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Isoform 3 of Ran-binding protein 9 AlphaSync

Canonical isoform description: May act as scaffolding protein, and as adapter protein to couple membrane receptors to intracellular signaling pathways (Probable). Acts as a mediator of cell spreading and actin cytoskeleton rearrangement¹. Core component of the CTLH E3 ubiquitin-protein ligase complex that selectively accepts ubiquitin from UBE2H and mediates ubiquitination and subsequent proteasomal degradation of the transcription factor HBP1². May be involved in signaling of ITGB2/LFA-1 and other integrins³. Enhances HGF-MET signaling by recruiting Sos and activating the Ras pathway⁴. Enhances dihydrotestosterone-induced transactivation activity of AR, as well as dexamethasone-induced transactivation activity of NR3C1, but not affect estrogen-induced transactivation^5,6. Stabilizes TP73 isoform Alpha, probably by inhibiting its ubiquitination, and increases its proapoptotic activity⁷. Inhibits the kinase activity of DYRK1A and DYRK1B. Inhibits FMR1 binding to RNA.

AlphaFold DB , UniProt , Accession Q96S59-3 (canonical: Q96S59), Species HUMAN (Homo sapiens, Human), Gene RANBP9, Length 500 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	97.5	Very high	98.2	Very high	39 Å²	39	42.5 Å²	42.5	19%	0.192	26%	0.261	C	S	.	.				0	137.2	0	-53.4	-178.6	-79.7	0	0	109.8	G27 F46 G88 L89 E94 V96	M1-G27 PolarHBondContact O-N 2.9Å; M1-F46 HydrophobicContact CB-CE2 4.43Å; M1-F46 HydrophobicContact CE-CD2 4.22Å; M1-F46 HydrophobicContact CE-CE2 4.22Å; M1-G88 WeakPolarHBondContact CA-O 3.5Å; M1-L89 HydrophobicContact CB-CD2 4.22Å; M1-L89 HydrophobicContact CG-CD2 3.87Å; M1-L89 HydrophobicContact SD-CD2 4.49Å; M1-E94 WeakPolarHBondContact CA-OE1 3.49Å; M1-E94 HydrophobicContact CG-CB 4.29Å; M1-E94 VanDerWaalsContact CG-CD 3.48Å; M1-E94 HydrophobicContact CG-CG 3.9Å; M1-E94 WeakPolarHBondContact CG-OE1 3.28Å; M1-E94 PolarHBondContact N-OE1 3.05Å; M1-V96 HydrophobicContact SD-CG1 3.53Å; M1-V96 VanDerWaalsContact SD-CG1 3.53Å
2	G	98.5	Very high	98.2	Very high	0 Å²	0	51 Å²	51	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	134.6	172.2	0	0	0	0	0	112	Y25 V87 G88	G2-Y25 WeakPolarHBondContact CA-O 3.38Å; G2-V87 WeakPolarHBondContact O-CA 3.45Å; G2-G88 PolarHBondContact N-O 2.85Å; G2-G88 PolarHBondContact O-N 3.23Å
3	I	98.9	Very high	98.1	Very high	29 Å²	29	58.3 Å²	58.3	15%	0.149	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	135.7	-173	-59.3	170.4	0	0	0	109.6	G24 Y25 F46 I52 Y65 V87	I3-G24 CarbonylContact O-C 3.32Å; I3-G24 WeakPolarHBondContact O-CA 3.4Å; I3-Y25 PolarHBondContact N-O 3.48Å; I3-Y25 PolarHBondContact O-N 3.25Å; I3-F46 HydrophobicContact CD1-CE2 3.86Å; I3-F46 HydrophobicContact CD1-CZ 3.87Å; I3-F46 HydrophobicContact CG1-CZ 4.33Å; I3-I52 HydrophobicContact CD1-CB 3.75Å; I3-I52 HydrophobicContact CD1-CG1 4.15Å; I3-I52 HydrophobicContact CD1-CG2 3.96Å; I3-Y65 HydrophobicContact CG2-CE1 4.41Å; I3-Y65 VanDerWaalsContact O-CE1 3.29Å; I3-Y65 WeakPolarHBondContact O-CE1 3.4Å; I3-Y65 PolarHBondContact O-OH 3.49Å; I3-V87 HydrophobicContact CG1-CG1 4.15Å; I3-V87 HydrophobicContact CG1-CG2 4.39Å; I3-V87 HydrophobicContact CG2-CG2 4.41Å
4	G	98.7	Very high	98	Very high	3 Å²	3	60.8 Å²	60.8	3%	0.031	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.5	-130.3	173.1	0	0	0	0	0	114.8	Y23 Y65 P85 T86	G4-Y23 CarbonylContact C-O 3.52Å; G4-Y23 WeakPolarHBondContact CA-O 3.45Å; G4-Y65 VanDerWaalsContact CA-OH 3.26Å; G4-Y65 WeakPolarHBondContact CA-OH 3.49Å; G4-P85 WeakPolarHBondContact O-CA 3.43Å; G4-T86 PolarHBondContact N-O 3.42Å; G4-T86 PolarHBondContact O-N 3.35Å
5	L	98.9	Very high	98	Very high	7 Å²	7	57.5 Å²	57.5	4%	0.037	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	140.7	-166.3	-56.4	170.7	0	0	0	110.7	S22 Y23 V56 C63 L79 L83 Y84	L5-S22 CarbonylContact O-C 3.58Å; L5-S22 WeakPolarHBondContact O-CA 3.26Å; L5-Y23 HydrophobicContact CB-CD2 4.46Å; L5-Y23 PolarHBondContact N-O 2.82Å; L5-Y23 PolarHBondContact O-N 3.07Å; L5-V56 HydrophobicContact CD1-CG1 4.44Å; L5-V56 HydrophobicContact CD1-CG2 3.62Å; L5-V56 HydrophobicContact CD2-CG2 3.84Å; L5-V56 HydrophobicContact CG-CG2 4.3Å; L5-C63 HydrophobicContact CD1-CB 4.32Å; L5-L79 HydrophobicContact CD1-CD1 4.11Å; L5-L83 HydrophobicContact CB-CB 4.16Å; L5-L83 HydrophobicContact CB-CD1 4.05Å; L5-L83 HydrophobicContact CD1-CD1 3.94Å; L5-Y84 CarbonylContact C-O 3.6Å; L5-Y84 VanDerWaalsContact CA-O 3.28Å; L5-Y84 WeakPolarHBondContact CA-O 3.28Å
6	S	98.6	Very high	98.1	Very high	7 Å²	7	54.1 Å²	54.1	5%	0.049	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	144.1	170.5	61.5	0	0	0	0	112.9	H21 Y84 T86	S6-H21 WeakPolarHBondContact CA-O 3.32Å; S6-Y84 PolarHBondContact N-O 2.87Å; S6-Y84 PolarHBondContact O-N 3.48Å; S6-T86 PolarHBondContact OG-OG1 3.36Å
7	A	98.4	Very high	98.1	Very high	23 Å²	23	50.9 Å²	50.9	19%	0.19	28%	0.282	C	S	.	.			trans	-67.6	160.9	171.2	0	0	0	0	0	111.9	G9 V10 H21 L83	A7-G9 PolarHBondContact O-N 3.14Å; A7-V10 HydrophobicContact CB-CG2 4.34Å; A7-V10 WeakPolarHBondContact O-CG2 3.35Å; A7-V10 PolarHBondContact O-N 3.28Å; A7-H21 HydrophobicContact CB-CB 3.65Å; A7-H21 PolarHBondContact N-O 3.25Å; A7-L83 HydrophobicContact CB-CD2 4.14Å
8	Q	98.2	Very high	98.1	Very high	165 Å²	165	51.2 Å²	51.2	77%	0.771	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	134.5	172.2	-170.2	179.2	19.4	0	0	110.7	Y84	Q8-Y84 HydrophobicContact CB-CE2 4.13Å
9	G	97.5	Very high	98.1	Very high	81 Å²	81	50.7 Å²	50.7	84%	0.835	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	2.6	178.2	0	0	0	0	0	115.5	A7	A7-G9 PolarHBondContact O-N 3.14Å
10	V	97.8	Very high	98.1	Very high	25 Å²	25	56.5 Å²	56.5	15%	0.152	30%	0.298	C	S	.	.			trans	-60.5	144.8	165.7	170.9	0	0	0	0	110.1	A7 M12 D19	A7-V10 HydrophobicContact CB-CG2 4.34Å; A7-V10 WeakPolarHBondContact O-CG2 3.35Å; A7-V10 PolarHBondContact O-N 3.28Å; V10-M12 PolarHBondContact O-N 3.34Å; V10-D19 HydrophobicContact CG1-CB 4.32Å
11	N	97.5	Very high	98.1	Very high	88 Å²	88	58.6 Å²	58.6	47%	0.471	31%	0.306	S	S	.	.			trans	-71.6	116.7	-177.3	177.7	9.8	0	0	0	111.3	N13 D19	N11-N13 PolarHBondContact O-N 3.48Å; N11-N13 WeakPolarHBondContact OD1-CB 3.3Å; N11-N13 PolarHBondContact OD1-N 3.1Å; N11-D19 WeakPolarHBondContact CB-OD2 3.42Å
12	M	97.7	Very high	98.1	Very high	145 Å²	145	57 Å²	57	71%	0.714	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-6.8	-178.2	-59.3	-57.6	-64.6	0	0	114.3	V10 R14 T86	V10-M12 PolarHBondContact O-N 3.34Å; M12-R14 PolarHBondContact O-N 2.86Å; M12-T86 HydrophobicContact CE-CG2 4.28Å
13	N	97.6	Very high	98.1	Very high	146 Å²	146	57.8 Å²	57.8	78%	0.781	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	24.7	175.8	-165.1	43	0	0	0	113	N11	N11-N13 PolarHBondContact O-N 3.48Å; N11-N13 WeakPolarHBondContact OD1-CB 3.3Å; N11-N13 PolarHBondContact OD1-N 3.1Å
14	R	96.7	Very high	98.1	Very high	93 Å²	93	56.4 Å²	56.4	35%	0.351	29%	0.294	S	S	.	.	S	Bend	trans	-145.6	154.9	-176.9	-62.8	-158.9	87.4	-152.3	-10.3	110.1	M12 W18 D19	M12-R14 PolarHBondContact O-N 2.86Å; R14-W18 HydrophobicContact CB-CB 4.42Å; R14-W18 HydrophobicContact CB-CE3 3.92Å; R14-W18 HydrophobicContact CG-CE3 4.35Å; R14-W18 PolarHBondContact NH1-O 3.23Å; R14-D19 WeakPolarHBondContact CD-OD1 3.19Å; R14-D19 WeakPolarHBondContact CD-OD2 3.39Å; R14-D19 IonicContact CZ-OD1 3.72Å; R14-D19 IonicContact NE-OD1 3.99Å; R14-D19 IonicContact NH1-OD1 2.65Å; R14-D19 PolarHBondContact NH1-OD1 3.39Å
15	L	98.1	Very high	98.1	Very high	11 Å²	11	56.2 Å²	56.2	6%	0.058	29%	0.293	C	S	.	.			trans	-71.2	150.5	173.9	-64	-178.5	0	0	0	111.2	W18 H26 G88 Q90	L15-W18 HydrophobicContact CB-CD2 4.1Å; L15-W18 HydrophobicContact CB-CE3 4.27Å; L15-W18 HydrophobicContact CB-CH2 4.45Å; L15-W18 HydrophobicContact CB-CZ2 4.29Å; L15-W18 HydrophobicContact CB-CZ3 4.45Å; L15-W18 HydrophobicContact CD1-CH2 3.99Å; L15-W18 HydrophobicContact CD1-CZ2 3.84Å; L15-W18 HydrophobicContact CG-CH2 4.13Å; L15-W18 HydrophobicContact CG-CZ2 4.25Å; L15-W18 HydrophobicContact CG-CZ3 4.34Å; L15-W18 WeakPolarHBondContact O-CB 3.43Å; L15-W18 PolarHBondContact O-N 2.84Å; L15-H26 VanDerWaalsContact CB-CE1 3.41Å; L15-H26 WeakPolarHBondContact CB-CE1 3.24Å; L15-G88 WeakPolarHBondContact CD2-O 3.39Å; L15-Q90 HydrophobicContact CD2-CB 4.46Å
16	P	98.5	Very high	98.1	Very high	3 Å²	3	56 Å²	56	2%	0.019	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	141.8	174.8	-28.5	35.7	0	0	0	112.6	H26 T86	P16-H26 PolarHBondContact O-NE2 3.25Å; P16-T86 HydrophobicContact CG-CG2 4Å
17	G	98.6	Very high	98.1	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.1	-25.2	-177.4	0	0	0	0	0	115.8	D19 S22 F33 S35 S36	G17-D19 PolarHBondContact O-N 3.09Å; G17-S22 VanDerWaalsContact CA-C 3.47Å; G17-S22 WeakPolarHBondContact CA-O 3.4Å; G17-S22 PolarHBondContact N-OG 3.03Å; G17-F33 WeakPolarHBondContact CA-O 3.47Å; G17-S35 CarbonylContact O-C 3.53Å; G17-S35 WeakPolarHBondContact O-CA 3.35Å; G17-S35 PolarHBondContact O-N 3.26Å; G17-S36 CarbonylContact O-C 3.45Å; G17-S36 PolarHBondContact O-N 3.11Å
18	W	98.2	Very high	98.1	Very high	57 Å²	57	60.4 Å²	60.4	22%	0.216	31%	0.313	C	S	.	.	S	Bend	trans	-76.3	-20.1	-169.4	-78.4	3.5	0	0	0	116.6	R14 L15 H26 F33 G37	R14-W18 HydrophobicContact CB-CB 4.42Å; R14-W18 HydrophobicContact CB-CE3 3.92Å; R14-W18 HydrophobicContact CG-CE3 4.35Å; R14-W18 PolarHBondContact NH1-O 3.23Å; L15-W18 HydrophobicContact CB-CD2 4.1Å; L15-W18 HydrophobicContact CB-CE3 4.27Å; L15-W18 HydrophobicContact CB-CH2 4.45Å; L15-W18 HydrophobicContact CB-CZ2 4.29Å; L15-W18 HydrophobicContact CB-CZ3 4.45Å; L15-W18 HydrophobicContact CD1-CH2 3.99Å; L15-W18 HydrophobicContact CD1-CZ2 3.84Å; L15-W18 HydrophobicContact CG-CH2 4.13Å; L15-W18 HydrophobicContact CG-CZ2 4.25Å; L15-W18 HydrophobicContact CG-CZ3 4.34Å; L15-W18 WeakPolarHBondContact O-CB 3.43Å; L15-W18 PolarHBondContact O-N 2.84Å; W18-H26 AromaticContact CD1-CE1 3.9Å; W18-H26 AromaticContact CE2-CE1 3.84Å; W18-H26 AromaticContact NE1-CE1 3.31Å; W18-H26 PolarHBondContact NE1-CE1 2.72Å; W18-H26 VanDerWaalsContact NE1-CE1 3.31Å; W18-F33 AromaticContact CD1-CD1 3.47Å; W18-F33 VanDerWaalsContact CD1-CD1 3.47Å; W18-F33 AromaticContact CD1-CE1 3.9Å; W18-F33 AromaticContact NE1-CD1 3.56Å; W18-F33 AromaticContact NE1-CE1 3.49Å; W18-G37 PolarHBondContact O-N 3.22Å
19	D	97.9	Very high	98.1	Very high	41 Å²	41	55.3 Å²	55.3	22%	0.219	29%	0.291	C	S	.	.	S	Bend	trans	-120.1	164.4	-179.4	-73.9	-27.8	0	0	0	111.1	V10 N11 R14 G17 S22 S35	V10-D19 HydrophobicContact CG1-CB 4.32Å; N11-D19 WeakPolarHBondContact CB-OD2 3.42Å; R14-D19 WeakPolarHBondContact CD-OD1 3.19Å; R14-D19 WeakPolarHBondContact CD-OD2 3.39Å; R14-D19 IonicContact CZ-OD1 3.72Å; R14-D19 IonicContact NE-OD1 3.99Å; R14-D19 IonicContact NH1-OD1 2.65Å; R14-D19 PolarHBondContact NH1-OD1 3.39Å; G17-D19 PolarHBondContact O-N 3.09Å; D19-S22 WeakPolarHBondContact O-CB 3.25Å; D19-S22 PolarHBondContact O-N 3.25Å; D19-S22 VanDerWaalsContact O-N 3.07Å; D19-S35 WeakPolarHBondContact O-CA 3.35Å
20	K	97.8	Very high	98.2	Very high	166 Å²	166	51.5 Å²	51.5	72%	0.722	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	139	179.8	-65.8	-173.7	179.1	-176	0	112.4	S22	K20-S22 PolarHBondContact O-N 3.23Å
21	H	97.7	Very high	98.2	Very high	102 Å²	102	52.9 Å²	52.9	47%	0.472	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	27.6	-175.2	-48.5	-61.4	0	0	0	113.5	S6 A7 S35	S6-H21 WeakPolarHBondContact CA-O 3.32Å; A7-H21 HydrophobicContact CB-CB 3.65Å; A7-H21 PolarHBondContact N-O 3.25Å; H21-S35 PolarHBondContact N-OG 2.91Å
22	S	98.7	Very high	98.3	Very high	4 Å²	4	49.3 Å²	49.3	3%	0.028	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	144	169	-158.6	0	0	0	0	108.8	L5 G17 D19 K20 S35	L5-S22 CarbonylContact O-C 3.58Å; L5-S22 WeakPolarHBondContact O-CA 3.26Å; G17-S22 VanDerWaalsContact CA-C 3.47Å; G17-S22 WeakPolarHBondContact CA-O 3.4Å; G17-S22 PolarHBondContact N-OG 3.03Å; D19-S22 WeakPolarHBondContact O-CB 3.25Å; D19-S22 PolarHBondContact O-N 3.25Å; D19-S22 VanDerWaalsContact O-N 3.07Å; K20-S22 PolarHBondContact O-N 3.23Å; S22-S35 WeakPolarHBondContact O-CA 3.41Å; S22-S35 PolarHBondContact O-N 2.77Å; S22-S35 PolarHBondContact O-OG 3.14Å
23	Y	98.9	Very high	98.3	Very high	17 Å²	17	43 Å²	43	7%	0.067	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	129.4	-174.4	-55.4	-90.8	0	0	0	108.1	G4 L5 F33 C34 F76 L79 P80 L83	G4-Y23 CarbonylContact C-O 3.52Å; G4-Y23 WeakPolarHBondContact CA-O 3.45Å; L5-Y23 HydrophobicContact CB-CD2 4.46Å; L5-Y23 PolarHBondContact N-O 2.82Å; L5-Y23 PolarHBondContact O-N 3.07Å; Y23-F33 WeakPolarHBondContact CA-O 3.31Å; Y23-C34 VanDerWaalsContact CE1-SG 3.59Å; Y23-F76 HydrophobicContact CD1-CB 4.3Å; Y23-F76 HydrophobicContact CD1-CD1 4.04Å; Y23-F76 HydrophobicContact CD1-CD2 4.19Å; Y23-F76 HydrophobicContact CD1-CE1 4.47Å; Y23-F76 AromaticContact CD1-CG 3.9Å; Y23-F76 HydrophobicContact CD1-CG 3.9Å; Y23-F76 HydrophobicContact CG-CD2 4.36Å; Y23-L79 HydrophobicContact CD1-CD2 3.63Å; Y23-L79 HydrophobicContact CD2-CD2 3.92Å; Y23-L79 HydrophobicContact CE1-CD2 3.55Å; Y23-L79 HydrophobicContact CE2-CD2 3.87Å; Y23-L79 HydrophobicContact CG-CD2 3.83Å; Y23-P80 HydrophobicContact CE2-CG 4.15Å; Y23-P80 WeakPolarHBondContact OH-CD 3.4Å; Y23-L83 HydrophobicContact CD2-CD1 4.14Å; Y23-L83 HydrophobicContact CD2-CD2 4.27Å; Y23-L83 HydrophobicContact CE2-CD1 4.14Å; Y23-L83 HydrophobicContact CE2-CD2 4.12Å
24	G	98.8	Very high	98.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	152.5	-173	0	0	0	0	0	114.9	I3 S32 F33 Y65	I3-G24 CarbonylContact O-C 3.32Å; I3-G24 WeakPolarHBondContact O-CA 3.4Å; G24-S32 CarbonylContact O-C 3.51Å; G24-S32 WeakPolarHBondContact O-CA 3.46Å; G24-F33 PolarHBondContact N-O 2.83Å; G24-F33 PolarHBondContact O-N 3.26Å; G24-Y65 WeakPolarHBondContact CA-OH 3.35Å
