	S	77.6	Confident	71.2	Confident	5 Å²	5	57.1 Å²	57.1	4%	0.035	27%	0.267	C	S	.	.	H	α-helix	trans	-56.4	-43.9	175.8	-60.9	0	0	0	0	111.7	A504 F537 H544 I545	A504-S541 WeakPolarHBondContact CB-O 3.24Å; F537-S541 WeakPolarHBondContact O-CB 3.18Å; F537-S541 PolarHBondContact O-N 3.05Å; F537-S541 PolarHBondContact O-OG 2.66Å; S541-H544 WeakPolarHBondContact O-CB 3.36Å; S541-H544 PolarHBondContact O-N 3.44Å; S541-I545 WeakPolarHBondContact O-CG1 3.41Å; S541-I545 PolarHBondContact O-N 3.47Å; S541-I545 VanDerWaalsContact O-N 3.14Å
542	H	78.5	Confident	69.7	Low	12 Å²	12	58.1 Å²	58.1	6%	0.056	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-38.9	177.3	-174.1	-83.2	0	0	0	112.7	Y15 I17 L430 L433 F500 F538 V539 E540 H544 I545 I546	Y15-H542 AromaticContact CE2-ND1 3.87Å; Y15-H542 AromaticContact CZ-ND1 3.74Å; Y15-H542 WeakPolarHBondContact OH-CB 3.33Å; Y15-H542 PolarHBondContact OH-CE1 3.32Å; Y15-H542 PolarHBondContact OH-ND1 3.04Å; I17-H542 PolarHBondContact O-CE1 3.04Å; I17-H542 VanDerWaalsContact O-CE1 3.22Å; L430-H542 HydrophobicContact CD1-CB 3.94Å; L430-H542 WeakPolarHBondContact CD1-CD2 3.14Å; L433-H542 WeakPolarHBondContact CD2-NE2 3.32Å; F500-H542 HydrophobicContact CE2-CB 4.23Å; F500-H542 HydrophobicContact CZ-CB 4.02Å; F538-H542 VanDerWaalsContact O-CB 3.28Å; F538-H542 WeakPolarHBondContact O-CB 3.29Å; F538-H542 PolarHBondContact O-N 3.37Å; V539-H542 PolarHBondContact O-N 3.46Å; E540-H542 VanDerWaalsContact C-N 3.29Å; E540-H542 PolarHBondContact O-N 3.06Å; H542-H544 VanDerWaalsContact C-N 3.31Å; H542-H544 PolarHBondContact O-N 3.06Å; H542-I545 WeakPolarHBondContact O-CB 3.42Å; H542-I545 PolarHBondContact O-N 2.79Å; H542-I546 WeakPolarHBondContact CE1-CD1 3.17Å; H542-I546 VanDerWaalsContact ND1-CD1 3.27Å; H542-I546 WeakPolarHBondContact ND1-CD1 3.15Å; H542-I546 WeakPolarHBondContact O-CG1 3.34Å; H542-I546 PolarHBondContact O-N 3.41Å
543	Q	74.3	Confident	68.3	Low	39 Å²	39	65.6 Å²	65.6	18%	0.182	30%	0.304	C	S	.	.	H	α-helix	trans	-62.3	-39.9	174.1	-75.6	-179.5	-37.6	0	0	111.2	Y15 V539 E540 I545 I546 Y547	Y15-Q543 HydrophobicContact CD2-CG 4.02Å; Y15-Q543 HydrophobicContact CE2-CG 3.89Å; V539-Q543 WeakPolarHBondContact O-CG 3.31Å; V539-Q543 PolarHBondContact O-N 2.91Å; E540-Q543 WeakPolarHBondContact O-CB 3.13Å; E540-Q543 PolarHBondContact O-N 3.48Å; E540-Q543 VanDerWaalsContact O-N 3.11Å; Q543-I545 VanDerWaalsContact C-N 3.31Å; Q543-I545 PolarHBondContact O-N 3.39Å; Q543-I546 PolarHBondContact O-N 2.69Å; Q543-Y547 HydrophobicContact CB-CD2 4.06Å; Q543-Y547 HydrophobicContact CB-CE2 3.95Å; Q543-Y547 HydrophobicContact CG-CE2 4.27Å; Q543-Y547 WeakPolarHBondContact O-CD2 3.48Å; Q543-Y547 PolarHBondContact O-N 2.74Å