25	Y	98.9	Very high	98.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	124.6	172.2	168.4	-143.5	0	0	0	108.1	G2 I3 H31 Y42 P44 F46 I52 Y65 L72	G2-Y25 WeakPolarHBondContact CA-O 3.38Å; I3-Y25 PolarHBondContact N-O 3.48Å; I3-Y25 PolarHBondContact O-N 3.25Å; Y25-H31 WeakPolarHBondContact CA-O 3.46Å; Y25-Y42 HydrophobicContact CD1-CE1 4.41Å; Y25-Y42 AromaticContact CD2-CD1 3.8Å; Y25-Y42 HydrophobicContact CD2-CD1 3.8Å; Y25-Y42 HydrophobicContact CD2-CE1 4.25Å; Y25-Y42 HydrophobicContact CE2-CD1 4.01Å; Y25-Y42 HydrophobicContact CE2-CE1 4.43Å; Y25-Y42 HydrophobicContact CG-CD1 4.21Å; Y25-Y42 HydrophobicContact CG-CE1 4.25Å; Y25-P44 PolarHBondContact OH-O 3.35Å; Y25-F46 HydrophobicContact CD1-CD1 4.43Å; Y25-F46 AromaticContact CD1-CE1 3.8Å; Y25-F46 HydrophobicContact CD1-CE1 3.8Å; Y25-F46 HydrophobicContact CD2-CE1 4.21Å; Y25-F46 AromaticContact CE1-CD1 3.8Å; Y25-F46 HydrophobicContact CE1-CD1 3.8Å; Y25-F46 AromaticContact CE1-CE1 3.63Å; Y25-F46 HydrophobicContact CE1-CE1 3.63Å; Y25-F46 HydrophobicContact CE2-CD1 4.25Å; Y25-F46 HydrophobicContact CE2-CE1 4.03Å; Y25-F46 HydrophobicContact CG-CE1 4.09Å; Y25-F46 AromaticContact CZ-CD1 3.68Å; Y25-F46 AromaticContact CZ-CE1 3.74Å; Y25-I52 HydrophobicContact CD1-CG2 3.96Å; Y25-I52 HydrophobicContact CE1-CD1 4.28Å; Y25-I52 HydrophobicContact CE1-CG2 4.02Å; Y25-Y65 VanDerWaalsContact CB-CZ 3.44Å; Y25-Y65 AromaticContact CD1-CD1 3.69Å; Y25-Y65 HydrophobicContact CD1-CD1 3.69Å; Y25-Y65 HydrophobicContact CD1-CD2 4.11Å; Y25-Y65 HydrophobicContact CD1-CE1 4.24Å; Y25-Y65 AromaticContact CD1-CG 3.59Å; Y25-Y65 HydrophobicContact CD1-CG 3.59Å; Y25-Y65 HydrophobicContact CE1-CG 4.41Å; Y25-Y65 HydrophobicContact CG-CD1 4.31Å; Y25-Y65 HydrophobicContact CG-CD2 4.22Å; Y25-Y65 HydrophobicContact CG-CE1 4.5Å; Y25-Y65 HydrophobicContact CG-CE2 4.43Å; Y25-Y65 HydrophobicContact CG-CG 4.14Å; Y25-Y65 PolarHBondContact N-OH 2.93Å; Y25-L72 HydrophobicContact CE1-CD1 3.73Å
26	H	98.8	Very high	98.4	Very high	3 Å²	3	38.3 Å²	38.3	1%	0.014	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	137.8	-168.7	-71.4	-141	0	0	0	110.8	L15 P16 W18 G30 H31 F33	L15-H26 VanDerWaalsContact CB-CE1 3.41Å; L15-H26 WeakPolarHBondContact CB-CE1 3.24Å; P16-H26 PolarHBondContact O-NE2 3.25Å; W18-H26 AromaticContact CD1-CE1 3.9Å; W18-H26 AromaticContact CE2-CE1 3.84Å; W18-H26 AromaticContact NE1-CE1 3.31Å; W18-H26 PolarHBondContact NE1-CE1 2.72Å; W18-H26 VanDerWaalsContact NE1-CE1 3.31Å; H26-G30 VanDerWaalsContact O-CA 3.25Å; H26-G30 WeakPolarHBondContact O-CA 3.4Å; H26-G30 PolarHBondContact O-N 3.41Å; H26-H31 PolarHBondContact N-O 2.95Å; H26-F33 HydrophobicContact CB-CD2 4.26Å; H26-F33 HydrophobicContact CB-CE2 3.82Å; H26-F33 AromaticContact CD2-CD2 3.37Å; H26-F33 WeakPolarHBondContact CD2-CD2 3.44Å; H26-F33 AromaticContact CD2-CE2 3.75Å; H26-F33 AromaticContact CE1-CD2 3.98Å; H26-F33 AromaticContact CG-CD2 3.67Å; H26-F33 AromaticContact CG-CE2 3.52Å; H26-F33 AromaticContact ND1-CE2 3.76Å; H26-F33 AromaticContact NE2-CD2 3.61Å; H26-F33 AromaticContact NE2-CG 3.96Å
27	G	98.5	Very high	98.2	Very high	6 Å²	6	40.3 Å²	40.3	6%	0.062	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-23.1	-169	0	0	0	0	0	115	M1 T45 F46	M1-G27 PolarHBondContact O-N 2.9Å; G27-T45 WeakPolarHBondContact O-CA 3.45Å; G27-T45 WeakPolarHBondContact O-CB 3.31Å; G27-F46 VanDerWaalsContact CA-CZ 3.4Å; G27-F46 PolarHBondContact O-N 3.05Å
28	D	98.2	Very high	98.2	Very high	116 Å²	116	45 Å²	45	62%	0.62	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-34.6	-176.1	51.7	-64.4	0	0	0	113.5	T45	D28-T45 WeakPolarHBondContact O-CG2 3.41Å
29	D	98.2	Very high	98.1	Very high	58 Å²	58	43 Å²	43	31%	0.31	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-11.7	178.5	67.8	2	0	0	0	114.2	H31	D29-H31 PolarHBondContact O-CE1 2.95Å; D29-H31 PolarHBondContact O-N 3.03Å; D29-H31 PolarHBondContact O-ND1 3.25Å; D29-H31 WeakPolarHBondContact OD1-CB 3.34Å; D29-H31 IonicContact OD1-CG 3.55Å; D29-H31 PolarHBondContact OD1-N 3.31Å; D29-H31 IonicContact OD1-ND1 2.64Å; D29-H31 WeakPolarHBondContact OD2-CB 3.4Å; D29-H31 IonicContact OD2-CG 2.94Å; D29-H31 IonicContact OD2-ND1 3.39Å
30	G	98.6	Very high	98.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.262	C	S	.	.			trans	72	11.4	-175.8	0	0	0	0	0	114.4	H26 G43 P44	H26-G30 VanDerWaalsContact O-CA 3.25Å; H26-G30 WeakPolarHBondContact O-CA 3.4Å; H26-G30 PolarHBondContact O-N 3.41Å; G30-G43 PolarHBondContact O-N 3.36Å; G30-P44 WeakPolarHBondContact CA-O 3.2Å
31	H	98.8	Very high	98.2	Very high	54 Å²	54	43.5 Å²	43.5	25%	0.25	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	152.8	-174.9	-70.3	43.1	0	0	0	112.3	Y25 H26 D29 F33 Q40	Y25-H31 WeakPolarHBondContact CA-O 3.46Å; H26-H31 PolarHBondContact N-O 2.95Å; D29-H31 PolarHBondContact O-CE1 2.95Å; D29-H31 PolarHBondContact O-N 3.03Å; D29-H31 PolarHBondContact O-ND1 3.25Å; D29-H31 WeakPolarHBondContact OD1-CB 3.34Å; D29-H31 IonicContact OD1-CG 3.55Å; D29-H31 PolarHBondContact OD1-N 3.31Å; D29-H31 IonicContact OD1-ND1 2.64Å; D29-H31 WeakPolarHBondContact OD2-CB 3.4Å; D29-H31 IonicContact OD2-CG 2.94Å; D29-H31 IonicContact OD2-ND1 3.39Å; H31-F33 HydrophobicContact CB-CD2 4.46Å; H31-F33 HydrophobicContact CB-CE2 3.84Å; H31-F33 HydrophobicContact CB-CZ 4.46Å; H31-Q40 CarbonylContact C-O 3.56Å; H31-Q40 VanDerWaalsContact CA-O 3.3Å; H31-Q40 WeakPolarHBondContact CA-O 3.4Å; H31-Q40 WeakPolarHBondContact CB-O 3.47Å; H31-Q40 VanDerWaalsContact CD2-C 3.43Å
32	S	98.7	Very high	98.2	Very high	13 Å²	13	40.8 Å²	40.8	9%	0.091	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	138.3	168.1	70.4	0	0	0	0	110.6	G24 G39 Q40	G24-S32 CarbonylContact O-C 3.51Å; G24-S32 WeakPolarHBondContact O-CA 3.46Å; S32-G39 CarbonylContact O-C 3.53Å; S32-G39 VanDerWaalsContact O-CA 3.28Å; S32-G39 WeakPolarHBondContact O-CA 3.35Å; S32-Q40 PolarHBondContact N-O 3.03Å; S32-Q40 PolarHBondContact O-N 3.13Å; S32-Q40 PolarHBondContact OG-O 2.65Å
33	F	98.7	Very high	98.2	Very high	13 Å²	13	41.8 Å²	41.8	6%	0.057	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	110.4	-180	-69.7	-102.5	0	0	0	108	G17 W18 Y23 G24 H26 H31	G17-F33 WeakPolarHBondContact CA-O 3.47Å; W18-F33 AromaticContact CD1-CD1 3.47Å; W18-F33 VanDerWaalsContact CD1-CD1 3.47Å; W18-F33 AromaticContact CD1-CE1 3.9Å; W18-F33 AromaticContact NE1-CD1 3.56Å; W18-F33 AromaticContact NE1-CE1 3.49Å; Y23-F33 WeakPolarHBondContact CA-O 3.31Å; G24-F33 PolarHBondContact N-O 2.83Å; G24-F33 PolarHBondContact O-N 3.26Å; H26-F33 HydrophobicContact CB-CD2 4.26Å; H26-F33 HydrophobicContact CB-CE2 3.82Å; H26-F33 AromaticContact CD2-CD2 3.37Å; H26-F33 WeakPolarHBondContact CD2-CD2 3.44Å; H26-F33 AromaticContact CD2-CE2 3.75Å; H26-F33 AromaticContact CE1-CD2 3.98Å; H26-F33 AromaticContact CG-CD2 3.67Å; H26-F33 AromaticContact CG-CE2 3.52Å; H26-F33 AromaticContact ND1-CE2 3.76Å; H26-F33 AromaticContact NE2-CD2 3.61Å; H26-F33 AromaticContact NE2-CG 3.96Å; H31-F33 HydrophobicContact CB-CD2 4.46Å; H31-F33 HydrophobicContact CB-CE2 3.84Å; H31-F33 HydrophobicContact CB-CZ 4.46Å
34	C	98.4	Very high	98.2	Very high	65 Å²	65	43.8 Å²	43.8	44%	0.439	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	95.9	-175.9	-173.5	0	0	0	0	109.9	Y23 S36 F76	Y23-C34 VanDerWaalsContact CE1-SG 3.59Å; C34-S36 WeakPolarHBondContact O-CB 3.49Å; C34-S36 PolarHBondContact O-N 3.15Å; C34-F76 HydrophobicContact CB-CD1 3.8Å; C34-F76 HydrophobicContact CB-CE1 3.8Å
35	S	98	Very high	98.2	Very high	40 Å²	40	47.5 Å²	47.5	28%	0.28	29%	0.293	S	S	.	.	S	Bend	trans	49.5	33.9	-179.5	-70.1	0	0	0	0	115	G17 D19 H21 S22	G17-S35 CarbonylContact O-C 3.53Å; G17-S35 WeakPolarHBondContact O-CA 3.35Å; G17-S35 PolarHBondContact O-N 3.26Å; D19-S35 WeakPolarHBondContact O-CA 3.35Å; H21-S35 PolarHBondContact N-OG 2.91Å; S22-S35 WeakPolarHBondContact O-CA 3.41Å; S22-S35 PolarHBondContact O-N 2.77Å; S22-S35 PolarHBondContact O-OG 3.14Å
36	S	97.1	Very high	98.2	Very high	46 Å²	46	48.2 Å²	48.2	32%	0.322	30%	0.296	S	S	.	.	S	Bend	trans	-155.2	142.7	-169.3	179	0	0	0	0	111.1	G17 C34 T38	G17-S36 CarbonylContact O-C 3.45Å; G17-S36 PolarHBondContact O-N 3.11Å; C34-S36 WeakPolarHBondContact O-CB 3.49Å; C34-S36 PolarHBondContact O-N 3.15Å; S36-T38 PolarHBondContact O-N 3Å; S36-T38 PolarHBondContact OG-N 3.27Å; S36-T38 VanDerWaalsContact OG-N 3.13Å
37	G	94.9	Very high	98.2	Very high	45 Å²	45	52.5 Å²	52.5	46%	0.464	32%	0.323	S	S	.	.	S	Bend	trans	-74.1	-1.9	170.5	0	0	0	0	0	114.6	W18	W18-G37 PolarHBondContact O-N 3.22Å
38	T	97.6	Very high	98.2	Very high	99 Å²	99	58.8 Å²	58.8	61%	0.607	36%	0.36	S	S	*	.	S	Bend	trans	-104.9	115.4	175.4	-54	0	0	0	0	109.7	S36	S36-T38 PolarHBondContact O-N 3Å; S36-T38 PolarHBondContact OG-N 3.27Å; S36-T38 VanDerWaalsContact OG-N 3.13Å
39	G	97.7	Very high	98.2	Very high	14 Å²	14	56.9 Å²	56.9	14%	0.144	37%	0.368	C	S	.	.			trans	-73.4	160.8	177.3	0	0	0	0	0	112.9	S32	S32-G39 CarbonylContact O-C 3.53Å; S32-G39 VanDerWaalsContact O-CA 3.28Å; S32-G39 WeakPolarHBondContact O-CA 3.35Å
40	Q	98.4	Very high	98.2	Very high	117 Å²	117	56.3 Å²	56.3	55%	0.547	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	139.8	169.3	-64	-59.4	-54.5	0	0	109.6	H31 S32 Y42	H31-Q40 CarbonylContact C-O 3.56Å; H31-Q40 VanDerWaalsContact CA-O 3.3Å; H31-Q40 WeakPolarHBondContact CA-O 3.4Å; H31-Q40 WeakPolarHBondContact CB-O 3.47Å; H31-Q40 VanDerWaalsContact CD2-C 3.43Å; S32-Q40 PolarHBondContact N-O 3.03Å; S32-Q40 PolarHBondContact O-N 3.13Å; S32-Q40 PolarHBondContact OG-O 2.65Å; Q40-Y42 PolarHBondContact O-N 2.89Å
41	P	98.6	Very high	98.3	Very high	102 Å²	102	59.8 Å²	59.8	66%	0.662	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.9	129.4	175.3	-24.4	33.1	0	0	0	110.9
42	Y	98.8	Very high	98.3	Very high	45 Å²	45	58.7 Å²	58.7	18%	0.176	38%	0.381	C	S	.	.			trans	-139.3	-61.3	-173.9	168.6	-113.6	0	0	0	112.5	Y25 Q40 Y65 L72 G73 A75	Y25-Y42 HydrophobicContact CD1-CE1 4.41Å; Y25-Y42 AromaticContact CD2-CD1 3.8Å; Y25-Y42 HydrophobicContact CD2-CD1 3.8Å; Y25-Y42 HydrophobicContact CD2-CE1 4.25Å; Y25-Y42 HydrophobicContact CE2-CD1 4.01Å; Y25-Y42 HydrophobicContact CE2-CE1 4.43Å; Y25-Y42 HydrophobicContact CG-CD1 4.21Å; Y25-Y42 HydrophobicContact CG-CE1 4.25Å; Q40-Y42 PolarHBondContact O-N 2.89Å; Y42-Y65 AromaticContact CE1-CD2 3.61Å; Y42-Y65 HydrophobicContact CE1-CD2 3.61Å; Y42-Y65 HydrophobicContact CE1-CG 4.18Å; Y42-Y65 AromaticContact CZ-CD2 3.96Å; Y42-Y65 PolarHBondContact OH-N 3.3Å; Y42-L72 HydrophobicContact CE1-CB 4.2Å; Y42-L72 HydrophobicContact CE1-CD1 4.19Å; Y42-L72 WeakPolarHBondContact OH-CB 3.46Å; Y42-G73 WeakPolarHBondContact CE2-O 3.35Å; Y42-G73 PolarHBondContact OH-O 2.89Å; Y42-A75 HydrophobicContact CD2-CB 4.11Å; Y42-A75 HydrophobicContact CE1-CB 4.14Å; Y42-A75 HydrophobicContact CE2-CB 3.64Å
43	G	98.5	Very high	98.3	Very high	24 Å²	24	59.1 Å²	59.1	25%	0.247	39%	0.388	C	S	.	.	S	Bend	trans	-132.5	-177.2	-172.8	0	0	0	0	0	113	G30	G30-G43 PolarHBondContact O-N 3.36Å
44	P	98.6	Very high	98.3	Very high	60 Å²	60	60.8 Å²	60.8	39%	0.39	40%	0.401	S	S	.	.			trans	-67	165.7	168.4	31.4	-36	0	0	0	111.1	Y25 G30 K67 L72	Y25-P44 PolarHBondContact OH-O 3.35Å; G30-P44 WeakPolarHBondContact CA-O 3.2Å; P44-K67 HydrophobicContact CG-CD 3.77Å; P44-L72 HydrophobicContact CG-CD2 4.3Å
45	T	98.8	Very high	98.3	Very high	77 Å²	77	58.4 Å²	58.4	47%	0.472	39%	0.385	S	S	.	.			trans	-69.2	164.5	163.2	50.2	0	0	0	0	111.1	G27 D28 K67	G27-T45 WeakPolarHBondContact O-CA 3.45Å; G27-T45 WeakPolarHBondContact O-CB 3.31Å; D28-T45 WeakPolarHBondContact O-CG2 3.41Å; T45-K67 PolarHBondContact O-NZ 3.26Å
46	F	98.8	Very high	98.3	Very high	15 Å²	15	59.2 Å²	59.2	7%	0.066	39%	0.388	C	S	.	.			trans	-144.8	151.6	175.4	59.8	-99.4	0	0	0	113	M1 I3 Y25 G27 D50 I52 K67	M1-F46 HydrophobicContact CB-CE2 4.43Å; M1-F46 HydrophobicContact CE-CD2 4.22Å; M1-F46 HydrophobicContact CE-CE2 4.22Å; I3-F46 HydrophobicContact CD1-CE2 3.86Å; I3-F46 HydrophobicContact CD1-CZ 3.87Å; I3-F46 HydrophobicContact CG1-CZ 4.33Å; Y25-F46 HydrophobicContact CD1-CD1 4.43Å; Y25-F46 AromaticContact CD1-CE1 3.8Å; Y25-F46 HydrophobicContact CD1-CE1 3.8Å; Y25-F46 HydrophobicContact CD2-CE1 4.21Å; Y25-F46 AromaticContact CE1-CD1 3.8Å; Y25-F46 HydrophobicContact CE1-CD1 3.8Å; Y25-F46 AromaticContact CE1-CE1 3.63Å; Y25-F46 HydrophobicContact CE1-CE1 3.63Å; Y25-F46 HydrophobicContact CE2-CD1 4.25Å; Y25-F46 HydrophobicContact CE2-CE1 4.03Å; Y25-F46 HydrophobicContact CG-CE1 4.09Å; Y25-F46 AromaticContact CZ-CD1 3.68Å; Y25-F46 AromaticContact CZ-CE1 3.74Å; G27-F46 VanDerWaalsContact CA-CZ 3.4Å; G27-F46 PolarHBondContact O-N 3.05Å; F46-D50 VanDerWaalsContact CA-OD2 3.28Å; F46-D50 WeakPolarHBondContact CA-OD2 3.46Å; F46-D50 HydrophobicContact CB-CB 4.04Å; F46-D50 WeakPolarHBondContact CB-OD2 3.22Å; F46-I52 HydrophobicContact CB-CD1 3.79Å; F46-I52 HydrophobicContact CB-CG1 4.17Å; F46-I52 HydrophobicContact CD1-CD1 3.75Å; F46-I52 HydrophobicContact CD1-CG1 3.85Å; F46-I52 HydrophobicContact CD2-CD1 4.33Å; F46-I52 HydrophobicContact CD2-CG1 3.78Å; F46-I52 HydrophobicContact CE1-CD1 4.4Å; F46-I52 HydrophobicContact CE1-CG1 4.12Å; F46-I52 HydrophobicContact CE2-CG1 4.06Å; F46-I52 HydrophobicContact CG-CD1 3.71Å; F46-I52 HydrophobicContact CG-CG1 3.68Å; F46-I52 HydrophobicContact CZ-CG1 4.22Å; F46-K67 HydrophobicContact CB-CD 4.42Å
47	T	98.6	Very high	98.3	Very high	93 Å²	93	57.5 Å²	57.5	57%	0.571	38%	0.375	S	S	*	.			trans	-147	-172.5	-170.8	-162.6	0	0	0	0	112.3	G49 D50	T47-G49 PolarHBondContact O-N 2.95Å; T47-D50 PolarHBondContact N-OD2 3.32Å; T47-D50 WeakPolarHBondContact O-CB 3.36Å; T47-D50 PolarHBondContact O-N 2.68Å
48	T	98.6	Very high	98.4	Very high	139 Å²	139	60.4 Å²	60.4	85%	0.853	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	122.8	178.9	-54.4	0	0	0	0	111.8
49	G	98.3	Very high	98.3	Very high	75 Å²	75	57.9 Å²	57.9	77%	0.773	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.8	-13.3	-179	0	0	0	0	0	115	T47	T47-G49 PolarHBondContact O-N 2.95Å
50	D	98.8	Very high	98.2	Very high	46 Å²	46	60.4 Å²	60.4	25%	0.246	37%	0.372	C	S	.	.			trans	-76.4	143.5	170.2	-72.8	-49.7	0	0	0	111.6	F46 T47 K67 N68	F46-D50 VanDerWaalsContact CA-OD2 3.28Å; F46-D50 WeakPolarHBondContact CA-OD2 3.46Å; F46-D50 HydrophobicContact CB-CB 4.04Å; F46-D50 WeakPolarHBondContact CB-OD2 3.22Å; T47-D50 PolarHBondContact N-OD2 3.32Å; T47-D50 WeakPolarHBondContact O-CB 3.36Å; T47-D50 PolarHBondContact O-N 2.68Å; D50-K67 WeakPolarHBondContact OD1-CE 3.46Å; D50-K67 IonicContact OD1-NZ 2.7Å; D50-K67 PolarHBondContact OD1-NZ 2.92Å; D50-K67 WeakPolarHBondContact OD2-CE 3.49Å; D50-K67 IonicContact OD2-NZ 2.8Å; D50-K67 PolarHBondContact OD2-NZ 2.7Å; D50-N68 WeakPolarHBondContact CA-OD1 3.49Å; D50-N68 PolarHBondContact OD1-ND2 3.33Å
51	V	98.8	Very high	98.1	Very high	74 Å²	74	58.4 Å²	58.4	45%	0.448	37%	0.365	S	S	.	.			trans	-106.9	119.1	172.1	179.5	0	0	0	0	109.1	N68 V106	V51-N68 PolarHBondContact N-OD1 2.87Å; V51-N68 PolarHBondContact O-N 3.33Å; V51-N68 PolarHBondContact O-OD1 3.39Å; V51-V106 HydrophobicContact CB-CG2 4.34Å; V51-V106 HydrophobicContact CG1-CG2 3.97Å; V51-V106 HydrophobicContact CG2-CG2 4.32Å