544	H	70.6	Confident	66.9	Low	87 Å²	87	65.7 Å²	65.7	40%	0.403	31%	0.307	S	S	.	.	H	α-helix	trans	-60.4	-39.8	174	-84.5	-79.3	0	0	0	112.7	E540 S541 H542 N548	E540-H544 PolarHBondContact O-CD2 3.22Å; E540-H544 VanDerWaalsContact O-CD2 3.26Å; E540-H544 PolarHBondContact O-N 2.78Å; S541-H544 WeakPolarHBondContact O-CB 3.36Å; S541-H544 PolarHBondContact O-N 3.44Å; H542-H544 VanDerWaalsContact C-N 3.31Å; H542-H544 PolarHBondContact O-N 3.06Å; H544-N548 WeakPolarHBondContact O-CB 3.45Å; H544-N548 PolarHBondContact O-N 2.78Å
545	I	70.1	Confident	64.9	Low	44 Å²	44	65.3 Å²	65.3	23%	0.226	31%	0.311	C	S	.	.	H	α-helix	trans	-62.3	-45	174.7	-63.3	167.8	0	0	0	110.9	F500 A503 A504 S541 H542 Q543	F500-I545 HydrophobicContact CD2-CD1 3.71Å; F500-I545 HydrophobicContact CE2-CD1 3.55Å; F500-I545 HydrophobicContact CZ-CD1 4.26Å; A503-I545 HydrophobicContact CB-CD1 3.96Å; A503-I545 HydrophobicContact CB-CG1 4.12Å; A504-I545 HydrophobicContact CB-CD1 4.19Å; A504-I545 HydrophobicContact CB-CG1 3.91Å; S541-I545 WeakPolarHBondContact O-CG1 3.41Å; S541-I545 PolarHBondContact O-N 3.47Å; S541-I545 VanDerWaalsContact O-N 3.14Å; H542-I545 WeakPolarHBondContact O-CB 3.42Å; H542-I545 PolarHBondContact O-N 2.79Å; Q543-I545 VanDerWaalsContact C-N 3.31Å; Q543-I545 PolarHBondContact O-N 3.39Å
546	I	65.9	Low	63	Low	10 Å²	10	72.6 Å²	72.6	5%	0.051	34%	0.342	C	S	.	.	H	α-helix	trans	-64.5	-52.1	179	-69.2	165.9	0	0	0	111.7	D19 Q22 Y26 H542 Q543 N548 P549	D19-I546 HydrophobicContact CB-CG2 4.26Å; Q22-I546 PolarHBondContact OE1-O 2.95Å; Y26-I546 WeakPolarHBondContact OH-CG1 3.3Å; Y26-I546 WeakPolarHBondContact OH-CG2 3.43Å; H542-I546 WeakPolarHBondContact CE1-CD1 3.17Å; H542-I546 VanDerWaalsContact ND1-CD1 3.27Å; H542-I546 WeakPolarHBondContact ND1-CD1 3.15Å; H542-I546 WeakPolarHBondContact O-CG1 3.34Å; H542-I546 PolarHBondContact O-N 3.41Å; Q543-I546 PolarHBondContact O-N 2.69Å; I546-N548 VanDerWaalsContact C-N 3.33Å; I546-N548 PolarHBondContact O-N 3.41Å; I546-P549 WeakPolarHBondContact O-CD 3.33Å
547	Y	66.5	Low	60.9	Low	147 Å²	147	76.9 Å²	76.9	58%	0.576	36%	0.362	S	S	*	.	H	α-helix	trans	-75.5	-24.3	-171.3	-69.7	-58.7	0	0	0	113.1	Q543	Q543-Y547 HydrophobicContact CB-CD2 4.06Å; Q543-Y547 HydrophobicContact CB-CE2 3.95Å; Q543-Y547 HydrophobicContact CG-CE2 4.27Å; Q543-Y547 WeakPolarHBondContact O-CD2 3.48Å; Q543-Y547 PolarHBondContact O-N 2.74Å
548	N	64.3	Low	58.7	Low	75 Å²	75	80.8 Å²	80.8	40%	0.401	39%	0.391	S	S	.	.			trans	-133.6	57.3	-174.1	-69.6	-54.4	0	0	0	112.9	H544 I546 Y550 L551	H544-N548 WeakPolarHBondContact O-CB 3.45Å; H544-N548 PolarHBondContact O-N 2.78Å; I546-N548 VanDerWaalsContact C-N 3.33Å; I546-N548 PolarHBondContact O-N 3.41Å; N548-Y550 PolarHBondContact O-N 3.3Å; N548-Y550 VanDerWaalsContact O-N 3.15Å; N548-L551 HydrophobicContact CB-CB 4.42Å; N548-L551 HydrophobicContact CB-CD1 3.66Å; N548-L551 PolarHBondContact O-N 2.84Å
549	P	54.5	Low	57.5	Low	42 Å²	42	84.9 Å²	84.9	27%	0.273	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-64.1	-26.5	-174.4	25.2	-31.9	0	0	0	112.4	I546	I546-P549 WeakPolarHBondContact O-CD 3.33Å
550	Y	51.9	Low	56.6	Low	184 Å²	184	89.3 Å²	89.3	72%	0.722	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-94.3	0.9	-173.4	-55.8	-69.5	0	0	0	115.3	N548 N552	N548-Y550 PolarHBondContact O-N 3.3Å; N548-Y550 VanDerWaalsContact O-N 3.15Å; Y550-N552 PolarHBondContact O-N 2.83Å
551	L	50.9	Low	55.5	Low	100 Å²	100	89.2 Å²	89.2	52%	0.524	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-73.7	-7.8	175.6	-98.2	155.9	0	0	0	112.9	N548 K553	N548-L551 HydrophobicContact CB-CB 4.42Å; N548-L551 HydrophobicContact CB-CD1 3.66Å; N548-L551 PolarHBondContact O-N 2.84Å; L551-K553 PolarHBondContact O-N 3.24Å; L551-K553 VanDerWaalsContact O-N 3.14Å
552	N	46.8	Very low	54.2	Low	21 Å²	21	94.1 Å²	94.1	11%	0.112	46%	0.455	C	S	.	.			trans	-83.4	83.9	-179.2	-85.4	-50.9	0	0	0	113.4	H502 A503 Y550 N554 I555	H502-N552 PolarHBondContact O-OD1 2.8Å; A503-N552 PolarHBondContact O-ND2 2.91Å; Y550-N552 PolarHBondContact O-N 2.83Å; N552-N554 PolarHBondContact O-N 2.94Å; N552-I555 HydrophobicContact CB-CB 4.13Å; N552-I555 HydrophobicContact CB-CD1 3.42Å; N552-I555 VanDerWaalsContact CB-CD1 3.42Å; N552-I555 HydrophobicContact CB-CG1 3.56Å; N552-I555 VanDerWaalsContact CG-CG1 3.44Å; N552-I555 WeakPolarHBondContact ND2-CD1 3.39Å
553	K	41.7	Very low	52.6	Low	193 Å²	193	99.3 Å²	99.3	84%	0.839	48%	0.48	S	S	*	.	S	Bend	trans	-69.9	-10.5	155.7	-75.4	-174.3	177.2	-178.3	0	112.8	L551	L551-K553 PolarHBondContact O-N 3.24Å; L551-K553 VanDerWaalsContact O-N 3.14Å
554	N	42.2	Very low	51.2	Low	104 Å²	104	103.3 Å²	103.3	56%	0.556	50%	0.5	S	S	*	.	S	Bend	trans	-106.9	-3	-170.5	-72.2	-22.2	0	0	0	115.7	N552 F556 N557	N552-N554 PolarHBondContact O-N 2.94Å; N554-F556 PolarHBondContact O-N 3.14Å; N554-N557 PolarHBondContact O-N 3.25Å
555	I	39.4	Very low	49.8	Very low	82 Å²	82	104.4 Å²	104.4	42%	0.421	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-65.9	-25.2	178.9	-81.4	173.8	0	0	0	112.2	N552 N557	N552-I555 HydrophobicContact CB-CB 4.13Å; N552-I555 HydrophobicContact CB-CD1 3.42Å; N552-I555 VanDerWaalsContact CB-CD1 3.42Å; N552-I555 HydrophobicContact CB-CG1 3.56Å; N552-I555 VanDerWaalsContact CG-CG1 3.44Å; N552-I555 WeakPolarHBondContact ND2-CD1 3.39Å; I555-N557 VanDerWaalsContact C-N 3.31Å; I555-N557 PolarHBondContact O-N 3.23Å
556	F	36.2	Very low	48.2	Very low	174 Å²	174	109.1 Å²	109.1	76%	0.763	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-83.6	-0.5	-178.2	-63.5	-75.2	0	0	0	114.6	N554	N554-F556 PolarHBondContact O-N 3.14Å
557	N	34.5	Very low	46.8	Very low	142 Å²	142	117.3 Å²	117.3	76%	0.759	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-107.8	11.9	-179	-78.7	-12	0	0	0	113.9	N554 I555	N554-N557 PolarHBondContact O-N 3.25Å; I555-N557 VanDerWaalsContact C-N 3.31Å; I555-N557 PolarHBondContact O-N 3.23Å
558	V	32.6	Very low	45	Very low	144 Å²	144	114.6 Å²	114.6	87%	0.873	57%	0.567	S	S	*	*			trans	-117.2	0	174.4	-174.7	0	0	0	0	108.8	V499	V499-V558 HydrophobicContact CG2-CG1 4.28Å

Retrieved 558 of 558 residues in 629.4 ms (Link to these results)

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