52	I	98.9	Very high	98.1	Very high	30 Å²	30	54.1 Å²	54.1	15%	0.154	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.8	176.9	-55.2	-57	0	0	0	109.9	I3 Y25 F46 Y65 T66 K67	I3-I52 HydrophobicContact CD1-CB 3.75Å; I3-I52 HydrophobicContact CD1-CG1 4.15Å; I3-I52 HydrophobicContact CD1-CG2 3.96Å; Y25-I52 HydrophobicContact CD1-CG2 3.96Å; Y25-I52 HydrophobicContact CE1-CD1 4.28Å; Y25-I52 HydrophobicContact CE1-CG2 4.02Å; F46-I52 HydrophobicContact CB-CD1 3.79Å; F46-I52 HydrophobicContact CB-CG1 4.17Å; F46-I52 HydrophobicContact CD1-CD1 3.75Å; F46-I52 HydrophobicContact CD1-CG1 3.85Å; F46-I52 HydrophobicContact CD2-CD1 4.33Å; F46-I52 HydrophobicContact CD2-CG1 3.78Å; F46-I52 HydrophobicContact CE1-CD1 4.4Å; F46-I52 HydrophobicContact CE1-CG1 4.12Å; F46-I52 HydrophobicContact CE2-CG1 4.06Å; F46-I52 HydrophobicContact CG-CD1 3.71Å; F46-I52 HydrophobicContact CG-CG1 3.68Å; F46-I52 HydrophobicContact CZ-CG1 4.22Å; I52-Y65 HydrophobicContact CG2-CD1 4.18Å; I52-T66 WeakPolarHBondContact CA-O 3.25Å; I52-K67 HydrophobicContact CD1-CB 3.83Å; I52-K67 HydrophobicContact CD1-CD 4.16Å; I52-K67 HydrophobicContact CD1-CG 3.75Å
53	G	98.8	Very high	98.1	Very high	23 Å²	23	52 Å²	52	24%	0.237	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	151.4	170.8	0	0	0	0	0	111.6	Y65 T66	G53-Y65 CarbonylContact O-C 3.57Å; G53-Y65 WeakPolarHBondContact O-CA 3.31Å; G53-Y65 WeakPolarHBondContact O-CD1 3.46Å; G53-T66 VanDerWaalsContact CA-OG1 3.29Å; G53-T66 WeakPolarHBondContact CA-OG1 3.39Å; G53-T66 PolarHBondContact N-O 2.86Å; G53-T66 PolarHBondContact N-OG1 3.46Å; G53-T66 PolarHBondContact O-N 3.17Å
54	C	98.9	Very high	98.1	Very high	48 Å²	48	51.1 Å²	51.1	32%	0.324	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	108.3	174.2	179.2	0	0	0	0	108.1	C63 Y65	C54-C63 VanDerWaalsContact SG-SG 3.62Å; C54-Y65 HydrophobicContact CB-CD1 3.96Å; C54-Y65 HydrophobicContact CB-CE1 3.87Å
55	C	98.8	Very high	98.2	Very high	15 Å²	15	48.3 Å²	48.3	10%	0.101	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	124.6	-179	-172.7	0	0	0	0	110.1	C63 F64	C55-C63 VanDerWaalsContact O-CA 3.25Å; C55-C63 WeakPolarHBondContact O-CA 3.4Å; C55-C63 PolarHBondContact O-SG 2.94Å; C55-F64 HydrophobicContact CB-CD1 3.93Å; C55-F64 HydrophobicContact CB-CD2 4.1Å; C55-F64 HydrophobicContact CB-CE1 3.51Å; C55-F64 HydrophobicContact CB-CE2 3.71Å; C55-F64 HydrophobicContact CB-CG 4.21Å; C55-F64 HydrophobicContact CB-CZ 3.4Å; C55-F64 VanDerWaalsContact CB-CZ 3.4Å; C55-F64 PolarHBondContact N-O 2.9Å; C55-F64 PolarHBondContact O-N 3.18Å; C55-F64 WeakPolarHBondContact SG-CE1 3.42Å; C55-F64 WeakPolarHBondContact SG-CZ 3.4Å
56	V	98.2	Very high	98.2	Very high	56 Å²	56	45 Å²	45	34%	0.339	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	127.1	-179.6	-168.7	0	0	0	0	109.3	L5 L58 L79	L5-V56 HydrophobicContact CD1-CG1 4.44Å; L5-V56 HydrophobicContact CD1-CG2 3.62Å; L5-V56 HydrophobicContact CD2-CG2 3.84Å; L5-V56 HydrophobicContact CG-CG2 4.3Å; V56-L58 HydrophobicContact CG1-CD2 3.96Å; V56-L79 HydrophobicContact CG1-CD1 4.1Å
57	N	97	Very high	98.2	Very high	10 Å²	10	46 Å²	46	5%	0.053	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	108.3	179	-176.1	-18.5	0	0	0	110.2	I59 N60 N61 T62 Y112 W116	N57-I59 VanDerWaalsContact C-N 3.29Å; N57-I59 PolarHBondContact O-N 3.24Å; N57-I59 VanDerWaalsContact OD1-CB 3.31Å; N57-I59 WeakPolarHBondContact OD1-CB 3.29Å; N57-I59 PolarHBondContact OD1-N 3.45Å; N57-N60 VanDerWaalsContact CB-OD1 3.27Å; N57-N60 WeakPolarHBondContact CB-OD1 3.39Å; N57-N60 PolarHBondContact ND2-OD1 2.98Å; N57-N60 PolarHBondContact O-OD1 2.9Å; N57-N60 PolarHBondContact OD1-OD1 3.08Å; N57-N61 VanDerWaalsContact O-CA 3.22Å; N57-N61 WeakPolarHBondContact O-CA 3.5Å; N57-N61 PolarHBondContact O-N 2.87Å; N57-T62 PolarHBondContact N-O 3.39Å; N57-T62 PolarHBondContact O-N 3.29Å; N57-T62 VanDerWaalsContact O-N 3.16Å; N57-Y112 PolarHBondContact ND2-OH 3.2Å; N57-W116 WeakPolarHBondContact ND2-CZ2 3.41Å; N57-W116 PolarHBondContact ND2-NE1 3.48Å
58	L	95.9	Very high	98.2	Very high	106 Å²	106	44.6 Å²	44.6	56%	0.555	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	3	-178.8	-54.9	179.4	0	0	0	113.9	V56 G488	V56-L58 HydrophobicContact CG1-CD2 3.96Å; L58-G488 WeakPolarHBondContact O-CA 3.47Å; L58-G488 PolarHBondContact O-N 3.04Å
59	I	96.1	Very high	98.2	Very high	46 Å²	46	39 Å²	39	24%	0.236	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-43.8	172.4	-55.6	170.2	0	0	0	110.1	N57 W116 I120 F492	N57-I59 VanDerWaalsContact C-N 3.29Å; N57-I59 PolarHBondContact O-N 3.24Å; N57-I59 VanDerWaalsContact OD1-CB 3.31Å; N57-I59 WeakPolarHBondContact OD1-CB 3.29Å; N57-I59 PolarHBondContact OD1-N 3.45Å; I59-W116 HydrophobicContact CB-CE3 4.4Å; I59-W116 HydrophobicContact CB-CZ3 4.1Å; I59-W116 HydrophobicContact CD1-CB 4.33Å; I59-W116 HydrophobicContact CD1-CD2 3.87Å; I59-W116 HydrophobicContact CD1-CE3 3.36Å; I59-W116 HydrophobicContact CD1-CG 4.28Å; I59-W116 HydrophobicContact CD1-CZ3 3.93Å; I59-W116 HydrophobicContact CG1-CE3 4.47Å; I59-W116 HydrophobicContact CG2-CE3 4.31Å; I59-W116 HydrophobicContact CG2-CH2 4.49Å; I59-W116 HydrophobicContact CG2-CZ3 3.78Å; I59-I120 HydrophobicContact CD1-CD1 4.44Å; I59-I120 HydrophobicContact CD1-CG1 4.39Å; I59-I120 HydrophobicContact CG2-CD1 4.49Å; I59-F492 HydrophobicContact CD1-CD2 3.81Å; I59-F492 HydrophobicContact CD1-CE2 3.66Å; I59-F492 HydrophobicContact CG1-CE2 4.45Å
60	N	96.4	Very high	98.2	Very high	68 Å²	68	42 Å²	42	36%	0.364	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.1	7.5	-176.8	70.6	-5.3	0	0	0	113.5	N57 T62 W116	N57-N60 VanDerWaalsContact CB-OD1 3.27Å; N57-N60 WeakPolarHBondContact CB-OD1 3.39Å; N57-N60 PolarHBondContact ND2-OD1 2.98Å; N57-N60 PolarHBondContact O-OD1 2.9Å; N57-N60 PolarHBondContact OD1-OD1 3.08Å; N60-T62 VanDerWaalsContact C-N 3.31Å; N60-T62 HydrophobicContact CB-CG2 4.47Å; N60-T62 VanDerWaalsContact CG-OG1 3.32Å; N60-T62 PolarHBondContact ND2-OG1 3.21Å; N60-T62 PolarHBondContact O-N 3.04Å; N60-T62 WeakPolarHBondContact OD1-CB 3.47Å; N60-T62 PolarHBondContact OD1-N 3.26Å; N60-T62 PolarHBondContact OD1-OG1 2.96Å; N60-W116 HydrophobicContact CB-CH2 4.42Å
61	N	96.7	Very high	98.2	Very high	74 Å²	74	42.9 Å²	42.9	40%	0.396	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	40.4	179.4	-54.3	-41.2	0	0	0	113.9	N57 T77 D78 L79	N57-N61 VanDerWaalsContact O-CA 3.22Å; N57-N61 WeakPolarHBondContact O-CA 3.5Å; N57-N61 PolarHBondContact O-N 2.87Å; N61-T77 CarbonylContact O-C 3.56Å; N61-D78 PolarHBondContact O-N 3.37Å; N61-L79 PolarHBondContact O-N 2.75Å
62	T	98.4	Very high	98.2	Very high	12 Å²	12	41.5 Å²	41.5	7%	0.074	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	160.2	178.7	63.8	0	0	0	0	112.8	N57 N60 I74 F76 T77	N57-T62 PolarHBondContact N-O 3.39Å; N57-T62 PolarHBondContact O-N 3.29Å; N57-T62 VanDerWaalsContact O-N 3.16Å; N60-T62 VanDerWaalsContact C-N 3.31Å; N60-T62 HydrophobicContact CB-CG2 4.47Å; N60-T62 VanDerWaalsContact CG-OG1 3.32Å; N60-T62 PolarHBondContact ND2-OG1 3.21Å; N60-T62 PolarHBondContact O-N 3.04Å; N60-T62 WeakPolarHBondContact OD1-CB 3.47Å; N60-T62 PolarHBondContact OD1-N 3.26Å; N60-T62 PolarHBondContact OD1-OG1 2.96Å; T62-I74 HydrophobicContact CG2-CG2 4.41Å; T62-F76 CarbonylContact C-O 3.49Å; T62-F76 VanDerWaalsContact CA-O 3.23Å; T62-F76 WeakPolarHBondContact CA-O 3.34Å; T62-F76 WeakPolarHBondContact CB-O 3.31Å; T62-T77 HydrophobicContact CG2-CG2 4.11Å
63	C	98.8	Very high	98.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	141.4	168.4	169.1	0	0	0	0	110.7	L5 C54 C55 A75 F76 L79	L5-C63 HydrophobicContact CD1-CB 4.32Å; C54-C63 VanDerWaalsContact SG-SG 3.62Å; C55-C63 VanDerWaalsContact O-CA 3.25Å; C55-C63 WeakPolarHBondContact O-CA 3.4Å; C55-C63 PolarHBondContact O-SG 2.94Å; C63-A75 PolarHBondContact O-N 3.36Å; C63-F76 HydrophobicContact CB-CB 4.46Å; C63-F76 HydrophobicContact CB-CD2 4.02Å; C63-F76 PolarHBondContact N-O 3.29Å; C63-F76 PolarHBondContact O-N 3.31Å; C63-L79 HydrophobicContact CB-CD1 3.56Å
64	F	98.9	Very high	98.1	Very high	7 Å²	7	44.9 Å²	44.9	3%	0.031	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	151.6	167	66.5	-87	0	0	0	110.5	C55 T66 S71 G73 I74 F107 Y112	C55-F64 HydrophobicContact CB-CD1 3.93Å; C55-F64 HydrophobicContact CB-CD2 4.1Å; C55-F64 HydrophobicContact CB-CE1 3.51Å; C55-F64 HydrophobicContact CB-CE2 3.71Å; C55-F64 HydrophobicContact CB-CG 4.21Å; C55-F64 HydrophobicContact CB-CZ 3.4Å; C55-F64 VanDerWaalsContact CB-CZ 3.4Å; C55-F64 PolarHBondContact N-O 2.9Å; C55-F64 PolarHBondContact O-N 3.18Å; C55-F64 WeakPolarHBondContact SG-CE1 3.42Å; C55-F64 WeakPolarHBondContact SG-CZ 3.4Å; F64-T66 HydrophobicContact CD2-CG2 4.05Å; F64-T66 HydrophobicContact CE2-CG2 3.73Å; F64-S71 WeakPolarHBondContact CD2-OG 3.32Å; F64-S71 WeakPolarHBondContact CE2-OG 3.44Å; F64-G73 WeakPolarHBondContact CB-O 3.36Å; F64-I74 HydrophobicContact CB-CD1 4.25Å; F64-I74 HydrophobicContact CD1-CD1 4.34Å; F64-F107 HydrophobicContact CE2-CE1 4.2Å; F64-F107 HydrophobicContact CE2-CE2 4.39Å; F64-F107 AromaticContact CE2-CZ 3.91Å; F64-F107 HydrophobicContact CE2-CZ 3.91Å; F64-F107 HydrophobicContact CZ-CE1 4.1Å; F64-F107 AromaticContact CZ-CZ 3.95Å; F64-F107 HydrophobicContact CZ-CZ 3.95Å; F64-Y112 HydrophobicContact CE1-CD2 4.44Å; F64-Y112 HydrophobicContact CE1-CE1 4.13Å; F64-Y112 AromaticContact CE1-CE2 3.8Å; F64-Y112 HydrophobicContact CE1-CE2 3.8Å; F64-Y112 AromaticContact CE1-CZ 3.62Å; F64-Y112 HydrophobicContact CZ-CD2 4.21Å; F64-Y112 HydrophobicContact CZ-CE1 4.4Å; F64-Y112 HydrophobicContact CZ-CE2 4.03Å; F64-Y112 HydrophobicContact CZ-CG 4.48Å
65	Y	98.9	Very high	98.1	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	158.7	171	-63.6	-93.2	0	0	0	111.1	I3 G4 G24 Y25 Y42 I52 G53 C54 L72 A75 F76	I3-Y65 HydrophobicContact CG2-CE1 4.41Å; I3-Y65 VanDerWaalsContact O-CE1 3.29Å; I3-Y65 WeakPolarHBondContact O-CE1 3.4Å; I3-Y65 PolarHBondContact O-OH 3.49Å; G4-Y65 VanDerWaalsContact CA-OH 3.26Å; G4-Y65 WeakPolarHBondContact CA-OH 3.49Å; G24-Y65 WeakPolarHBondContact CA-OH 3.35Å; Y25-Y65 VanDerWaalsContact CB-CZ 3.44Å; Y25-Y65 AromaticContact CD1-CD1 3.69Å; Y25-Y65 HydrophobicContact CD1-CD1 3.69Å; Y25-Y65 HydrophobicContact CD1-CD2 4.11Å; Y25-Y65 HydrophobicContact CD1-CE1 4.24Å; Y25-Y65 AromaticContact CD1-CG 3.59Å; Y25-Y65 HydrophobicContact CD1-CG 3.59Å; Y25-Y65 HydrophobicContact CE1-CG 4.41Å; Y25-Y65 HydrophobicContact CG-CD1 4.31Å; Y25-Y65 HydrophobicContact CG-CD2 4.22Å; Y25-Y65 HydrophobicContact CG-CE1 4.5Å; Y25-Y65 HydrophobicContact CG-CE2 4.43Å; Y25-Y65 HydrophobicContact CG-CG 4.14Å; Y25-Y65 PolarHBondContact N-OH 2.93Å; Y42-Y65 AromaticContact CE1-CD2 3.61Å; Y42-Y65 HydrophobicContact CE1-CD2 3.61Å; Y42-Y65 HydrophobicContact CE1-CG 4.18Å; Y42-Y65 AromaticContact CZ-CD2 3.96Å; Y42-Y65 PolarHBondContact OH-N 3.3Å; I52-Y65 HydrophobicContact CG2-CD1 4.18Å; G53-Y65 CarbonylContact O-C 3.57Å; G53-Y65 WeakPolarHBondContact O-CA 3.31Å; G53-Y65 WeakPolarHBondContact O-CD1 3.46Å; C54-Y65 HydrophobicContact CB-CD1 3.96Å; C54-Y65 HydrophobicContact CB-CE1 3.87Å; Y65-L72 WeakPolarHBondContact O-CB 3.3Å; Y65-L72 PolarHBondContact O-N 3.22Å; Y65-A75 HydrophobicContact CD2-CB 3.83Å; Y65-A75 HydrophobicContact CE2-CB 3.84Å; Y65-F76 HydrophobicContact CE2-CD2 4.42Å; Y65-F76 AromaticContact CE2-CE2 3.58Å; Y65-F76 HydrophobicContact CE2-CE2 3.58Å; Y65-F76 HydrophobicContact CE2-CZ 4.12Å; Y65-F76 AromaticContact CZ-CE2 3.99Å
66	T	98.9	Very high	98.1	Very high	8 Å²	8	43.1 Å²	43.1	5%	0.049	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	146.8	170.2	63.3	0	0	0	0	108.9	I52 G53 F64 H70 F107	I52-T66 WeakPolarHBondContact CA-O 3.25Å; G53-T66 VanDerWaalsContact CA-OG1 3.29Å; G53-T66 WeakPolarHBondContact CA-OG1 3.39Å; G53-T66 PolarHBondContact N-O 2.86Å; G53-T66 PolarHBondContact N-OG1 3.46Å; G53-T66 PolarHBondContact O-N 3.17Å; F64-T66 HydrophobicContact CD2-CG2 4.05Å; F64-T66 HydrophobicContact CE2-CG2 3.73Å; T66-H70 CarbonylContact C-O 3.57Å; T66-H70 WeakPolarHBondContact CA-O 3.23Å; T66-H70 WeakPolarHBondContact CB-O 3.29Å; T66-F107 HydrophobicContact CG2-CB 4.06Å; T66-F107 HydrophobicContact CG2-CD1 4.17Å; T66-F107 HydrophobicContact CG2-CD2 3.59Å; T66-F107 HydrophobicContact CG2-CE2 4.03Å; T66-F107 HydrophobicContact CG2-CG 3.67Å; T66-F107 HydrophobicContact CG2-CZ 4.49Å
67	K	98.8	Very high	98.1	Very high	36 Å²	36	44.2 Å²	44.2	16%	0.157	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	124.1	168.8	178.7	171.1	-174.3	175.9	0	109	P44 T45 F46 D50 I52 G69 H70 L72	P44-K67 HydrophobicContact CG-CD 3.77Å; T45-K67 PolarHBondContact O-NZ 3.26Å; F46-K67 HydrophobicContact CB-CD 4.42Å; D50-K67 WeakPolarHBondContact OD1-CE 3.46Å; D50-K67 IonicContact OD1-NZ 2.7Å; D50-K67 PolarHBondContact OD1-NZ 2.92Å; D50-K67 WeakPolarHBondContact OD2-CE 3.49Å; D50-K67 IonicContact OD2-NZ 2.8Å; D50-K67 PolarHBondContact OD2-NZ 2.7Å; I52-K67 HydrophobicContact CD1-CB 3.83Å; I52-K67 HydrophobicContact CD1-CD 4.16Å; I52-K67 HydrophobicContact CD1-CG 3.75Å; K67-G69 PolarHBondContact O-N 2.99Å; K67-G69 VanDerWaalsContact O-N 3.16Å; K67-H70 PolarHBondContact N-O 2.98Å; K67-H70 PolarHBondContact O-N 3.35Å; K67-L72 HydrophobicContact CB-CD1 4.2Å; K67-L72 HydrophobicContact CB-CD2 4.23Å; K67-L72 HydrophobicContact CB-CG 4.48Å
68	N	98.7	Very high	98.1	Very high	64 Å²	64	50.1 Å²	50.1	34%	0.342	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	40.5	177.5	-56.9	-23.5	0	0	0	113	D50 V51	D50-N68 WeakPolarHBondContact CA-OD1 3.49Å; D50-N68 PolarHBondContact OD1-ND2 3.33Å; V51-N68 PolarHBondContact N-OD1 2.87Å; V51-N68 PolarHBondContact O-N 3.33Å; V51-N68 PolarHBondContact O-OD1 3.39Å
69	G	98.5	Very high	98.2	Very high	20 Å²	20	45.7 Å²	45.7	21%	0.206	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	86	-2.5	-179.2	0	0	0	0	0	116.1	K67 V106 F107	K67-G69 PolarHBondContact O-N 2.99Å; K67-G69 VanDerWaalsContact O-N 3.16Å; G69-V106 WeakPolarHBondContact CA-O 3.46Å; G69-F107 WeakPolarHBondContact O-CD2 3.43Å
70	H	98.7	Very high	98.2	Very high	139 Å²	139	45.2 Å²	45.2	64%	0.644	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	130.3	177.9	-60.4	-73.1	0	0	0	111.7	T66 K67	T66-H70 CarbonylContact C-O 3.57Å; T66-H70 WeakPolarHBondContact CA-O 3.23Å; T66-H70 WeakPolarHBondContact CB-O 3.29Å; K67-H70 PolarHBondContact N-O 2.98Å; K67-H70 PolarHBondContact O-N 3.35Å
71	S	98.5	Very high	98.1	Very high	64 Å²	64	46.8 Å²	46.8	45%	0.448	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	137.2	174.4	-178.2	0	0	0	0	111.7	F64 G73	F64-S71 WeakPolarHBondContact CD2-OG 3.32Å; F64-S71 WeakPolarHBondContact CE2-OG 3.44Å; S71-G73 PolarHBondContact OG-N 3.33Å
72	L	98.7	Very high	98	Very high	45 Å²	45	50.1 Å²	50.1	24%	0.236	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	1.6	-179.1	-57.2	178	0	0	0	113	Y25 Y42 P44 Y65 K67	Y25-L72 HydrophobicContact CE1-CD1 3.73Å; Y42-L72 HydrophobicContact CE1-CB 4.2Å; Y42-L72 HydrophobicContact CE1-CD1 4.19Å; Y42-L72 WeakPolarHBondContact OH-CB 3.46Å; P44-L72 HydrophobicContact CG-CD2 4.3Å; Y65-L72 WeakPolarHBondContact O-CB 3.3Å; Y65-L72 PolarHBondContact O-N 3.22Å; K67-L72 HydrophobicContact CB-CD1 4.2Å; K67-L72 HydrophobicContact CB-CD2 4.23Å; K67-L72 HydrophobicContact CB-CG 4.48Å
73	G	98.5	Very high	98	Very high	35 Å²	35	51.2 Å²	51.2	36%	0.361	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	84.7	170.2	-173.6	0	0	0	0	0	113.5	Y42 F64 S71 A75	Y42-G73 WeakPolarHBondContact CE2-O 3.35Å; Y42-G73 PolarHBondContact OH-O 2.89Å; F64-G73 WeakPolarHBondContact CB-O 3.36Å; S71-G73 PolarHBondContact OG-N 3.33Å; G73-A75 PolarHBondContact O-N 3.28Å
74	I	98.7	Very high	98	Very high	89 Å²	89	57.4 Å²	57.4	46%	0.456	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	125.7	-175.7	-56.9	-57.3	0	0	0	110.8	T62 F64 F76 T77	T62-I74 HydrophobicContact CG2-CG2 4.41Å; F64-I74 HydrophobicContact CB-CD1 4.25Å; F64-I74 HydrophobicContact CD1-CD1 4.34Å; I74-F76 WeakPolarHBondContact CG2-O 3.46Å; I74-T77 HydrophobicContact CG2-CG2 4.08Å
75	A	98.7	Very high	98	Very high	21 Å²	21	61.1 Å²	61.1	17%	0.174	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-41.6	172.4	0	0	0	0	0	111.8	Y42 C63 Y65 G73	Y42-A75 HydrophobicContact CD2-CB 4.11Å; Y42-A75 HydrophobicContact CE1-CB 4.14Å; Y42-A75 HydrophobicContact CE2-CB 3.64Å; C63-A75 PolarHBondContact O-N 3.36Å; Y65-A75 HydrophobicContact CD2-CB 3.83Å; Y65-A75 HydrophobicContact CE2-CB 3.84Å; G73-A75 PolarHBondContact O-N 3.28Å
76	F	98.7	Very high	98	Very high	5 Å²	5	62.2 Å²	62.2	2%	0.022	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	144.2	-172.8	-45.5	-58.8	0	0	0	111.5	Y23 C34 T62 C63 Y65 I74 L79	Y23-F76 HydrophobicContact CD1-CB 4.3Å; Y23-F76 HydrophobicContact CD1-CD1 4.04Å; Y23-F76 HydrophobicContact CD1-CD2 4.19Å; Y23-F76 HydrophobicContact CD1-CE1 4.47Å; Y23-F76 AromaticContact CD1-CG 3.9Å; Y23-F76 HydrophobicContact CD1-CG 3.9Å; Y23-F76 HydrophobicContact CG-CD2 4.36Å; C34-F76 HydrophobicContact CB-CD1 3.8Å; C34-F76 HydrophobicContact CB-CE1 3.8Å; T62-F76 CarbonylContact C-O 3.49Å; T62-F76 VanDerWaalsContact CA-O 3.23Å; T62-F76 WeakPolarHBondContact CA-O 3.34Å; T62-F76 WeakPolarHBondContact CB-O 3.31Å; C63-F76 HydrophobicContact CB-CB 4.46Å; C63-F76 HydrophobicContact CB-CD2 4.02Å; C63-F76 PolarHBondContact N-O 3.29Å; C63-F76 PolarHBondContact O-N 3.31Å; Y65-F76 HydrophobicContact CE2-CD2 4.42Å; Y65-F76 AromaticContact CE2-CE2 3.58Å; Y65-F76 HydrophobicContact CE2-CE2 3.58Å; Y65-F76 HydrophobicContact CE2-CZ 4.12Å; Y65-F76 AromaticContact CZ-CE2 3.99Å; I74-F76 WeakPolarHBondContact CG2-O 3.46Å; F76-L79 HydrophobicContact CB-CD2 3.86Å; F76-L79 HydrophobicContact CB-CG 4.33Å
77	T	98.4	Very high	98	Very high	79 Å²	79	65.2 Å²	65.2	49%	0.485	37%	0.371	S	S	.	.			trans	-118.6	171.1	168.8	66	0	0	0	0	109.6	N61 T62 I74 L79	N61-T77 CarbonylContact O-C 3.56Å; T62-T77 HydrophobicContact CG2-CG2 4.11Å; I74-T77 HydrophobicContact CG2-CG2 4.08Å; T77-L79 PolarHBondContact O-N 3.04Å; T77-L79 VanDerWaalsContact O-N 3.14Å
78	D	97.1	Very high	97.9	Very high	135 Å²	135	64 Å²	64	72%	0.722	37%	0.369	S	S	*	.	S	Bend	trans	55.4	36.1	171.1	-50.9	-74.6	0	0	0	113.5	N61	N61-D78 PolarHBondContact O-N 3.37Å
79	L	97.7	Very high	97.9	Very high	12 Å²	12	64.9 Å²	64.9	6%	0.063	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-63.5	137.6	179.9	-69.5	175.8	0	0	0	111.5	L5 Y23 V56 N61 C63 F76 T77 L83	L5-L79 HydrophobicContact CD1-CD1 4.11Å; Y23-L79 HydrophobicContact CD1-CD2 3.63Å; Y23-L79 HydrophobicContact CD2-CD2 3.92Å; Y23-L79 HydrophobicContact CE1-CD2 3.55Å; Y23-L79 HydrophobicContact CE2-CD2 3.87Å; Y23-L79 HydrophobicContact CG-CD2 3.83Å; V56-L79 HydrophobicContact CG1-CD1 4.1Å; N61-L79 PolarHBondContact O-N 2.75Å; C63-L79 HydrophobicContact CB-CD1 3.56Å; F76-L79 HydrophobicContact CB-CD2 3.86Å; F76-L79 HydrophobicContact CB-CG 4.33Å; T77-L79 PolarHBondContact O-N 3.04Å; T77-L79 VanDerWaalsContact O-N 3.14Å; L79-L83 HydrophobicContact CB-CD1 4.19Å; L79-L83 HydrophobicContact CD1-CD1 4.49Å; L79-L83 HydrophobicContact CD2-CD1 4.12Å
80	P	96.2	Very high	97.9	Very high	37 Å²	37	70.4 Å²	70.4	24%	0.24	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-68.5	154.5	170.3	31	-36	0	0	0	110.8	Y23 L83	Y23-P80 HydrophobicContact CE2-CG 4.15Å; Y23-P80 WeakPolarHBondContact OH-CD 3.4Å; P80-L83 HydrophobicContact CG-CD1 4.31Å; P80-L83 HydrophobicContact CG-CD2 4.05Å; P80-L83 HydrophobicContact CG-CG 4.28Å; P80-L83 WeakPolarHBondContact O-CD1 3.41Å; P80-L83 WeakPolarHBondContact O-CG 3.28Å
81	P	94.5	Very high	97.7	Very high	101 Å²	101	67.8 Å²	67.8	66%	0.656	39%	0.388	S	S	*	.	S	Bend	trans	-69.5	168	173.8	31.4	-36.5	0	0	0	111.8	L83	P81-L83 PolarHBondContact O-N 2.89Å
82	N	94.3	Very high	97.7	Very high	143 Å²	143	71.2 Å²	71.2	77%	0.765	41%	0.408	S	S	*	.	S	Bend	trans	60.7	38.9	171.8	-50.1	-44.2	0	0	0	114.7
83	L	97.7	Very high	97.6	Very high	35 Å²	35	72.8 Å²	72.8	18%	0.183	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-78.9	144.2	171	-69	171.8	0	0	0	111.7	L5 A7 Y23 L79 P80 P81	L5-L83 HydrophobicContact CB-CB 4.16Å; L5-L83 HydrophobicContact CB-CD1 4.05Å; L5-L83 HydrophobicContact CD1-CD1 3.94Å; A7-L83 HydrophobicContact CB-CD2 4.14Å; Y23-L83 HydrophobicContact CD2-CD1 4.14Å; Y23-L83 HydrophobicContact CD2-CD2 4.27Å; Y23-L83 HydrophobicContact CE2-CD1 4.14Å; Y23-L83 HydrophobicContact CE2-CD2 4.12Å; L79-L83 HydrophobicContact CB-CD1 4.19Å; L79-L83 HydrophobicContact CD1-CD1 4.49Å; L79-L83 HydrophobicContact CD2-CD1 4.12Å; P80-L83 HydrophobicContact CG-CD1 4.31Å; P80-L83 HydrophobicContact CG-CD2 4.05Å; P80-L83 HydrophobicContact CG-CG 4.28Å; P80-L83 WeakPolarHBondContact O-CD1 3.41Å; P80-L83 WeakPolarHBondContact O-CG 3.28Å; P81-L83 PolarHBondContact O-N 2.89Å
84	Y	98.7	Very high	97.6	Very high	130 Å²	130	73.1 Å²	73.1	51%	0.51	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	138.7	174.2	-69.3	-101.2	0	0	0	110.1	L5 S6 Q8 T86	L5-Y84 CarbonylContact C-O 3.6Å; L5-Y84 VanDerWaalsContact CA-O 3.28Å; L5-Y84 WeakPolarHBondContact CA-O 3.28Å; S6-Y84 PolarHBondContact N-O 2.87Å; S6-Y84 PolarHBondContact O-N 3.48Å; Q8-Y84 HydrophobicContact CB-CE2 4.13Å; Y84-T86 PolarHBondContact O-N 3.11Å; Y84-T86 PolarHBondContact O-OG1 3.41Å
85	P	98.8	Very high	97.6	Very high	86 Å²	86	74.6 Å²	74.6	56%	0.558	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.7	127.4	166.7	-20.1	32.7	0	0	0	110.6	G4 F100	G4-P85 WeakPolarHBondContact O-CA 3.43Å; P85-F100 HydrophobicContact CB-CE1 3.89Å; P85-F100 HydrophobicContact CB-CZ 4.36Å; P85-F100 HydrophobicContact CG-CE1 4.15Å
86	T	98.7	Very high	97.6	Very high	23 Å²	23	76.6 Å²	76.6	14%	0.141	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	136.7	-172.9	-54	0	0	0	0	110.8	G4 S6 M12 P16 Y84	G4-T86 PolarHBondContact N-O 3.42Å; G4-T86 PolarHBondContact O-N 3.35Å; S6-T86 PolarHBondContact OG-OG1 3.36Å; M12-T86 HydrophobicContact CE-CG2 4.28Å; P16-T86 HydrophobicContact CG-CG2 4Å; Y84-T86 PolarHBondContact O-N 3.11Å; Y84-T86 PolarHBondContact O-OG1 3.41Å
87	V	98.7	Very high	97.6	Very high	70 Å²	70	84.3 Å²	84.3	42%	0.424	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	136.6	171	-174.4	0	0	0	0	108.9	G2 I3 L89 V96	G2-V87 WeakPolarHBondContact O-CA 3.45Å; I3-V87 HydrophobicContact CG1-CG1 4.15Å; I3-V87 HydrophobicContact CG1-CG2 4.39Å; I3-V87 HydrophobicContact CG2-CG2 4.41Å; V87-L89 HydrophobicContact CG1-CD2 4.3Å; V87-V96 HydrophobicContact CG1-CG2 4.05Å
88	G	98.4	Very high	97.6	Very high	11 Å²	11	83.8 Å²	83.8	11%	0.113	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.6	175	0	0	0	0	0	111.5	M1 G2 L15	M1-G88 WeakPolarHBondContact CA-O 3.5Å; G2-G88 PolarHBondContact N-O 2.85Å; G2-G88 PolarHBondContact O-N 3.23Å; L15-G88 WeakPolarHBondContact CD2-O 3.39Å
89	L	98.2	Very high	97.7	Very high	82 Å²	82	80 Å²	80	43%	0.429	48%	0.475	S	S	.	.			trans	-117.9	154.8	174.7	-52	-178.2	0	0	0	108.7	M1 V87 E94 V96	M1-L89 HydrophobicContact CB-CD2 4.22Å; M1-L89 HydrophobicContact CG-CD2 3.87Å; M1-L89 HydrophobicContact SD-CD2 4.49Å; V87-L89 HydrophobicContact CG1-CD2 4.3Å; L89-E94 WeakPolarHBondContact CA-OE2 3.37Å; L89-E94 HydrophobicContact CB-CB 4.33Å; L89-E94 WeakPolarHBondContact CB-OE2 3.38Å; L89-E94 HydrophobicContact CD1-CB 4.22Å; L89-E94 HydrophobicContact CD2-CB 4.05Å; L89-E94 HydrophobicContact CG-CB 4.42Å; L89-V96 HydrophobicContact CD1-CG2 4.46Å; L89-V96 HydrophobicContact CD2-CG1 4.15Å; L89-V96 HydrophobicContact CD2-CG2 4.18Å
90	Q	97.1	Very high	97.7	Very high	137 Å²	137	86.2 Å²	86.2	64%	0.64	50%	0.502	S	S	*	.			trans	-137.9	-31.6	-178	-168.7	177.1	13.7	0	0	113.4	L15 E94	L15-Q90 HydrophobicContact CD2-CB 4.46Å; Q90-E94 PolarHBondContact N-OE2 3.41Å
91	T	96.2	Very high	97.8	Very high	84 Å²	84	86.9 Å²	86.9	52%	0.515	52%	0.515	S	S	.	.	S	Bend	trans	-105.2	138.3	-176.1	57.6	0	0	0	0	112.2	G93 E94	T91-G93 PolarHBondContact O-N 3.32Å; T91-E94 PolarHBondContact N-OE2 3.07Å; T91-E94 WeakPolarHBondContact O-CG 3.33Å; T91-E94 PolarHBondContact O-N 3.03Å; T91-E94 VanDerWaalsContact OG1-CG 3.24Å; T91-E94 WeakPolarHBondContact OG1-CG 3.37Å; T91-E94 PolarHBondContact OG1-OE2 2.93Å
92	P	97.5	Very high	98	Very high	136 Å²	136	88 Å²	88	88%	0.883	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	134.3	176.2	-25.9	34.7	0	0	0	112.5
93	G	97.3	Very high	98.2	Very high	77 Å²	77	87.7 Å²	87.7	79%	0.794	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.5	-6	-179.5	0	0	0	0	0	115.1	T91 V95	T91-G93 PolarHBondContact O-N 3.32Å; G93-V95 PolarHBondContact O-N 3.24Å
94	E	98.2	Very high	98.2	Very high	42 Å²	42	91.9 Å²	91.9	20%	0.196	54%	0.535	C	S	.	.			trans	-63.9	127.8	165	-70.2	176.2	133.2	0	0	109.9	M1 L89 Q90 T91	M1-E94 WeakPolarHBondContact CA-OE1 3.49Å; M1-E94 HydrophobicContact CG-CB 4.29Å; M1-E94 VanDerWaalsContact CG-CD 3.48Å; M1-E94 HydrophobicContact CG-CG 3.9Å; M1-E94 WeakPolarHBondContact CG-OE1 3.28Å; M1-E94 PolarHBondContact N-OE1 3.05Å; L89-E94 WeakPolarHBondContact CA-OE2 3.37Å; L89-E94 HydrophobicContact CB-CB 4.33Å; L89-E94 WeakPolarHBondContact CB-OE2 3.38Å; L89-E94 HydrophobicContact CD1-CB 4.22Å; L89-E94 HydrophobicContact CD2-CB 4.05Å; L89-E94 HydrophobicContact CG-CB 4.42Å; Q90-E94 PolarHBondContact N-OE2 3.41Å; T91-E94 PolarHBondContact N-OE2 3.07Å; T91-E94 WeakPolarHBondContact O-CG 3.33Å; T91-E94 PolarHBondContact O-N 3.03Å; T91-E94 VanDerWaalsContact OG1-CG 3.24Å; T91-E94 WeakPolarHBondContact OG1-CG 3.37Å; T91-E94 PolarHBondContact OG1-OE2 2.93Å
95	V	98.4	Very high	98.2	Very high	121 Å²	121	91 Å²	91	73%	0.733	53%	0.534	S	S	*	.			trans	-137.2	138.9	174.1	-178.4	0	0	0	0	107.6	G93	G93-V95 PolarHBondContact O-N 3.24Å
96	V	98.4	Very high	98.2	Very high	63 Å²	63	91.2 Å²	91.2	38%	0.382	53%	0.533	S	S	.	.			trans	-140.5	140.6	-178.2	-67.3	0	0	0	0	109.5	M1 V87 L89	M1-V96 HydrophobicContact SD-CG1 3.53Å; M1-V96 VanDerWaalsContact SD-CG1 3.53Å; V87-V96 HydrophobicContact CG1-CG2 4.05Å; L89-V96 HydrophobicContact CD1-CG2 4.46Å; L89-V96 HydrophobicContact CD2-CG1 4.15Å; L89-V96 HydrophobicContact CD2-CG2 4.18Å
97	D	98.5	Very high	98.2	Very high	166 Å²	166	92 Å²	92	89%	0.888	54%	0.535	S	S	*	.			trans	-105.2	140.4	172	-64.7	-46.8	0	0	0	109.7
98	A	98.6	Very high	98.2	Very high	69 Å²	69	93.4 Å²	93.4	57%	0.57	54%	0.54	S	S	*	.			trans	-104.8	134.9	178.7	0	0	0	0	0	111	F100	A98-F100 HydrophobicContact CB-CD2 4.16Å; A98-F100 HydrophobicContact CB-CE2 3.62Å; A98-F100 HydrophobicContact CB-CZ 4.13Å
99	N	98.7	Very high	98.1	Very high	54 Å²	54	94.7 Å²	94.7	29%	0.289	54%	0.544	S	S	.	.			trans	-114.4	110.9	169.9	-178.5	15.8	0	0	0	109.5	G101 Q102 H103	N99-G101 PolarHBondContact OD1-N 3.38Å; N99-Q102 PolarHBondContact OD1-N 2.72Å; N99-Q102 VanDerWaalsContact OD1-N 3.08Å; N99-H103 PolarHBondContact ND2-O 3Å; N99-H103 PolarHBondContact OD1-N 3.02Å; N99-H103 VanDerWaalsContact OD1-N 3.12Å; N99-H103 PolarHBondContact OD1-O 3.08Å
100	F	98.5	Very high	98.1	Very high	144 Å²	144	96.7 Å²	96.7	63%	0.632	55%	0.551	S	S	*	*	S	Bend	trans	-106.3	22.6	174.4	-63.5	-67.7	0	0	0	111.9	P85 A98	P85-F100 HydrophobicContact CB-CE1 3.89Å; P85-F100 HydrophobicContact CB-CZ 4.36Å; P85-F100 HydrophobicContact CG-CE1 4.15Å; A98-F100 HydrophobicContact CB-CD2 4.16Å; A98-F100 HydrophobicContact CB-CE2 3.62Å; A98-F100 HydrophobicContact CB-CZ 4.13Å
101	G	98.2	Very high	98.1	Very high	50 Å²	50	94 Å²	94	52%	0.515	54%	0.541	S	S	.	.	S	Bend	trans	111.7	4.7	-176.9	0	0	0	0	0	114.6	N99 H103	N99-G101 PolarHBondContact OD1-N 3.38Å; G101-H103 PolarHBondContact O-N 2.88Å
102	Q	98.5	Very high	98.2	Very high	126 Å²	126	92.1 Å²	92.1	59%	0.589	53%	0.525	S	S	*	.	S	Bend	trans	-66.5	-26.5	172.2	-64.2	83.8	-2.6	0	0	112.3	N99	N99-Q102 PolarHBondContact OD1-N 2.72Å; N99-Q102 VanDerWaalsContact OD1-N 3.08Å
103	H	98.2	Very high	98.2	Very high	135 Å²	135	88.9 Å²	88.9	63%	0.625	50%	0.499	S	S	*	.	S	Bend	trans	-132.7	155.6	177.3	-60.1	-48.2	0	0	0	110.6	N99 G101 F105	N99-H103 PolarHBondContact ND2-O 3Å; N99-H103 PolarHBondContact OD1-N 3.02Å; N99-H103 VanDerWaalsContact OD1-N 3.12Å; N99-H103 PolarHBondContact OD1-O 3.08Å; G101-H103 PolarHBondContact O-N 2.88Å; H103-F105 PolarHBondContact O-N 2.74Å
104	P	98.5	Very high	98.1	Very high	124 Å²	124	92 Å²	92	81%	0.805	49%	0.486	S	S	*	.			trans	-53	139	170.6	-25.5	35.1	0	0	0	111.7
105	F	98.6	Very high	98	Very high	111 Å²	111	94.6 Å²	94.6	49%	0.487	50%	0.499	S	S	.	.			trans	-74.1	147	175.7	-62	-70	0	0	0	111	H103 F107 I109	H103-F105 PolarHBondContact O-N 2.74Å; F105-F107 VanDerWaalsContact C-N 3.33Å; F105-F107 WeakPolarHBondContact CB-O 3.41Å; F105-I109 HydrophobicContact CD2-CG2 3.81Å; F105-I109 HydrophobicContact CE2-CG2 4.41Å
106	V	98.6	Very high	97.9	Very high	90 Å²	90	90.6 Å²	90.6	55%	0.545	47%	0.47	S	S	.	.	S	Bend	trans	-75.1	-27.5	174.6	-171.3	0	0	0	0	111.3	V51 G69	V51-V106 HydrophobicContact CB-CG2 4.34Å; V51-V106 HydrophobicContact CG1-CG2 3.97Å; V51-V106 HydrophobicContact CG2-CG2 4.32Å; G69-V106 WeakPolarHBondContact CA-O 3.46Å
107	F	98.6	Very high	97.8	Very high	39 Å²	39	92.4 Å²	92.4	17%	0.171	47%	0.47	C	S	.	.	S	Bend	trans	-87.6	134.5	169.7	175.3	-104.9	0	0	0	109.7	F64 T66 G69 F105 I109 Y112	F64-F107 HydrophobicContact CE2-CE1 4.2Å; F64-F107 HydrophobicContact CE2-CE2 4.39Å; F64-F107 AromaticContact CE2-CZ 3.91Å; F64-F107 HydrophobicContact CE2-CZ 3.91Å; F64-F107 HydrophobicContact CZ-CE1 4.1Å; F64-F107 AromaticContact CZ-CZ 3.95Å; F64-F107 HydrophobicContact CZ-CZ 3.95Å; T66-F107 HydrophobicContact CG2-CB 4.06Å; T66-F107 HydrophobicContact CG2-CD1 4.17Å; T66-F107 HydrophobicContact CG2-CD2 3.59Å; T66-F107 HydrophobicContact CG2-CE2 4.03Å; T66-F107 HydrophobicContact CG2-CG 3.67Å; T66-F107 HydrophobicContact CG2-CZ 4.49Å; G69-F107 WeakPolarHBondContact O-CD2 3.43Å; F105-F107 VanDerWaalsContact C-N 3.33Å; F105-F107 WeakPolarHBondContact CB-O 3.41Å; F107-I109 VanDerWaalsContact C-N 3.3Å; F107-I109 HydrophobicContact CD1-CB 4.16Å; F107-I109 HydrophobicContact CD1-CD1 4.31Å; F107-I109 HydrophobicContact CE1-CB 4.43Å; F107-I109 HydrophobicContact CE1-CD1 4.01Å; F107-I109 PolarHBondContact O-N 2.84Å; F107-Y112 HydrophobicContact CE1-CG 4.44Å; F107-Y112 HydrophobicContact CZ-CG 4.45Å
108	D	98.2	Very high	97.7	Very high	100 Å²	100	88.9 Å²	88.9	54%	0.535	46%	0.455	S	S	.	.			trans	-74	83.8	174.2	-168.1	-16.8	0	0	0	110.5	E110 D111	D108-E110 VanDerWaalsContact C-N 3.25Å; D108-E110 PolarHBondContact O-N 2.95Å; D108-E110 PolarHBondContact OD1-N 3.49Å; D108-D111 PolarHBondContact OD1-N 3.44Å
109	I	98.1	Very high	97.5	Very high	39 Å²	39	89.4 Å²	89.4	20%	0.2	44%	0.444	C	S	.	.	H	α-helix	trans	-69.1	-25.1	176.5	-169.7	60.1	0	0	0	112.2	F105 F107 Y112 M113	F105-I109 HydrophobicContact CD2-CG2 3.81Å; F105-I109 HydrophobicContact CE2-CG2 4.41Å; F107-I109 VanDerWaalsContact C-N 3.3Å; F107-I109 HydrophobicContact CD1-CB 4.16Å; F107-I109 HydrophobicContact CD1-CD1 4.31Å; F107-I109 HydrophobicContact CE1-CB 4.43Å; F107-I109 HydrophobicContact CE1-CD1 4.01Å; F107-I109 PolarHBondContact O-N 2.84Å; I109-Y112 HydrophobicContact CD1-CD1 3.91Å; I109-Y112 PolarHBondContact O-N 3.3Å; I109-M113 HydrophobicContact CG1-CG 4.44Å; I109-M113 HydrophobicContact CG1-SD 4.22Å; I109-M113 WeakPolarHBondContact O-CB 3.48Å; I109-M113 VanDerWaalsContact O-CG 3.3Å; I109-M113 WeakPolarHBondContact O-CG 3.21Å; I109-M113 PolarHBondContact O-N 2.95Å
110	E	97.4	Very high	97.4	Very high	123 Å²	123	87.1 Å²	87.1	58%	0.575	43%	0.432	S	S	*	.	H	α-helix	trans	-72.2	-41.5	-178.1	-67.7	-65.5	168.8	0	0	111.5	D108 M113 R114	D108-E110 VanDerWaalsContact C-N 3.25Å; D108-E110 PolarHBondContact O-N 2.95Å; D108-E110 PolarHBondContact OD1-N 3.49Å; E110-M113 PolarHBondContact O-N 3.33Å; E110-R114 WeakPolarHBondContact O-CB 3.37Å; E110-R114 PolarHBondContact O-N 3.33Å
111	D	97.5	Very high	97.2	Very high	81 Å²	81	82.7 Å²	82.7	43%	0.433	41%	0.413	S	S	.	.	H	α-helix	trans	-67.1	-38.7	173.8	-165.8	57.3	0	0	0	111.9	D108 M113 R114 E115	D108-D111 PolarHBondContact OD1-N 3.44Å; D111-M113 PolarHBondContact O-N 3Å; D111-R114 WeakPolarHBondContact O-CB 3.5Å; D111-R114 PolarHBondContact O-N 2.93Å; D111-R114 IonicContact OD1-CZ 3.36Å; D111-R114 IonicContact OD1-NH1 3.16Å; D111-R114 PolarHBondContact OD1-NH1 3.16Å; D111-E115 PolarHBondContact O-N 3.33Å
112	Y	97.3	Very high	97	Very high	45 Å²	45	81.7 Å²	81.7	18%	0.176	40%	0.4	C	S	.	.	H	α-helix	trans	-61.4	-42	172	176.2	-98.4	0	0	0	112.3	N57 F64 F107 I109 R114 E115 W116	N57-Y112 PolarHBondContact ND2-OH 3.2Å; F64-Y112 HydrophobicContact CE1-CD2 4.44Å; F64-Y112 HydrophobicContact CE1-CE1 4.13Å; F64-Y112 AromaticContact CE1-CE2 3.8Å; F64-Y112 HydrophobicContact CE1-CE2 3.8Å; F64-Y112 AromaticContact CE1-CZ 3.62Å; F64-Y112 HydrophobicContact CZ-CD2 4.21Å; F64-Y112 HydrophobicContact CZ-CE1 4.4Å; F64-Y112 HydrophobicContact CZ-CE2 4.03Å; F64-Y112 HydrophobicContact CZ-CG 4.48Å; F107-Y112 HydrophobicContact CE1-CG 4.44Å; F107-Y112 HydrophobicContact CZ-CG 4.45Å; I109-Y112 HydrophobicContact CD1-CD1 3.91Å; I109-Y112 PolarHBondContact O-N 3.3Å; Y112-R114 VanDerWaalsContact C-N 3.34Å; Y112-E115 PolarHBondContact O-N 2.95Å; Y112-W116 AromaticContact CE1-CD1 3.85Å; Y112-W116 AromaticContact CE1-NE1 4Å; Y112-W116 AromaticContact CE2-CD1 3.98Å; Y112-W116 AromaticContact CE2-NE1 3.65Å; Y112-W116 AromaticContact CZ-CD1 3.63Å; Y112-W116 AromaticContact CZ-NE1 3.33Å; Y112-W116 VanDerWaalsContact CZ-NE1 3.33Å; Y112-W116 PolarHBondContact O-N 2.83Å; Y112-W116 PolarHBondContact OH-NE1 3.15Å; Y112-W116 VanDerWaalsContact OH-NE1 3.12Å
113	M	97.1	Very high	96.9	Very high	67 Å²	67	81.7 Å²	81.7	33%	0.33	40%	0.4	S	S	.	.	H	α-helix	trans	-67.7	-33.4	174.6	-77.2	-179.9	57.8	0	0	112.4	I109 E110 D111 W116 R117 F492	I109-M113 HydrophobicContact CG1-CG 4.44Å; I109-M113 HydrophobicContact CG1-SD 4.22Å; I109-M113 WeakPolarHBondContact O-CB 3.48Å; I109-M113 VanDerWaalsContact O-CG 3.3Å; I109-M113 WeakPolarHBondContact O-CG 3.21Å; I109-M113 PolarHBondContact O-N 2.95Å; E110-M113 PolarHBondContact O-N 3.33Å; D111-M113 PolarHBondContact O-N 3Å; M113-W116 PolarHBondContact O-N 2.69Å; M113-R117 PolarHBondContact O-N 3.18Å; M113-F492 HydrophobicContact CB-CE1 4.14Å; M113-F492 HydrophobicContact CE-CE1 4.31Å; M113-F492 HydrophobicContact CE-CZ 4.47Å; M113-F492 HydrophobicContact CG-CE1 4.43Å; M113-F492 HydrophobicContact CG-CZ 4.4Å; M113-F492 WeakPolarHBondContact O-CE1 3.48Å
114	R	96.7	Very high	96.6	Very high	142 Å²	142	78.5 Å²	78.5	54%	0.536	39%	0.387	S	S	.	.	H	α-helix	trans	-62.6	-43.7	173.8	-172.5	-172.9	-60	142.6	2.5	111.7	E110 D111 Y112 W116 R117 T118	E110-R114 WeakPolarHBondContact O-CB 3.37Å; E110-R114 PolarHBondContact O-N 3.33Å; D111-R114 WeakPolarHBondContact O-CB 3.5Å; D111-R114 PolarHBondContact O-N 2.93Å; D111-R114 IonicContact OD1-CZ 3.36Å; D111-R114 IonicContact OD1-NH1 3.16Å; D111-R114 PolarHBondContact OD1-NH1 3.16Å; Y112-R114 VanDerWaalsContact C-N 3.34Å; R114-W116 VanDerWaalsContact C-N 3.3Å; R114-W116 PolarHBondContact O-N 3.03Å; R114-R117 WeakPolarHBondContact O-CB 3.44Å; R114-R117 PolarHBondContact O-N 2.93Å; R114-T118 PolarHBondContact O-N 2.97Å; R114-T118 PolarHBondContact O-OG1 2.87Å; R114-T118 VanDerWaalsContact O-OG1 3.07Å
115	E	96.3	Very high	96.2	Very high	97 Å²	97	77.9 Å²	77.9	45%	0.453	38%	0.377	S	S	.	.	H	α-helix	trans	-57.1	-44.7	175.5	-163	-158.6	167	0	0	111.4	D111 Y112 T118 K119	D111-E115 PolarHBondContact O-N 3.33Å; Y112-E115 PolarHBondContact O-N 2.95Å; E115-T118 PolarHBondContact O-N 2.72Å; E115-K119 WeakPolarHBondContact O-CG 3.26Å; E115-K119 PolarHBondContact O-N 2.94Å; E115-K119 WeakPolarHBondContact OE1-CE 3.44Å; E115-K119 IonicContact OE1-NZ 3.68Å; E115-K119 PolarHBondContact OE1-NZ 3.32Å; E115-K119 IonicContact OE2-NZ 3.57Å
116	W	96.1	Very high	95.9	Very high	37 Å²	37	82.3 Å²	82.3	14%	0.14	39%	0.391	C	S	.	.	H	α-helix	trans	-68.6	-40	176.7	-81.6	98.3	0	0	0	113.2	N57 I59 N60 Y112 M113 R114 T118 K119 I120 F492	N57-W116 WeakPolarHBondContact ND2-CZ2 3.41Å; N57-W116 PolarHBondContact ND2-NE1 3.48Å; I59-W116 HydrophobicContact CB-CE3 4.4Å; I59-W116 HydrophobicContact CB-CZ3 4.1Å; I59-W116 HydrophobicContact CD1-CB 4.33Å; I59-W116 HydrophobicContact CD1-CD2 3.87Å; I59-W116 HydrophobicContact CD1-CE3 3.36Å; I59-W116 HydrophobicContact CD1-CG 4.28Å; I59-W116 HydrophobicContact CD1-CZ3 3.93Å; I59-W116 HydrophobicContact CG1-CE3 4.47Å; I59-W116 HydrophobicContact CG2-CE3 4.31Å; I59-W116 HydrophobicContact CG2-CH2 4.49Å; I59-W116 HydrophobicContact CG2-CZ3 3.78Å; N60-W116 HydrophobicContact CB-CH2 4.42Å; Y112-W116 AromaticContact CE1-CD1 3.85Å; Y112-W116 AromaticContact CE1-NE1 4Å; Y112-W116 AromaticContact CE2-CD1 3.98Å; Y112-W116 AromaticContact CE2-NE1 3.65Å; Y112-W116 AromaticContact CZ-CD1 3.63Å; Y112-W116 AromaticContact CZ-NE1 3.33Å; Y112-W116 VanDerWaalsContact CZ-NE1 3.33Å; Y112-W116 PolarHBondContact O-N 2.83Å; Y112-W116 PolarHBondContact OH-NE1 3.15Å; Y112-W116 VanDerWaalsContact OH-NE1 3.12Å; M113-W116 PolarHBondContact O-N 2.69Å; R114-W116 VanDerWaalsContact C-N 3.3Å; R114-W116 PolarHBondContact O-N 3.03Å; W116-T118 VanDerWaalsContact C-N 3.32Å; W116-T118 PolarHBondContact O-N 2.82Å; W116-K119 HydrophobicContact CD2-CD 4.36Å; W116-K119 HydrophobicContact CE3-CD 4.21Å; W116-K119 HydrophobicContact CZ3-CD 4.49Å; W116-K119 PolarHBondContact O-N 3.17Å; W116-K119 VanDerWaalsContact O-N 3.17Å; W116-I120 WeakPolarHBondContact O-CG1 3.28Å; W116-I120 PolarHBondContact O-N 2.91Å; W116-F492 HydrophobicContact CB-CE1 4.19Å; W116-F492 HydrophobicContact CB-CE2 4.45Å; W116-F492 HydrophobicContact CB-CZ 4.1Å
117	R	95.6	Very high	95.5	Very high	102 Å²	102	85 Å²	85	39%	0.385	40%	0.395	S	S	.	.	H	α-helix	trans	-55.7	-48.1	172.6	-165.6	179.2	-61.6	-80.7	-1.9	111.2	M113 R114 K119 I120 Q121 F492	M113-R117 PolarHBondContact O-N 3.18Å; R114-R117 WeakPolarHBondContact O-CB 3.44Å; R114-R117 PolarHBondContact O-N 2.93Å; R117-K119 VanDerWaalsContact C-N 3.34Å; R117-K119 PolarHBondContact O-N 3.44Å; R117-I120 PolarHBondContact O-N 3.25Å; R117-Q121 WeakPolarHBondContact O-CB 3.24Å; R117-Q121 PolarHBondContact O-N 3.15Å; R117-F492 HydrophobicContact CB-CD1 3.81Å; R117-F492 HydrophobicContact CG-CD1 4.31Å
118	T	95.4	Very high	95	Very high	92 Å²	92	87.9 Å²	87.9	56%	0.564	42%	0.418	S	S	*	.	H	α-helix	trans	-61.6	-39.5	177.2	-53.8	0	0	0	0	112.5	R114 E115 W116 A122	R114-T118 PolarHBondContact O-N 2.97Å; R114-T118 PolarHBondContact O-OG1 2.87Å; R114-T118 VanDerWaalsContact O-OG1 3.07Å; E115-T118 PolarHBondContact O-N 2.72Å; W116-T118 VanDerWaalsContact C-N 3.32Å; W116-T118 PolarHBondContact O-N 2.82Å; T118-A122 WeakPolarHBondContact O-CB 3.32Å; T118-A122 PolarHBondContact O-N 2.98Å
119	K	96.3	Very high	94.2	Very high	79 Å²	79	86.9 Å²	86.9	34%	0.343	41%	0.412	S	S	.	.	H	α-helix	trans	-64.9	-44.5	175.9	-73.3	169	-174.8	166.2	0	112.5	E115 W116 R117 Q123	E115-K119 WeakPolarHBondContact O-CG 3.26Å; E115-K119 PolarHBondContact O-N 2.94Å; E115-K119 WeakPolarHBondContact OE1-CE 3.44Å; E115-K119 IonicContact OE1-NZ 3.68Å; E115-K119 PolarHBondContact OE1-NZ 3.32Å; E115-K119 IonicContact OE2-NZ 3.57Å; W116-K119 HydrophobicContact CD2-CD 4.36Å; W116-K119 HydrophobicContact CE3-CD 4.21Å; W116-K119 HydrophobicContact CZ3-CD 4.49Å; W116-K119 PolarHBondContact O-N 3.17Å; W116-K119 VanDerWaalsContact O-N 3.17Å; R117-K119 VanDerWaalsContact C-N 3.34Å; R117-K119 PolarHBondContact O-N 3.44Å; K119-Q123 WeakPolarHBondContact O-CG 3.42Å; K119-Q123 PolarHBondContact O-N 2.86Å; K119-Q123 VanDerWaalsContact O-N 3.16Å
120	I	95.7	Very high	93	Very high	6 Å²	6	87.8 Å²	87.8	3%	0.031	43%	0.431	C	S	.	.	H	α-helix	trans	-68.7	-42.3	178.9	-62.7	-51.7	0	0	0	110.7	I59 W116 R117 A122 Q123 I124 F492	I59-I120 HydrophobicContact CD1-CD1 4.44Å; I59-I120 HydrophobicContact CD1-CG1 4.39Å; I59-I120 HydrophobicContact CG2-CD1 4.49Å; W116-I120 WeakPolarHBondContact O-CG1 3.28Å; W116-I120 PolarHBondContact O-N 2.91Å; R117-I120 PolarHBondContact O-N 3.25Å; I120-A122 PolarHBondContact O-N 2.98Å; I120-Q123 WeakPolarHBondContact O-CB 3.4Å; I120-Q123 PolarHBondContact O-N 3.45Å; I120-I124 HydrophobicContact CG2-CD1 4.04Å; I120-I124 WeakPolarHBondContact O-CG1 3.23Å; I120-I124 PolarHBondContact O-N 2.71Å; I120-F492 HydrophobicContact CB-CB 4.06Å; I120-F492 HydrophobicContact CG1-CB 4.09Å; I120-F492 HydrophobicContact CG2-CB 4.18Å
121	Q	94.4	Very high	91.3	Very high	51 Å²	51	89.5 Å²	89.5	24%	0.238	44%	0.444	C	S	.	.	H	α-helix	trans	-55	-51.2	173.5	-170.6	59.6	49.7	0	0	111.4	R117 Q123 I124 D125 Y498	R117-Q121 WeakPolarHBondContact O-CB 3.24Å; R117-Q121 PolarHBondContact O-N 3.15Å; Q121-Q123 PolarHBondContact O-N 3.13Å; Q121-Q123 VanDerWaalsContact O-N 3.14Å; Q121-I124 PolarHBondContact O-N 3.29Å; Q121-D125 PolarHBondContact NE2-OD1 3.1Å; Q121-D125 PolarHBondContact O-N 3.36Å; Q121-Y498 VanDerWaalsContact CD-OH 3.3Å; Q121-Y498 PolarHBondContact NE2-OH 3.44Å; Q121-Y498 PolarHBondContact OE1-OH 2.91Å
122	A	95	Very high	90.1	Very high	29 Å²	29	94 Å²	94	24%	0.24	46%	0.455	C	S	.	.	H	α-helix	trans	-65.2	-17.5	178.4	0	0	0	0	0	114.2	T118 I120 R126	T118-A122 WeakPolarHBondContact O-CB 3.32Å; T118-A122 PolarHBondContact O-N 2.98Å; I120-A122 PolarHBondContact O-N 2.98Å; A122-R126 WeakPolarHBondContact O-CB 3.39Å; A122-R126 WeakPolarHBondContact O-CD 3.38Å; A122-R126 WeakPolarHBondContact O-CG 3.42Å
123	Q	94.5	Very high	88.7	Confident	127 Å²	127	101.3 Å²	101.3	59%	0.593	49%	0.491	S	S	*	.	H	α-helix	trans	-80.1	-38.2	169.8	-74.4	176.4	-3.8	0	0	111.8	K119 I120 Q121 F127	K119-Q123 WeakPolarHBondContact O-CG 3.42Å; K119-Q123 PolarHBondContact O-N 2.86Å; K119-Q123 VanDerWaalsContact O-N 3.16Å; I120-Q123 WeakPolarHBondContact O-CB 3.4Å; I120-Q123 PolarHBondContact O-N 3.45Å; Q121-Q123 PolarHBondContact O-N 3.13Å; Q121-Q123 VanDerWaalsContact O-N 3.14Å; Q123-F127 PolarHBondContact O-N 2.99Å
124	I	92.4	Very high	87.9	Confident	67 Å²	67	100.1 Å²	100.1	34%	0.344	50%	0.496	S	S	.	.	H	α-helix	trans	-66.9	-49	176.2	-64.3	166	0	0	0	110.1	I120 Q121 R126 F127 A493 Y498	I120-I124 HydrophobicContact CG2-CD1 4.04Å; I120-I124 WeakPolarHBondContact O-CG1 3.23Å; I120-I124 PolarHBondContact O-N 2.71Å; Q121-I124 PolarHBondContact O-N 3.29Å; I124-R126 PolarHBondContact O-N 3.21Å; I124-R126 VanDerWaalsContact O-N 3.14Å; I124-F127 VanDerWaalsContact O-CB 3.24Å; I124-F127 WeakPolarHBondContact O-CB 3.32Å; I124-F127 PolarHBondContact O-N 3.42Å; I124-A493 HydrophobicContact CD1-CB 3.8Å; I124-Y498 WeakPolarHBondContact CD1-OH 3.43Å; I124-Y498 HydrophobicContact CG2-CE1 4.37Å
125	D	90.7	Very high	87.4	Confident	112 Å²	112	98.1 Å²	98.1	60%	0.599	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-25.8	-179.9	-57.7	-22.8	0	0	0	113.2	Q121	Q121-D125 PolarHBondContact NE2-OD1 3.1Å; Q121-D125 PolarHBondContact O-N 3.36Å
126	R	92.2	Very high	87	Confident	204 Å²	204	98.5 Å²	98.5	77%	0.77	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	6.3	179.4	-64.3	177	-170	173.6	3.1	113.1	A122 I124	A122-R126 WeakPolarHBondContact O-CB 3.39Å; A122-R126 WeakPolarHBondContact O-CD 3.38Å; A122-R126 WeakPolarHBondContact O-CG 3.42Å; I124-R126 PolarHBondContact O-N 3.21Å; I124-R126 VanDerWaalsContact O-N 3.14Å
127	F	90.3	Very high	86.7	Confident	145 Å²	145	101.9 Å²	101.9	64%	0.636	51%	0.507	S	S	*	.			trans	-62.5	127.8	-179.9	-168.6	-89.7	0	0	0	109.5	Q123 I124 I129	Q123-F127 PolarHBondContact O-N 2.99Å; I124-F127 VanDerWaalsContact O-CB 3.24Å; I124-F127 WeakPolarHBondContact O-CB 3.32Å; I124-F127 PolarHBondContact O-N 3.42Å; F127-I129 PolarHBondContact O-N 3.36Å; F127-I129 VanDerWaalsContact O-N 3.11Å
128	P	87	Confident	86.4	Confident	100 Å²	100	99.4 Å²	99.4	65%	0.649	50%	0.503	S	S	*	.			trans	-67.8	115.8	-174.1	26.6	-33.9	0	0	0	110.4
129	I	82.4	Confident	86.2	Confident	79 Å²	79	99.6 Å²	99.6	41%	0.405	50%	0.499	S	S	.	.			trans	-91.3	137.8	170.9	-61.5	166.3	0	0	0	106.7	F127 D131 W136	F127-I129 PolarHBondContact O-N 3.36Å; F127-I129 VanDerWaalsContact O-N 3.11Å; I129-D131 PolarHBondContact O-N 3.23Å; I129-D131 VanDerWaalsContact O-N 3.08Å; I129-W136 HydrophobicContact CD1-CD2 4.43Å; I129-W136 HydrophobicContact CD1-CZ2 4.15Å; I129-W136 HydrophobicContact CG2-CB 3.66Å; I129-W136 HydrophobicContact CG2-CD2 3.41Å; I129-W136 VanDerWaalsContact CG2-CD2 3.41Å; I129-W136 HydrophobicContact CG2-CE3 3.74Å; I129-W136 HydrophobicContact CG2-CG 3.39Å
130	G	73.7	Confident	86	Confident	59 Å²	59	98.9 Å²	98.9	61%	0.608	50%	0.498	S	S	*	.			trans	-55	115.8	-172.7	0	0	0	0	0	113.4	R132	G130-R132 PolarHBondContact O-N 3.3Å
131	D	61.5	Low	85.9	Confident	158 Å²	158	101 Å²	101	85%	0.845	51%	0.508	S	S	*	.			trans	-68.9	19.1	-168.1	-61.6	-56.8	0	0	0	116.2	I129 E133	I129-D131 PolarHBondContact O-N 3.23Å; I129-D131 VanDerWaalsContact O-N 3.08Å; D131-E133 PolarHBondContact O-N 3.07Å
132	R	71.9	Confident	85.9	Confident	175 Å²	175	104.2 Å²	104.2	66%	0.66	52%	0.521	S	S	*	.	S	Bend	trans	-75.1	110.6	173.5	-73.1	-171.3	170.2	-167.9	-0.7	109.1	G130 G134 E135	G130-R132 PolarHBondContact O-N 3.3Å; R132-G134 PolarHBondContact O-N 3.4Å; R132-G134 VanDerWaalsContact O-N 3.1Å; R132-E135 HydrophobicContact CB-CB 4.11Å; R132-E135 VanDerWaalsContact CB-CD 3.42Å; R132-E135 HydrophobicContact CB-CG 3.72Å; R132-E135 WeakPolarHBondContact CD-OE1 3.34Å; R132-E135 VanDerWaalsContact CD-OE2 3.29Å; R132-E135 WeakPolarHBondContact CD-OE2 3.28Å; R132-E135 IonicContact CZ-OE1 3.82Å; R132-E135 IonicContact NE-OE1 3.85Å; R132-E135 IonicContact NH1-OE1 3.53Å; R132-E135 PolarHBondContact NH1-OE1 3.22Å; R132-E135 VanDerWaalsContact NH1-OE1 3.1Å; R132-E135 WeakPolarHBondContact O-CB 3.44Å; R132-E135 PolarHBondContact O-N 2.88Å
133	E	67.9	Low	85.9	Confident	200 Å²	200	104.7 Å²	104.7	94%	0.935	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43	115.2	-172.8	-67.7	-174.4	145.2	0	0	112.2	D131 E135	D131-E133 PolarHBondContact O-N 3.07Å; E133-E135 VanDerWaalsContact C-N 3.29Å; E133-E135 PolarHBondContact O-N 3.28Å
134	G	79.7	Confident	85.9	Confident	42 Å²	42	100.8 Å²	100.8	43%	0.433	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	-9.5	177	0	0	0	0	0	116.9	R132 W136 Q137 T138	R132-G134 PolarHBondContact O-N 3.4Å; R132-G134 VanDerWaalsContact O-N 3.1Å; G134-W136 VanDerWaalsContact C-N 3.32Å; G134-W136 PolarHBondContact O-N 3.31Å; G134-Q137 PolarHBondContact O-N 3.36Å; G134-T138 VanDerWaalsContact O-CB 3.32Å; G134-T138 WeakPolarHBondContact O-CB 3.41Å; G134-T138 PolarHBondContact O-N 3.14Å; G134-T138 PolarHBondContact O-OG1 3.42Å
135	E	85.8	Confident	86	Confident	99 Å²	99	97.9 Å²	97.9	46%	0.463	49%	0.489	S	S	.	.	H	α-helix	trans	-59.7	-42.4	178.8	-77.8	-169.2	-179.3	0	0	111.3	R132 E133 T138 M139	R132-E135 HydrophobicContact CB-CB 4.11Å; R132-E135 VanDerWaalsContact CB-CD 3.42Å; R132-E135 HydrophobicContact CB-CG 3.72Å; R132-E135 WeakPolarHBondContact CD-OE1 3.34Å; R132-E135 VanDerWaalsContact CD-OE2 3.29Å; R132-E135 WeakPolarHBondContact CD-OE2 3.28Å; R132-E135 IonicContact CZ-OE1 3.82Å; R132-E135 IonicContact NE-OE1 3.85Å; R132-E135 IonicContact NH1-OE1 3.53Å; R132-E135 PolarHBondContact NH1-OE1 3.22Å; R132-E135 VanDerWaalsContact NH1-OE1 3.1Å; R132-E135 WeakPolarHBondContact O-CB 3.44Å; R132-E135 PolarHBondContact O-N 2.88Å; E133-E135 VanDerWaalsContact C-N 3.29Å; E133-E135 PolarHBondContact O-N 3.28Å; E135-T138 PolarHBondContact O-N 3.01Å; E135-M139 WeakPolarHBondContact O-CB 3.47Å; E135-M139 PolarHBondContact O-N 2.99Å
136	W	88.1	Confident	86.2	Confident	105 Å²	105	94.5 Å²	94.5	40%	0.398	47%	0.474	S	S	.	.	H	α-helix	trans	-63.2	-46.9	176	179.5	-119.2	0	0	0	113.5	I129 G134 T138 M139 I140	I129-W136 HydrophobicContact CD1-CD2 4.43Å; I129-W136 HydrophobicContact CD1-CZ2 4.15Å; I129-W136 HydrophobicContact CG2-CB 3.66Å; I129-W136 HydrophobicContact CG2-CD2 3.41Å; I129-W136 VanDerWaalsContact CG2-CD2 3.41Å; I129-W136 HydrophobicContact CG2-CE3 3.74Å; I129-W136 HydrophobicContact CG2-CG 3.39Å; G134-W136 VanDerWaalsContact C-N 3.32Å; G134-W136 PolarHBondContact O-N 3.31Å; W136-T138 VanDerWaalsContact C-N 3.31Å; W136-T138 PolarHBondContact O-N 3.39Å; W136-M139 HydrophobicContact CE3-SD 4.08Å; W136-M139 HydrophobicContact CZ3-SD 3.92Å; W136-M139 WeakPolarHBondContact O-CB 3.43Å; W136-M139 PolarHBondContact O-N 3.36Å; W136-M139 VanDerWaalsContact O-N 3.11Å; W136-I140 HydrophobicContact CD2-CD1 4.27Å; W136-I140 HydrophobicContact CD2-CG1 4.43Å; W136-I140 HydrophobicContact CZ2-CD1 3.84Å; W136-I140 HydrophobicContact CZ2-CG1 4.23Å; W136-I140 VanDerWaalsContact NE1-CD1 3.34Å; W136-I140 PolarHBondContact O-N 2.98Å
137	Q	90.1	Very high	86.4	Confident	108 Å²	108	88.4 Å²	88.4	51%	0.505	45%	0.452	S	S	.	.	H	α-helix	trans	-63.7	-41.4	179.1	-60.7	-59.6	-23	0	0	110.7	G134 M139 I140 Q141	G134-Q137 PolarHBondContact O-N 3.36Å; Q137-M139 VanDerWaalsContact C-N 3.31Å; Q137-M139 PolarHBondContact O-N 3.15Å; Q137-I140 PolarHBondContact O-N 3.16Å; Q137-Q141 WeakPolarHBondContact O-CB 3.38Å; Q137-Q141 WeakPolarHBondContact O-CG 3.36Å; Q137-Q141 PolarHBondContact O-N 3.35Å
138	T	90.1	Very high	86.6	Confident	50 Å²	50	82.6 Å²	82.6	31%	0.307	43%	0.427	S	S	.	.	H	α-helix	trans	-61.7	-38.3	173.5	-55.5	0	0	0	0	111.6	G134 E135 W136 K142	G134-T138 VanDerWaalsContact O-CB 3.32Å; G134-T138 WeakPolarHBondContact O-CB 3.41Å; G134-T138 PolarHBondContact O-N 3.14Å; G134-T138 PolarHBondContact O-OG1 3.42Å; E135-T138 PolarHBondContact O-N 3.01Å; W136-T138 VanDerWaalsContact C-N 3.31Å; W136-T138 PolarHBondContact O-N 3.39Å; T138-K142 HydrophobicContact CG2-CD 4.17Å; T138-K142 WeakPolarHBondContact O-CB 3.49Å; T138-K142 VanDerWaalsContact O-CG 3.26Å; T138-K142 WeakPolarHBondContact O-CG 3.16Å; T138-K142 PolarHBondContact O-N 2.79Å
139	M	91.1	Very high	86.9	Confident	97 Å²	97	78.5 Å²	78.5	48%	0.478	40%	0.401	S	S	.	.	H	α-helix	trans	-64.6	-49.8	176.4	-171.2	-175.5	-59.3	0	0	111.4	E135 W136 Q137 Q141 K142 M143	E135-M139 WeakPolarHBondContact O-CB 3.47Å; E135-M139 PolarHBondContact O-N 2.99Å; W136-M139 HydrophobicContact CE3-SD 4.08Å; W136-M139 HydrophobicContact CZ3-SD 3.92Å; W136-M139 WeakPolarHBondContact O-CB 3.43Å; W136-M139 PolarHBondContact O-N 3.36Å; W136-M139 VanDerWaalsContact O-N 3.11Å; Q137-M139 VanDerWaalsContact C-N 3.31Å; Q137-M139 PolarHBondContact O-N 3.15Å; M139-Q141 PolarHBondContact O-N 3.01Å; M139-K142 PolarHBondContact O-N 3.23Å; M139-M143 HydrophobicContact CG-SD 4.21Å; M139-M143 WeakPolarHBondContact O-CG 3.45Å; M139-M143 PolarHBondContact O-N 2.96Å
140	I	92.1	Very high	87.5	Confident	64 Å²	64	75.2 Å²	75.2	33%	0.328	38%	0.383	S	S	.	.	H	α-helix	trans	-58.1	-48.6	175.6	-69.7	177	0	0	0	110.5	W136 Q137 K142 M143 V144	W136-I140 HydrophobicContact CD2-CD1 4.27Å; W136-I140 HydrophobicContact CD2-CG1 4.43Å; W136-I140 HydrophobicContact CZ2-CD1 3.84Å; W136-I140 HydrophobicContact CZ2-CG1 4.23Å; W136-I140 VanDerWaalsContact NE1-CD1 3.34Å; W136-I140 PolarHBondContact O-N 2.98Å; Q137-I140 PolarHBondContact O-N 3.16Å; I140-K142 VanDerWaalsContact C-N 3.3Å; I140-K142 PolarHBondContact O-N 3.3Å; I140-M143 PolarHBondContact O-N 3.04Å; I140-M143 VanDerWaalsContact O-N 3.09Å; I140-V144 HydrophobicContact CG2-CG2 4.19Å; I140-V144 WeakPolarHBondContact O-CG2 3.35Å; I140-V144 PolarHBondContact O-N 2.81Å
141	Q	94	Very high	88.4	Confident	50 Å²	50	75.1 Å²	75.1	23%	0.234	37%	0.367	C	S	.	.	H	α-helix	trans	-58.6	-40.1	178.9	-71.2	166.2	4	0	0	112.1	Q137 M139 S145 F160 T164 Q166	Q137-Q141 WeakPolarHBondContact O-CB 3.38Å; Q137-Q141 WeakPolarHBondContact O-CG 3.36Å; Q137-Q141 PolarHBondContact O-N 3.35Å; M139-Q141 PolarHBondContact O-N 3.01Å; Q141-S145 WeakPolarHBondContact O-CB 3.44Å; Q141-S145 PolarHBondContact O-N 3.43Å; Q141-F160 HydrophobicContact CB-CE1 4.28Å; Q141-F160 HydrophobicContact CB-CZ 4.31Å; Q141-F160 HydrophobicContact CG-CZ 4.19Å; Q141-F160 WeakPolarHBondContact O-CE1 3.29Å; Q141-T164 HydrophobicContact CG-CG2 4.13Å; Q141-Q166 HydrophobicContact CB-CG 4.08Å
142	K	93.8	Very high	89.9	Confident	118 Å²	118	67.9 Å²	67.9	51%	0.513	33%	0.33	S	S	.	.	H	α-helix	trans	-64.1	-42.6	173.6	-75.5	171	179.9	171.4	0	112.5	T138 M139 I140 S146	T138-K142 HydrophobicContact CG2-CD 4.17Å; T138-K142 WeakPolarHBondContact O-CB 3.49Å; T138-K142 VanDerWaalsContact O-CG 3.26Å; T138-K142 WeakPolarHBondContact O-CG 3.16Å; T138-K142 PolarHBondContact O-N 2.79Å; M139-K142 PolarHBondContact O-N 3.23Å; I140-K142 VanDerWaalsContact C-N 3.3Å; I140-K142 PolarHBondContact O-N 3.3Å; K142-S146 VanDerWaalsContact O-CB 3.24Å; K142-S146 WeakPolarHBondContact O-CB 3.49Å; K142-S146 PolarHBondContact O-N 3.39Å
143	M	94.5	Very high	90.8	Very high	39 Å²	39	64.5 Å²	64.5	19%	0.192	32%	0.318	C	S	.	.	H	α-helix	trans	-64.8	-44.2	178.1	-68.3	174	66.7	0	0	111.8	M139 I140 Y147 P467 L468 A471	M139-M143 HydrophobicContact CG-SD 4.21Å; M139-M143 WeakPolarHBondContact O-CG 3.45Å; M139-M143 PolarHBondContact O-N 2.96Å; I140-M143 PolarHBondContact O-N 3.04Å; I140-M143 VanDerWaalsContact O-N 3.09Å; M143-Y147 WeakPolarHBondContact O-CB 3.1Å; M143-Y147 PolarHBondContact O-N 3.17Å; M143-P467 HydrophobicContact CG-CB 4.23Å; M143-L468 HydrophobicContact CB-CB 4.48Å; M143-L468 HydrophobicContact CE-CB 4.36Å; M143-L468 HydrophobicContact CE-CD1 4.08Å; M143-A471 HydrophobicContact CE-CB 3.7Å
144	V	95.1	Very high	91.9	Very high	45 Å²	45	55.2 Å²	55.2	27%	0.273	28%	0.275	S	S	.	.	H	α-helix	trans	-65	-48.5	176	173	0	0	0	0	111.1	I140 S146 Y147 L148 F160	I140-V144 HydrophobicContact CG2-CG2 4.19Å; I140-V144 WeakPolarHBondContact O-CG2 3.35Å; I140-V144 PolarHBondContact O-N 2.81Å; V144-S146 VanDerWaalsContact C-N 3.34Å; V144-S146 PolarHBondContact O-N 3.18Å; V144-Y147 WeakPolarHBondContact O-CB 3.35Å; V144-Y147 PolarHBondContact O-N 2.7Å; V144-L148 HydrophobicContact CG1-CD1 4.04Å; V144-L148 HydrophobicContact CG1-CG 4.4Å; V144-L148 WeakPolarHBondContact O-CG 3.23Å; V144-L148 PolarHBondContact O-N 2.93Å; V144-F160 HydrophobicContact CB-CE1 4.18Å; V144-F160 HydrophobicContact CB-CZ 4Å; V144-F160 HydrophobicContact CG1-CD1 4.5Å; V144-F160 HydrophobicContact CG1-CE1 3.98Å; V144-F160 HydrophobicContact CG1-CE2 4.01Å; V144-F160 HydrophobicContact CG1-CZ 3.7Å
145	S	94.9	Very high	92.5	Very high	7 Å²	7	56.4 Å²	56.4	5%	0.049	28%	0.281	C	S	.	.	H	α-helix	trans	-57.9	-45.8	176.5	-178.4	0	0	0	0	111.6	Q141 Y147 L148 V149	Q141-S145 WeakPolarHBondContact O-CB 3.44Å; Q141-S145 PolarHBondContact O-N 3.43Å; S145-Y147 PolarHBondContact O-N 3.39Å; S145-L148 PolarHBondContact O-N 3.4Å; S145-V149 WeakPolarHBondContact O-CG2 3.43Å; S145-V149 PolarHBondContact O-N 3.12Å
146	S	94.4	Very high	92.9	Very high	40 Å²	40	54.4 Å²	54.4	28%	0.28	28%	0.276	S	S	.	.	H	α-helix	trans	-62.8	-39.2	176.7	-179.3	0	0	0	0	112.8	K142 V144 H150 P467	K142-S146 VanDerWaalsContact O-CB 3.24Å; K142-S146 WeakPolarHBondContact O-CB 3.49Å; K142-S146 PolarHBondContact O-N 3.39Å; V144-S146 VanDerWaalsContact C-N 3.34Å; V144-S146 PolarHBondContact O-N 3.18Å; S146-H150 WeakPolarHBondContact O-CB 3.44Å; S146-H150 PolarHBondContact O-N 3.18Å; S146-P467 WeakPolarHBondContact OG-CD 3.48Å
147	Y	95.1	Very high	93.1	Very high	77 Å²	77	49.5 Å²	49.5	30%	0.302	26%	0.258	S	S	.	.	H	α-helix	trans	-62.6	-47.2	173.1	176.6	-88.8	0	0	0	111.8	M143 V144 S145 V149 H150 H151 Y153 P466 L468	M143-Y147 WeakPolarHBondContact O-CB 3.1Å; M143-Y147 PolarHBondContact O-N 3.17Å; V144-Y147 WeakPolarHBondContact O-CB 3.35Å; V144-Y147 PolarHBondContact O-N 2.7Å; S145-Y147 PolarHBondContact O-N 3.39Å; Y147-V149 VanDerWaalsContact C-N 3.35Å; Y147-V149 PolarHBondContact O-N 3.06Å; Y147-H150 PolarHBondContact O-N 2.94Å; Y147-H151 AromaticContact CD2-CD2 3.59Å; Y147-H151 AromaticContact CD2-NE2 3.82Å; Y147-H151 AromaticContact CE2-CD2 3.3Å; Y147-H151 WeakPolarHBondContact CE2-CD2 3.46Å; Y147-H151 AromaticContact CE2-NE2 3.31Å; Y147-H151 VanDerWaalsContact CE2-NE2 3.31Å; Y147-H151 WeakPolarHBondContact CE2-NE2 3.38Å; Y147-H151 AromaticContact CZ-CD2 3.59Å; Y147-H151 AromaticContact CZ-NE2 3.9Å; Y147-H151 PolarHBondContact O-CD2 2.88Å; Y147-H151 PolarHBondContact O-N 2.88Å; Y147-Y153 HydrophobicContact CE1-CE2 4.09Å; Y147-P466 HydrophobicContact CD2-CB 4.29Å; Y147-P466 HydrophobicContact CD2-CG 3.79Å; Y147-L468 HydrophobicContact CD2-CD2 4.18Å; Y147-L468 HydrophobicContact CG-CD2 4.19Å
148	L	94.7	Very high	93.2	Very high	22 Å²	22	47.2 Å²	47.2	12%	0.115	25%	0.247	C	C	.	.	H	α-helix	trans	-60.5	-43.2	179.1	-68.7	172	0	0	0	111.8	V144 S145 G152 Y153 T156 A157 F160	V144-L148 HydrophobicContact CG1-CD1 4.04Å; V144-L148 HydrophobicContact CG1-CG 4.4Å; V144-L148 WeakPolarHBondContact O-CG 3.23Å; V144-L148 PolarHBondContact O-N 2.93Å; S145-L148 PolarHBondContact O-N 3.4Å; L148-G152 PolarHBondContact O-N 2.97Å; L148-Y153 HydrophobicContact CD2-CD2 4Å; L148-Y153 HydrophobicContact CD2-CG 4.13Å; L148-Y153 PolarHBondContact O-N 2.83Å; L148-T156 HydrophobicContact CD1-CG2 4.22Å; L148-T156 HydrophobicContact CD2-CG2 4.1Å; L148-A157 HydrophobicContact CB-CB 3.82Å; L148-F160 HydrophobicContact CD1-CB 4.04Å; L148-F160 HydrophobicContact CD1-CD1 4.38Å; L148-F160 HydrophobicContact CD1-CG 4.12Å
149	V	94.3	Very high	93.4	Very high	15 Å²	15	47.1 Å²	47.1	9%	0.091	25%	0.251	C	S	.	.	H	α-helix	trans	-66.8	-46.4	176.1	172.9	0	0	0	0	111.4	S145 Y147 H151 G152 A157 V168 E170 I175 R178	S145-V149 WeakPolarHBondContact O-CG2 3.43Å; S145-V149 PolarHBondContact O-N 3.12Å; Y147-V149 VanDerWaalsContact C-N 3.35Å; Y147-V149 PolarHBondContact O-N 3.06Å; V149-H151 PolarHBondContact O-N 3.15Å; V149-G152 PolarHBondContact O-N 3.23Å; V149-G152 VanDerWaalsContact O-N 3.11Å; V149-A157 HydrophobicContact CG2-CB 3.96Å; V149-V168 HydrophobicContact CG2-CG1 3.83Å; V149-V168 HydrophobicContact CG2-CG2 4.18Å; V149-E170 HydrophobicContact CG1-CB 4.05Å; V149-E170 WeakPolarHBondContact CG1-OE2 3.44Å; V149-I175 HydrophobicContact CG1-CD1 3.92Å; V149-I175 HydrophobicContact CG1-CG1 4.24Å; V149-R178 PolarHBondContact O-NH2 3.48Å
150	H	94.4	Very high	93.6	Very high	10 Å²	10	44.9 Å²	44.9	5%	0.046	24%	0.238	C	C	.	.	H	α-helix	trans	-57.4	-49.2	-179.3	178.9	-75.2	0	0	0	111.9	S146 Y147 G152 R178 N453 L457 K464 P466	S146-H150 WeakPolarHBondContact O-CB 3.44Å; S146-H150 PolarHBondContact O-N 3.18Å; Y147-H150 PolarHBondContact O-N 2.94Å; H150-G152 VanDerWaalsContact C-N 3.25Å; H150-G152 PolarHBondContact O-N 3.18Å; H150-R178 PolarHBondContact O-NH1 3.26Å; H150-N453 PolarHBondContact CE1-ND2 2.95Å; H150-N453 PolarHBondContact O-ND2 3.31Å; H150-L457 WeakPolarHBondContact CD2-CD1 3.39Å; H150-L457 WeakPolarHBondContact NE2-CD1 3.39Å; H150-K464 PolarHBondContact NE2-O 3.41Å; H150-P466 HydrophobicContact CB-CB 4.14Å; H150-P466 HydrophobicContact CB-CG 4.46Å
151	H	93.2	Very high	93.7	Very high	56 Å²	56	42.3 Å²	42.3	26%	0.259	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	0.4	179.8	-72.3	-85.3	0	0	0	114.3	Y147 V149 Y153	Y147-H151 AromaticContact CD2-CD2 3.59Å; Y147-H151 AromaticContact CD2-NE2 3.82Å; Y147-H151 AromaticContact CE2-CD2 3.3Å; Y147-H151 WeakPolarHBondContact CE2-CD2 3.46Å; Y147-H151 AromaticContact CE2-NE2 3.31Å; Y147-H151 VanDerWaalsContact CE2-NE2 3.31Å; Y147-H151 WeakPolarHBondContact CE2-NE2 3.38Å; Y147-H151 AromaticContact CZ-CD2 3.59Å; Y147-H151 AromaticContact CZ-NE2 3.9Å; Y147-H151 PolarHBondContact O-CD2 2.88Å; Y147-H151 PolarHBondContact O-N 2.88Å; V149-H151 PolarHBondContact O-N 3.15Å; H151-Y153 HydrophobicContact CB-CD2 3.67Å; H151-Y153 HydrophobicContact CB-CE2 3.38Å
152	G	91.9	Very high	93.6	Very high	7 Å²	7	47.9 Å²	47.9	7%	0.072	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	28.3	174.3	0	0	0	0	0	114.2	L148 V149 H150 C154 Q179	L148-G152 PolarHBondContact O-N 2.97Å; V149-G152 PolarHBondContact O-N 3.23Å; V149-G152 VanDerWaalsContact O-N 3.11Å; H150-G152 VanDerWaalsContact C-N 3.25Å; H150-G152 PolarHBondContact O-N 3.18Å; G152-C154 PolarHBondContact O-N 3.02Å; G152-Q179 WeakPolarHBondContact O-CG 3.4Å; G152-Q179 PolarHBondContact O-NE2 3.13Å
153	Y	92.4	Very high	93.7	Very high	103 Å²	103	46.5 Å²	46.5	40%	0.404	25%	0.251	S	S	.	.			trans	-80.1	50.8	173.4	-62.4	-73.2	0	0	0	112.1	Y147 L148 H151 A155 T156 A157	Y147-Y153 HydrophobicContact CE1-CE2 4.09Å; L148-Y153 HydrophobicContact CD2-CD2 4Å; L148-Y153 HydrophobicContact CD2-CG 4.13Å; L148-Y153 PolarHBondContact O-N 2.83Å; H151-Y153 HydrophobicContact CB-CD2 3.67Å; H151-Y153 HydrophobicContact CB-CE2 3.38Å; Y153-A155 PolarHBondContact O-N 3.49Å; Y153-T156 CarbonylContact O-C 3.55Å; Y153-T156 WeakPolarHBondContact O-CA 3.35Å; Y153-T156 WeakPolarHBondContact O-CB 3.46Å; Y153-T156 PolarHBondContact O-N 3.04Å; Y153-A157 WeakPolarHBondContact O-CB 3.44Å; Y153-A157 PolarHBondContact O-N 3.19Å
154	C	90.2	Very high	93.7	Very high	6 Å²	6	45.8 Å²	45.8	4%	0.041	25%	0.249	C	C	.	.	H	α-helix	trans	-52	-48	-164.2	-163.4	0	0	0	0	114.9	G152 T156 A157 E158 I175	G152-C154 PolarHBondContact O-N 3.02Å; C154-T156 VanDerWaalsContact C-N 3.34Å; C154-T156 PolarHBondContact O-N 2.92Å; C154-A157 PolarHBondContact O-N 3.05Å; C154-E158 WeakPolarHBondContact O-CB 3.35Å; C154-E158 WeakPolarHBondContact O-CG 3.46Å; C154-E158 PolarHBondContact O-N 2.77Å; C154-I175 HydrophobicContact CB-CG2 3.82Å
155	A	91.3	Very high	93.5	Very high	67 Å²	67	50.9 Å²	50.9	55%	0.554	28%	0.275	S	S	*	.	H	α-helix	trans	-62.7	-40.6	178.9	0	0	0	0	0	112.3	Y153 A159	Y153-A155 PolarHBondContact O-N 3.49Å; A155-A159 WeakPolarHBondContact O-CB 3.45Å; A155-A159 PolarHBondContact O-N 2.98Å
156	T	94.4	Very high	93.2	Very high	57 Å²	57	51.9 Å²	51.9	35%	0.35	28%	0.278	S	S	.	.	H	α-helix	trans	-68.9	-43	175.6	-43.8	0	0	0	0	111.2	L148 Y153 C154 E158 A159 F160	L148-T156 HydrophobicContact CD1-CG2 4.22Å; L148-T156 HydrophobicContact CD2-CG2 4.1Å; Y153-T156 CarbonylContact O-C 3.55Å; Y153-T156 WeakPolarHBondContact O-CA 3.35Å; Y153-T156 WeakPolarHBondContact O-CB 3.46Å; Y153-T156 PolarHBondContact O-N 3.04Å; C154-T156 VanDerWaalsContact C-N 3.34Å; C154-T156 PolarHBondContact O-N 2.92Å; T156-E158 PolarHBondContact O-N 3.4Å; T156-A159 PolarHBondContact O-N 3.42Å; T156-F160 WeakPolarHBondContact O-CB 3.24Å; T156-F160 PolarHBondContact O-N 3.45Å
157	A	93.4	Very high	92.8	Very high	2 Å²	2	55.3 Å²	55.3	2%	0.017	30%	0.298	C	S	.	.	H	α-helix	trans	-60.7	-44.6	177.3	0	0	0	0	0	111.6	L148 V149 Y153 C154 A161	L148-A157 HydrophobicContact CB-CB 3.82Å; V149-A157 HydrophobicContact CG2-CB 3.96Å; Y153-A157 WeakPolarHBondContact O-CB 3.44Å; Y153-A157 PolarHBondContact O-N 3.19Å; C154-A157 PolarHBondContact O-N 3.05Å; A157-A161 WeakPolarHBondContact O-CB 3.43Å; A157-A161 PolarHBondContact O-N 3.25Å
158	E	91.5	Very high	92.2	Very high	60 Å²	60	54.3 Å²	54.3	28%	0.28	30%	0.3	S	S	.	.	H	α-helix	trans	-63.7	-46.3	174.9	-79.2	-179.4	-137.2	0	0	112.9	C154 T156 R162	C154-E158 WeakPolarHBondContact O-CB 3.35Å; C154-E158 WeakPolarHBondContact O-CG 3.46Å; C154-E158 PolarHBondContact O-N 2.77Å; T156-E158 PolarHBondContact O-N 3.4Å; E158-R162 WeakPolarHBondContact O-CB 3.4Å; E158-R162 WeakPolarHBondContact O-CG 3.47Å; E158-R162 PolarHBondContact O-N 3.06Å; E158-R162 IonicContact OE2-NH1 3.84Å; E158-R162 PolarHBondContact OE2-NH1 3.32Å; E158-R162 VanDerWaalsContact OE2-NH1 3.16Å
159	A	94.8	Very high	91.5	Very high	47 Å²	47	61 Å²	61	39%	0.388	33%	0.334	S	S	.	.	H	α-helix	trans	-64	-44.4	178.7	0	0	0	0	0	111.3	A155 T156 R162 S163	A155-A159 WeakPolarHBondContact O-CB 3.45Å; A155-A159 PolarHBondContact O-N 2.98Å; T156-A159 PolarHBondContact O-N 3.42Å; A159-R162 PolarHBondContact O-N 3.48Å; A159-S163 PolarHBondContact O-N 2.89Å; A159-S163 VanDerWaalsContact O-N 3.13Å; A159-S163 PolarHBondContact O-OG 2.81Å
160	F	95.6	Very high	91.1	Very high	50 Å²	50	61.3 Å²	61.3	22%	0.219	34%	0.335	C	S	.	.	H	α-helix	trans	-60.6	-53.4	175.4	-172.9	-96.8	0	0	0	110.9	Q141 V144 L148 T156 R162 S163 T164	Q141-F160 HydrophobicContact CB-CE1 4.28Å; Q141-F160 HydrophobicContact CB-CZ 4.31Å; Q141-F160 HydrophobicContact CG-CZ 4.19Å; Q141-F160 WeakPolarHBondContact O-CE1 3.29Å; V144-F160 HydrophobicContact CB-CE1 4.18Å; V144-F160 HydrophobicContact CB-CZ 4Å; V144-F160 HydrophobicContact CG1-CD1 4.5Å; V144-F160 HydrophobicContact CG1-CE1 3.98Å; V144-F160 HydrophobicContact CG1-CE2 4.01Å; V144-F160 HydrophobicContact CG1-CZ 3.7Å; L148-F160 HydrophobicContact CD1-CB 4.04Å; L148-F160 HydrophobicContact CD1-CD1 4.38Å; L148-F160 HydrophobicContact CD1-CG 4.12Å; T156-F160 WeakPolarHBondContact O-CB 3.24Å; T156-F160 PolarHBondContact O-N 3.45Å; F160-R162 VanDerWaalsContact C-N 3.3Å; F160-R162 PolarHBondContact O-N 2.88Å; F160-S163 WeakPolarHBondContact CA-OG 3.39Å; F160-S163 CarbonylContact O-C 3.58Å; F160-S163 WeakPolarHBondContact O-CA 3.48Å; F160-S163 PolarHBondContact O-N 3.13Å; F160-S163 PolarHBondContact O-OG 3.1Å; F160-T164 HydrophobicContact CD2-CG2 4.41Å; F160-T164 HydrophobicContact CE1-CG2 4.18Å; F160-T164 HydrophobicContact CE2-CG2 4.06Å; F160-T164 HydrophobicContact CZ-CG2 3.94Å; F160-T164 PolarHBondContact O-N 3.38Å; F160-T164 PolarHBondContact O-OG1 3.36Å
161	A	92.8	Very high	90.8	Very high	10 Å²	10	68 Å²	68	8%	0.083	37%	0.366	C	S	.	.	H	α-helix	trans	-54	-43.1	178.8	0	0	0	0	0	113.1	A157 S163 D165 Q166 V168	A157-A161 WeakPolarHBondContact O-CB 3.43Å; A157-A161 PolarHBondContact O-N 3.25Å; A161-S163 VanDerWaalsContact C-N 3.32Å; A161-S163 PolarHBondContact O-N 3.3Å; A161-D165 PolarHBondContact O-N 2.95Å; A161-D165 VanDerWaalsContact O-N 3.12Å; A161-Q166 WeakPolarHBondContact CB-O 3.48Å; A161-Q166 PolarHBondContact O-N 2.94Å; A161-Q166 VanDerWaalsContact O-N 3.1Å; A161-V168 HydrophobicContact CB-CG2 3.92Å
162	R	93.4	Very high	90.4	Very high	168 Å²	168	69 Å²	69	63%	0.634	37%	0.373	S	S	*	.	H	α-helix	trans	-65.8	-29.3	173.9	-74	-174.4	-65.2	-102	0.2	113.8	E158 A159 F160	E158-R162 WeakPolarHBondContact O-CB 3.4Å; E158-R162 WeakPolarHBondContact O-CG 3.47Å; E158-R162 PolarHBondContact O-N 3.06Å; E158-R162 IonicContact OE2-NH1 3.84Å; E158-R162 PolarHBondContact OE2-NH1 3.32Å; E158-R162 VanDerWaalsContact OE2-NH1 3.16Å; A159-R162 PolarHBondContact O-N 3.48Å; F160-R162 VanDerWaalsContact C-N 3.3Å; F160-R162 PolarHBondContact O-N 2.88Å
163	S	95.5	Very high	90.3	Very high	88 Å²	88	71.4 Å²	71.4	62%	0.615	39%	0.393	S	S	*	.	H	α-helix	trans	-86.7	-18	-179.7	68.6	0	0	0	0	114.3	A159 F160 A161	A159-S163 PolarHBondContact O-N 2.89Å; A159-S163 VanDerWaalsContact O-N 3.13Å; A159-S163 PolarHBondContact O-OG 2.81Å; F160-S163 WeakPolarHBondContact CA-OG 3.39Å; F160-S163 CarbonylContact O-C 3.58Å; F160-S163 WeakPolarHBondContact O-CA 3.48Å; F160-S163 PolarHBondContact O-N 3.13Å; F160-S163 PolarHBondContact O-OG 3.1Å; A161-S163 VanDerWaalsContact C-N 3.32Å; A161-S163 PolarHBondContact O-N 3.3Å
164	T	93.7	Very high	90.3	Very high	25 Å²	25	67.5 Å²	67.5	15%	0.153	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.7	15.2	-174.1	61.7	0	0	0	0	113.5	Q141 F160 Q166	Q141-T164 HydrophobicContact CG-CG2 4.13Å; F160-T164 HydrophobicContact CD2-CG2 4.41Å; F160-T164 HydrophobicContact CE1-CG2 4.18Å; F160-T164 HydrophobicContact CE2-CG2 4.06Å; F160-T164 HydrophobicContact CZ-CG2 3.94Å; F160-T164 PolarHBondContact O-N 3.38Å; F160-T164 PolarHBondContact O-OG1 3.36Å; T164-Q166 WeakPolarHBondContact O-CG 3.37Å; T164-Q166 PolarHBondContact O-N 2.91Å; T164-Q166 VanDerWaalsContact O-N 3.1Å; T164-Q166 PolarHBondContact O-NE2 3.34Å; T164-Q166 VanDerWaalsContact O-NE2 3.1Å; T164-Q166 VanDerWaalsContact OG1-CG 3.3Å; T164-Q166 WeakPolarHBondContact OG1-CG 3.37Å
165	D	91	Very high	90.4	Very high	152 Å²	152	67.4 Å²	67.4	81%	0.813	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.4	38.3	-176.4	-67.7	-42.9	0	0	0	114.4	A161	A161-D165 PolarHBondContact O-N 2.95Å; A161-D165 VanDerWaalsContact O-N 3.12Å
166	Q	89.2	Confident	90.5	Very high	27 Å²	27	69.8 Å²	69.8	13%	0.126	38%	0.377	C	S	.	.			trans	-93.8	145.3	178.6	-62.2	-55.5	-41.9	0	0	111.5	Q141 A161 T164	Q141-Q166 HydrophobicContact CB-CG 4.08Å; A161-Q166 WeakPolarHBondContact CB-O 3.48Å; A161-Q166 PolarHBondContact O-N 2.94Å; A161-Q166 VanDerWaalsContact O-N 3.1Å; T164-Q166 WeakPolarHBondContact O-CG 3.37Å; T164-Q166 PolarHBondContact O-N 2.91Å; T164-Q166 VanDerWaalsContact O-N 3.1Å; T164-Q166 PolarHBondContact O-NE2 3.34Å; T164-Q166 VanDerWaalsContact O-NE2 3.1Å; T164-Q166 VanDerWaalsContact OG1-CG 3.3Å; T164-Q166 WeakPolarHBondContact OG1-CG 3.37Å
167	T	85.7	Confident	90.5	Very high	112 Å²	112	69.7 Å²	69.7	69%	0.687	37%	0.374	S	S	*	.			trans	-91.1	129	175.6	50.7	0	0	0	0	111.4
168	V	82.4	Confident	90.7	Very high	57 Å²	57	69.6 Å²	69.6	35%	0.345	37%	0.374	S	S	.	.			trans	-90.3	114.2	168	177.1	0	0	0	0	107.6	V149 A161 I175	V149-V168 HydrophobicContact CG2-CG1 3.83Å; V149-V168 HydrophobicContact CG2-CG2 4.18Å; A161-V168 HydrophobicContact CB-CG2 3.92Å; V168-I175 HydrophobicContact CG1-CD1 4.14Å
169	L	81.1	Confident	90.8	Very high	161 Å²	161	69 Å²	69	84%	0.843	37%	0.371	S	S	*	.			trans	-83.9	-23.4	-176.2	-64.2	177.1	0	0	0	113.8
170	E	86	Confident	90.9	Very high	23 Å²	23	73.2 Å²	73.2	11%	0.107	38%	0.377	C	S	.	.	S	Bend	trans	-87.3	137.4	-179	-169.9	-177	165.3	0	0	110.9	V149 L172 S174 I175 R178 L462	V149-E170 HydrophobicContact CG1-CB 4.05Å; V149-E170 WeakPolarHBondContact CG1-OE2 3.44Å; E170-L172 PolarHBondContact O-N 2.66Å; E170-S174 VanDerWaalsContact OE1-CB 3.23Å; E170-S174 WeakPolarHBondContact OE1-CB 3.41Å; E170-S174 PolarHBondContact OE1-OG 3.45Å; E170-I175 HydrophobicContact CB-CD1 4.37Å; E170-I175 HydrophobicContact CB-CG1 4.25Å; E170-I175 HydrophobicContact CG-CG1 4.01Å; E170-R178 VanDerWaalsContact CD-NH2 3.28Å; E170-R178 IonicContact OE1-CZ 3.79Å; E170-R178 IonicContact OE1-NE 2.74Å; E170-R178 PolarHBondContact OE1-NE 3Å; E170-R178 IonicContact OE1-NH2 3.16Å; E170-R178 PolarHBondContact OE1-NH2 3.04Å; E170-R178 VanDerWaalsContact OE1-NH2 3.13Å; E170-R178 IonicContact OE2-CZ 3.28Å; E170-R178 IonicContact OE2-NE 3.58Å; E170-R178 IonicContact OE2-NH2 2.72Å; E170-R178 PolarHBondContact OE2-NH2 2.84Å; E170-L462 HydrophobicContact CG-CD1 3.93Å
171	E	86.7	Confident	91	Very high	150 Å²	150	71 Å²	71	70%	0.701	37%	0.367	S	S	*	.			trans	-63.1	137	176.6	-70	-167.7	162.8	0	0	112.5	A173 S174 I175	E171-A173 PolarHBondContact O-N 2.94Å; E171-S174 WeakPolarHBondContact O-CA 3.36Å; E171-S174 WeakPolarHBondContact O-CB 3.49Å; E171-S174 PolarHBondContact O-N 3.5Å; E171-I175 PolarHBondContact O-N 2.89Å
172	L	85.6	Confident	91.3	Very high	77 Å²	77	71.5 Å²	71.5	40%	0.403	37%	0.367	S	S	.	.	H	α-helix	trans	-54.1	-30.5	179.8	-138.1	155.8	0	0	0	112.9	E170 K176	E170-L172 PolarHBondContact O-N 2.66Å; L172-K176 HydrophobicContact CD2-CD 3.93Å; L172-K176 HydrophobicContact CD2-CG 4.41Å; L172-K176 WeakPolarHBondContact O-CB 3.47Å; L172-K176 WeakPolarHBondContact O-CG 3.37Å; L172-K176 PolarHBondContact O-N 3Å; L172-K176 VanDerWaalsContact O-N 3.12Å
173	A	90.1	Very high	91.4	Very high	58 Å²	58	70.5 Å²	70.5	48%	0.479	37%	0.368	S	S	.	.	H	α-helix	trans	-69	-41.5	174	0	0	0	0	0	112.9	E171 K176 N177	E171-A173 PolarHBondContact O-N 2.94Å; A173-K176 PolarHBondContact O-N 2.72Å; A173-N177 WeakPolarHBondContact O-CB 3.34Å; A173-N177 VanDerWaalsContact O-CG 3.26Å; A173-N177 PolarHBondContact O-N 3.36Å
174	S	92	Very high	91.5	Very high	21 Å²	21	66.9 Å²	66.9	15%	0.147	34%	0.341	C	S	.	.	H	α-helix	trans	-63.4	-45.5	175.8	179.7	0	0	0	0	111	E170 E171 K176 N177 R178	E170-S174 VanDerWaalsContact OE1-CB 3.23Å; E170-S174 WeakPolarHBondContact OE1-CB 3.41Å; E170-S174 PolarHBondContact OE1-OG 3.45Å; E171-S174 WeakPolarHBondContact O-CA 3.36Å; E171-S174 WeakPolarHBondContact O-CB 3.49Å; E171-S174 PolarHBondContact O-N 3.5Å; S174-K176 VanDerWaalsContact C-N 3.35Å; S174-K176 PolarHBondContact O-N 3.37Å; S174-N177 PolarHBondContact O-N 2.88Å; S174-R178 WeakPolarHBondContact O-CG 3.44Å; S174-R178 PolarHBondContact O-N 3.47Å
175	I	92.6	Very high	91.7	Very high	3 Å²	3	65.7 Å²	65.7	2%	0.015	33%	0.334	C	S	.	.	H	α-helix	trans	-59.1	-45.6	177.2	-53.7	171.4	0	0	0	110.6	V149 C154 V168 E170 E171 R178 Q179	V149-I175 HydrophobicContact CG1-CD1 3.92Å; V149-I175 HydrophobicContact CG1-CG1 4.24Å; C154-I175 HydrophobicContact CB-CG2 3.82Å; V168-I175 HydrophobicContact CG1-CD1 4.14Å; E170-I175 HydrophobicContact CB-CD1 4.37Å; E170-I175 HydrophobicContact CB-CG1 4.25Å; E170-I175 HydrophobicContact CG-CG1 4.01Å; E171-I175 PolarHBondContact O-N 2.89Å; I175-R178 PolarHBondContact O-N 3.42Å; I175-Q179 WeakPolarHBondContact O-CG 3.3Å; I175-Q179 PolarHBondContact O-N 3.33Å
176	K	92.9	Very high	92	Very high	117 Å²	117	62.4 Å²	62.4	51%	0.509	32%	0.316	S	S	.	.	H	α-helix	trans	-64.7	-36.8	176.9	-77.4	175.1	173.9	174.6	0	113.3	L172 A173 S174 Q179 R180	L172-K176 HydrophobicContact CD2-CD 3.93Å; L172-K176 HydrophobicContact CD2-CG 4.41Å; L172-K176 WeakPolarHBondContact O-CB 3.47Å; L172-K176 WeakPolarHBondContact O-CG 3.37Å; L172-K176 PolarHBondContact O-N 3Å; L172-K176 VanDerWaalsContact O-N 3.12Å; A173-K176 PolarHBondContact O-N 2.72Å; S174-K176 VanDerWaalsContact C-N 3.35Å; S174-K176 PolarHBondContact O-N 3.37Å; K176-Q179 WeakPolarHBondContact O-CB 3.45Å; K176-R180 PolarHBondContact O-N 3.49Å
177	N	95.3	Very high	92.3	Very high	55 Å²	55	63.4 Å²	63.4	29%	0.294	33%	0.329	S	S	.	.	H	α-helix	trans	-64.8	-45.5	175.2	-76.9	-13.6	0	0	0	111.5	A173 S174 R180 I181 L200 Y201	A173-N177 WeakPolarHBondContact O-CB 3.34Å; A173-N177 VanDerWaalsContact O-CG 3.26Å; A173-N177 PolarHBondContact O-N 3.36Å; S174-N177 PolarHBondContact O-N 2.88Å; N177-R180 PolarHBondContact O-N 3.22Å; N177-I181 PolarHBondContact O-N 3.13Å; N177-L200 HydrophobicContact CB-CD1 3.94Å; N177-Y201 WeakPolarHBondContact CB-OH 3.17Å
178	R	96.1	Very high	92.9	Very high	1 Å²	1	58 Å²	58	0%	0.004	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-46.9	175	-66.3	-175	-56.8	92.7	-6.3	111.6	V149 H150 E170 S174 I175 R180 I181 Q182 N453 I456	V149-R178 PolarHBondContact O-NH2 3.48Å; H150-R178 PolarHBondContact O-NH1 3.26Å; E170-R178 VanDerWaalsContact CD-NH2 3.28Å; E170-R178 IonicContact OE1-CZ 3.79Å; E170-R178 IonicContact OE1-NE 2.74Å; E170-R178 PolarHBondContact OE1-NE 3Å; E170-R178 IonicContact OE1-NH2 3.16Å; E170-R178 PolarHBondContact OE1-NH2 3.04Å; E170-R178 VanDerWaalsContact OE1-NH2 3.13Å; E170-R178 IonicContact OE2-CZ 3.28Å; E170-R178 IonicContact OE2-NE 3.58Å; E170-R178 IonicContact OE2-NH2 2.72Å; E170-R178 PolarHBondContact OE2-NH2 2.84Å; S174-R178 WeakPolarHBondContact O-CG 3.44Å; S174-R178 PolarHBondContact O-N 3.47Å; I175-R178 PolarHBondContact O-N 3.42Å; R178-R180 VanDerWaalsContact C-N 3.3Å; R178-R180 PolarHBondContact O-N 3.35Å; R178-I181 PolarHBondContact O-N 2.99Å; R178-I181 VanDerWaalsContact O-N 3.15Å; R178-Q182 VanDerWaalsContact O-CG 3.28Å; R178-Q182 WeakPolarHBondContact O-CG 3.49Å; R178-Q182 PolarHBondContact O-N 3Å; R178-Q182 PolarHBondContact O-OE1 3.03Å; R178-N453 WeakPolarHBondContact CD-OD1 3.37Å; R178-N453 PolarHBondContact NH1-OD1 2.95Å; R178-I456 HydrophobicContact CG-CG2 3.79Å
179	Q	95.2	Very high	93.6	Very high	46 Å²	46	59 Å²	59	22%	0.215	29%	0.294	C	S	.	.	H	α-helix	trans	-51.5	-46	172.8	-78.4	178.4	1.1	0	0	112.8	G152 I175 K176 I181 Q182 K183	G152-Q179 WeakPolarHBondContact O-CG 3.4Å; G152-Q179 PolarHBondContact O-NE2 3.13Å; I175-Q179 WeakPolarHBondContact O-CG 3.3Å; I175-Q179 PolarHBondContact O-N 3.33Å; K176-Q179 WeakPolarHBondContact O-CB 3.45Å; Q179-I181 VanDerWaalsContact C-N 3.35Å; Q179-I181 PolarHBondContact O-N 2.83Å; Q179-Q182 PolarHBondContact O-N 3.5Å; Q179-K183 WeakPolarHBondContact O-CB 3.45Å; Q179-K183 WeakPolarHBondContact O-CG 3.21Å; Q179-K183 PolarHBondContact O-N 2.88Å
180	R	96.7	Very high	94.4	Very high	137 Å²	137	51.3 Å²	51.3	52%	0.517	25%	0.253	S	S	.	.	H	α-helix	trans	-59.9	-46.4	-179.2	-179.5	179.7	171.8	173.2	-2.6	110.8	K176 N177 R178 L184 T196	K176-R180 PolarHBondContact O-N 3.49Å; N177-R180 PolarHBondContact O-N 3.22Å; R178-R180 VanDerWaalsContact C-N 3.3Å; R178-R180 PolarHBondContact O-N 3.35Å; R180-L184 WeakPolarHBondContact O-CG 3.48Å; R180-L184 PolarHBondContact O-N 3.42Å; R180-T196 HydrophobicContact CG-CG2 4.31Å
181	I	97.9	Very high	94.9	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.01	25%	0.25	C	S	.	.	H	α-helix	trans	-64.6	-47.8	177.4	-66.5	166.5	0	0	0	110.7	N177 R178 Q179 K183 L184 V185 T196 L200 Y201 L452 I456	N177-I181 PolarHBondContact O-N 3.13Å; R178-I181 PolarHBondContact O-N 2.99Å; R178-I181 VanDerWaalsContact O-N 3.15Å; Q179-I181 VanDerWaalsContact C-N 3.35Å; Q179-I181 PolarHBondContact O-N 2.83Å; I181-K183 VanDerWaalsContact C-N 3.34Å; I181-K183 PolarHBondContact O-N 3.44Å; I181-L184 WeakPolarHBondContact O-CB 3.4Å; I181-L184 PolarHBondContact O-N 3.47Å; I181-L184 VanDerWaalsContact O-N 3.07Å; I181-V185 PolarHBondContact O-N 3.3Å; I181-T196 HydrophobicContact CG1-CG2 3.79Å; I181-L200 HydrophobicContact CD1-CD1 4.3Å; I181-Y201 HydrophobicContact CD1-CD2 3.94Å; I181-Y201 HydrophobicContact CD1-CE2 3.64Å; I181-L452 HydrophobicContact CG2-CD2 3.47Å; I181-L452 VanDerWaalsContact CG2-CD2 3.47Å; I181-L452 HydrophobicContact CG2-CG 4.18Å; I181-I456 HydrophobicContact CD1-CD1 3.85Å
182	Q	97.2	Very high	95.4	Very high	21 Å²	21	45.6 Å²	45.6	10%	0.098	23%	0.228	C	C	.	.	H	α-helix	trans	-59.8	-42	179.9	-68.2	174	-72.9	0	0	111.9	R178 Q179 L184 V185 L186	R178-Q182 VanDerWaalsContact O-CG 3.28Å; R178-Q182 WeakPolarHBondContact O-CG 3.49Å; R178-Q182 PolarHBondContact O-N 3Å; R178-Q182 PolarHBondContact O-OE1 3.03Å; Q179-Q182 PolarHBondContact O-N 3.5Å; Q182-L184 VanDerWaalsContact C-N 3.32Å; Q182-L184 PolarHBondContact O-N 3.11Å; Q182-V185 PolarHBondContact O-N 2.81Å; Q182-L186 WeakPolarHBondContact O-CB 3.49Å; Q182-L186 VanDerWaalsContact O-CG 3.31Å; Q182-L186 WeakPolarHBondContact O-CG 3.47Å; Q182-L186 PolarHBondContact O-N 2.72Å
183	K	96.6	Very high	96	Very high	148 Å²	148	41.9 Å²	41.9	64%	0.643	21%	0.208	S	C	*	.	H	α-helix	trans	-60.4	-37.4	174	-77.4	-179.8	176.7	-174.9	0	112.7	Q179 I181 A187	Q179-K183 WeakPolarHBondContact O-CB 3.45Å; Q179-K183 WeakPolarHBondContact O-CG 3.21Å; Q179-K183 PolarHBondContact O-N 2.88Å; I181-K183 VanDerWaalsContact C-N 3.34Å; I181-K183 PolarHBondContact O-N 3.44Å; K183-A187 WeakPolarHBondContact O-CB 3.3Å; K183-A187 PolarHBondContact O-N 2.8Å; K183-A187 VanDerWaalsContact O-N 3.11Å
184	L	97.9	Very high	96.4	Very high	11 Å²	11	39.3 Å²	39.3	6%	0.058	19%	0.186	C	C	.	.	H	α-helix	trans	-68.3	-45.5	176.4	-67.4	168	0	0	0	111.5	R180 I181 Q182 A187 G188 R189 E192 A193 T196	R180-L184 WeakPolarHBondContact O-CG 3.48Å; R180-L184 PolarHBondContact O-N 3.42Å; I181-L184 WeakPolarHBondContact O-CB 3.4Å; I181-L184 PolarHBondContact O-N 3.47Å; I181-L184 VanDerWaalsContact O-N 3.07Å; Q182-L184 VanDerWaalsContact C-N 3.32Å; Q182-L184 PolarHBondContact O-N 3.11Å; L184-A187 PolarHBondContact O-N 2.6Å; L184-G188 PolarHBondContact O-N 2.88Å; L184-R189 HydrophobicContact CD2-CB 4.31Å; L184-R189 VanDerWaalsContact CD2-CZ 3.42Å; L184-R189 PolarHBondContact O-N 3.26Å; L184-E192 HydrophobicContact CD1-CB 4.24Å; L184-E192 HydrophobicContact CD2-CB 3.99Å; L184-A193 HydrophobicContact CB-CB 3.7Å; L184-T196 HydrophobicContact CD1-CG2 4.32Å; L184-T196 WeakPolarHBondContact CD1-OG1 3.45Å
185	V	98.2	Very high	96.7	Very high	1 Å²	1	44 Å²	44	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-50.1	177.2	176.5	0	0	0	0	111.5	I181 Q182 A187 G188 M190 A193 R445 C449 L452	I181-V185 PolarHBondContact O-N 3.3Å; Q182-V185 PolarHBondContact O-N 2.81Å; V185-A187 VanDerWaalsContact C-N 3.29Å; V185-A187 PolarHBondContact O-N 2.89Å; V185-G188 PolarHBondContact O-N 3.41Å; V185-M190 HydrophobicContact CB-SD 4.22Å; V185-M190 HydrophobicContact CG1-CE 4.26Å; V185-M190 HydrophobicContact CG1-SD 3.82Å; V185-M190 HydrophobicContact CG2-CE 4.26Å; V185-M190 HydrophobicContact CG2-SD 4.26Å; V185-A193 HydrophobicContact CG2-CB 3.66Å; V185-R445 WeakPolarHBondContact O-CD 3.49Å; V185-C449 HydrophobicContact CB-CB 4.26Å; V185-C449 HydrophobicContact CG1-CB 3.66Å; V185-L452 HydrophobicContact CG2-CD2 4.16Å
186	L	96.6	Very high	97	Very high	83 Å²	83	44.4 Å²	44.4	44%	0.435	21%	0.209	S	C	.	.	H	α-helix	trans	-66.5	-30.1	-178.5	-65.5	172.9	0	0	0	112.5	Q182 G188 R445 E446 C449	Q182-L186 WeakPolarHBondContact O-CB 3.49Å; Q182-L186 VanDerWaalsContact O-CG 3.31Å; Q182-L186 WeakPolarHBondContact O-CG 3.47Å; Q182-L186 PolarHBondContact O-N 2.72Å; L186-G188 PolarHBondContact O-N 3.13Å; L186-R445 HydrophobicContact CD2-CB 4.35Å; L186-R445 WeakPolarHBondContact O-CD 3.31Å; L186-R445 PolarHBondContact O-NH1 2.91Å; L186-E446 HydrophobicContact CD2-CG 4.22Å; L186-C449 HydrophobicContact CD2-CB 4.11Å; L186-C449 HydrophobicContact CG-CB 4.47Å
187	A	96.3	Very high	97.2	Very high	47 Å²	47	38.9 Å²	38.9	39%	0.388	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-5.4	171	0	0	0	0	0	114.2	K183 L184 V185 R189	K183-A187 WeakPolarHBondContact O-CB 3.3Å; K183-A187 PolarHBondContact O-N 2.8Å; K183-A187 VanDerWaalsContact O-N 3.11Å; L184-A187 PolarHBondContact O-N 2.6Å; V185-A187 VanDerWaalsContact C-N 3.29Å; V185-A187 PolarHBondContact O-N 2.89Å; A187-R189 VanDerWaalsContact C-N 3.32Å; A187-R189 HydrophobicContact CB-CG 4.41Å
188	G	96.7	Very high	97.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	16.7	-176.4	0	0	0	0	0	114.4	L184 V185 L186 M190 E222	L184-G188 PolarHBondContact O-N 2.88Å; V185-G188 PolarHBondContact O-N 3.41Å; L186-G188 PolarHBondContact O-N 3.13Å; G188-M190 VanDerWaalsContact C-N 3.35Å; G188-M190 PolarHBondContact O-N 2.78Å; G188-E222 WeakPolarHBondContact O-CB 3.22Å
189	R	97.1	Very high	97.4	Very high	77 Å²	77	47.5 Å²	47.5	29%	0.291	22%	0.223	S	C	.	.			trans	-94.7	65.9	177.2	-63.4	-170.6	-73	157.8	-14.8	109.7	L184 A187 E192 A193	L184-R189 HydrophobicContact CD2-CB 4.31Å; L184-R189 VanDerWaalsContact CD2-CZ 3.42Å; L184-R189 PolarHBondContact O-N 3.26Å; A187-R189 VanDerWaalsContact C-N 3.32Å; A187-R189 HydrophobicContact CB-CG 4.41Å; R189-E192 HydrophobicContact CB-CB 4.35Å; R189-E192 WeakPolarHBondContact CD-OE1 3.29Å; R189-E192 IonicContact CZ-OE2 3.6Å; R189-E192 IonicContact NE-OE2 3.97Å; R189-E192 IonicContact NH1-OE1 3.72Å; R189-E192 IonicContact NH1-OE2 2.68Å; R189-E192 PolarHBondContact NH1-OE2 3.08Å; R189-A193 WeakPolarHBondContact O-CB 3.43Å; R189-A193 PolarHBondContact O-N 3.39Å
190	M	97.9	Very high	97.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68.8	-35.3	-172	-64.3	-57	-54	0	0	112.8	V185 G188 A193 I194 L215 R218 Q219 E222 D228 V448	V185-M190 HydrophobicContact CB-SD 4.22Å; V185-M190 HydrophobicContact CG1-CE 4.26Å; V185-M190 HydrophobicContact CG1-SD 3.82Å; V185-M190 HydrophobicContact CG2-CE 4.26Å; V185-M190 HydrophobicContact CG2-SD 4.26Å; G188-M190 VanDerWaalsContact C-N 3.35Å; G188-M190 PolarHBondContact O-N 2.78Å; M190-A193 PolarHBondContact O-N 3.26Å; M190-I194 WeakPolarHBondContact O-CD1 3.46Å; M190-I194 VanDerWaalsContact O-CG1 3.23Å; M190-I194 WeakPolarHBondContact O-CG1 3.46Å; M190-I194 PolarHBondContact O-N 3.47Å; M190-L215 HydrophobicContact CE-CB 4.39Å; M190-L215 HydrophobicContact CE-CD2 3.54Å; M190-R218 HydrophobicContact CE-CB 4.09Å; M190-R218 HydrophobicContact CE-CG 4.02Å; M190-R218 HydrophobicContact CG-CB 4.49Å; M190-R218 HydrophobicContact CG-CG 4.04Å; M190-R218 HydrophobicContact SD-CB 4.48Å; M190-R218 HydrophobicContact SD-CG 3.82Å; M190-Q219 HydrophobicContact CB-CB 3.57Å; M190-Q219 HydrophobicContact CB-CG 3.89Å; M190-Q219 HydrophobicContact CG-CB 4.36Å; M190-E222 HydrophobicContact CG-CB 4.42Å; M190-E222 HydrophobicContact CG-CG 3.76Å; M190-D228 PolarHBondContact N-OD2 2.86Å; M190-V448 HydrophobicContact CE-CG1 4.14Å
191	G	96.9	Very high	97.4	Very high	4 Å²	4	41.9 Å²	41.9	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-57.5	-56.4	173.6	0	0	0	0	0	111.8	A193 I194 E195 D228	G191-A193 VanDerWaalsContact C-N 3.27Å; G191-A193 PolarHBondContact O-N 2.86Å; G191-I194 PolarHBondContact O-N 2.98Å; G191-I194 VanDerWaalsContact O-N 3.16Å; G191-E195 PolarHBondContact O-N 3.36Å; G191-D228 PolarHBondContact N-OD2 3.07Å
192	E	97.8	Very high	97.3	Very high	48 Å²	48	46.3 Å²	46.3	22%	0.224	23%	0.233	C	C	.	.	H	α-helix	trans	-58.6	-36.8	176.4	-65.9	174.4	-132.8	0	0	112.3	L184 R189 T196 S229 R232	L184-E192 HydrophobicContact CD1-CB 4.24Å; L184-E192 HydrophobicContact CD2-CB 3.99Å; R189-E192 HydrophobicContact CB-CB 4.35Å; R189-E192 WeakPolarHBondContact CD-OE1 3.29Å; R189-E192 IonicContact CZ-OE2 3.6Å; R189-E192 IonicContact NE-OE2 3.97Å; R189-E192 IonicContact NH1-OE1 3.72Å; R189-E192 IonicContact NH1-OE2 2.68Å; R189-E192 PolarHBondContact NH1-OE2 3.08Å; E192-T196 WeakPolarHBondContact O-CB 3.44Å; E192-T196 PolarHBondContact O-N 3Å; E192-T196 PolarHBondContact O-OG1 3.21Å; E192-S229 VanDerWaalsContact OE1-CB 3.32Å; E192-S229 WeakPolarHBondContact OE1-CB 3.36Å; E192-R232 IonicContact OE1-NH2 3.66Å
193	A	98.5	Very high	97.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.5	-42.1	177	0	0	0	0	0	112.6	L184 V185 R189 M190 G191 T197	L184-A193 HydrophobicContact CB-CB 3.7Å; V185-A193 HydrophobicContact CG2-CB 3.66Å; R189-A193 WeakPolarHBondContact O-CB 3.43Å; R189-A193 PolarHBondContact O-N 3.39Å; M190-A193 PolarHBondContact O-N 3.26Å; G191-A193 VanDerWaalsContact C-N 3.27Å; G191-A193 PolarHBondContact O-N 2.86Å; A193-T197 WeakPolarHBondContact O-CB 3.38Å; A193-T197 PolarHBondContact O-N 3.46Å; A193-T197 PolarHBondContact O-OG1 3.49Å
194	I	98.2	Very high	97.2	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-66.3	-48	178.1	-69.8	164.5	0	0	0	110	M190 G191 T197 Q198 L205 L212 L215 K216	M190-I194 WeakPolarHBondContact O-CD1 3.46Å; M190-I194 VanDerWaalsContact O-CG1 3.23Å; M190-I194 WeakPolarHBondContact O-CG1 3.46Å; M190-I194 PolarHBondContact O-N 3.47Å; G191-I194 PolarHBondContact O-N 2.98Å; G191-I194 VanDerWaalsContact O-N 3.16Å; I194-T197 WeakPolarHBondContact O-CB 3.49Å; I194-T197 PolarHBondContact O-N 2.99Å; I194-Q198 WeakPolarHBondContact O-CG 3.42Å; I194-Q198 PolarHBondContact O-N 3.25Å; I194-L205 HydrophobicContact CG2-CD1 3.92Å; I194-L212 HydrophobicContact CG2-CD1 4.41Å; I194-L215 HydrophobicContact CD1-CB 3.94Å; I194-L215 HydrophobicContact CG1-CB 4.05Å; I194-L215 HydrophobicContact CG1-CD1 4.45Å; I194-K216 HydrophobicContact CD1-CD 3.89Å; I194-K216 HydrophobicContact CD1-CG 4.29Å
195	E	97.8	Very high	97.2	Very high	120 Å²	120	39.9 Å²	39.9	56%	0.561	21%	0.209	S	C	*	.	H	α-helix	trans	-59.9	-48.3	177	-70.5	176.4	179	0	0	111.8	G191 T197 Q198 Q199	G191-E195 PolarHBondContact O-N 3.36Å; E195-T197 VanDerWaalsContact C-N 3.26Å; E195-T197 PolarHBondContact O-N 3.12Å; E195-Q198 PolarHBondContact O-N 3.41Å; E195-Q198 VanDerWaalsContact O-N 3.15Å; E195-Q199 WeakPolarHBondContact O-CB 3.5Å; E195-Q199 PolarHBondContact O-N 3.45Å
196	T	98.2	Very high	97	Very high	11 Å²	11	46.8 Å²	46.8	7%	0.067	24%	0.241	C	C	.	.	H	α-helix	trans	-60.3	-37.7	177	-58.4	0	0	0	0	111.2	R180 I181 L184 E192 L200	R180-T196 HydrophobicContact CG-CG2 4.31Å; I181-T196 HydrophobicContact CG1-CG2 3.79Å; L184-T196 HydrophobicContact CD1-CG2 4.32Å; L184-T196 WeakPolarHBondContact CD1-OG1 3.45Å; E192-T196 WeakPolarHBondContact O-CB 3.44Å; E192-T196 PolarHBondContact O-N 3Å; E192-T196 PolarHBondContact O-OG1 3.21Å; T196-L200 HydrophobicContact CG2-CD1 3.67Å; T196-L200 HydrophobicContact CG2-CG 4.32Å; T196-L200 WeakPolarHBondContact O-CB 3.42Å; T196-L200 VanDerWaalsContact O-CG 3.31Å; T196-L200 WeakPolarHBondContact O-CG 3.43Å; T196-L200 PolarHBondContact O-N 3.28Å
197	T	98.2	Very high	96.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.8	-45.5	174.9	-59.1	0	0	0	0	111.5	A193 I194 E195 Q199 L200 Y201 L204 L205 L452	A193-T197 WeakPolarHBondContact O-CB 3.38Å; A193-T197 PolarHBondContact O-N 3.46Å; A193-T197 PolarHBondContact O-OG1 3.49Å; I194-T197 WeakPolarHBondContact O-CB 3.49Å; I194-T197 PolarHBondContact O-N 2.99Å; E195-T197 VanDerWaalsContact C-N 3.26Å; E195-T197 PolarHBondContact O-N 3.12Å; T197-Q199 VanDerWaalsContact C-N 3.33Å; T197-Q199 PolarHBondContact O-N 2.94Å; T197-L200 PolarHBondContact O-N 3.04Å; T197-Y201 CarbonylContact O-C 3.58Å; T197-Y201 WeakPolarHBondContact O-CA 3.47Å; T197-Y201 WeakPolarHBondContact O-CB 3.49Å; T197-Y201 PolarHBondContact O-N 3.43Å; T197-L204 HydrophobicContact CG2-CD2 4.21Å; T197-L205 HydrophobicContact CG2-CD1 4.07Å; T197-L205 HydrophobicContact CG2-CD2 4.28Å; T197-L205 HydrophobicContact CG2-CG 4.01Å; T197-L452 HydrophobicContact CG2-CD1 3.88Å
198	Q	97.5	Very high	96.9	Very high	93 Å²	93	52 Å²	52	44%	0.435	25%	0.249	S	C	.	.	H	α-helix	trans	-66.1	-35.8	179.3	-69.3	173.6	-55.3	0	0	112.2	I194 E195 L205	I194-Q198 WeakPolarHBondContact O-CG 3.42Å; I194-Q198 PolarHBondContact O-N 3.25Å; E195-Q198 PolarHBondContact O-N 3.41Å; E195-Q198 VanDerWaalsContact O-N 3.15Å; Q198-L205 HydrophobicContact CG-CD1 3.86Å
199	Q	97.6	Very high	96.8	Very high	144 Å²	144	54.5 Å²	54.5	67%	0.673	27%	0.265	S	S	*	.	H	α-helix	trans	-68.6	-45.2	176.7	-173.2	-177.9	12.9	0	0	112.4	E195 T197	E195-Q199 WeakPolarHBondContact O-CB 3.5Å; E195-Q199 PolarHBondContact O-N 3.45Å; T197-Q199 VanDerWaalsContact C-N 3.33Å; T197-Q199 PolarHBondContact O-N 2.94Å
200	L	96.8	Very high	96.7	Very high	49 Å²	49	53.6 Å²	53.6	26%	0.257	27%	0.266	S	S	.	.	H	α-helix	trans	-84.3	-28.8	-175.8	-64	175.8	0	0	0	113	N177 I181 T196 T197	N177-L200 HydrophobicContact CB-CD1 3.94Å; I181-L200 HydrophobicContact CD1-CD1 4.3Å; T196-L200 HydrophobicContact CG2-CD1 3.67Å; T196-L200 HydrophobicContact CG2-CG 4.32Å; T196-L200 WeakPolarHBondContact O-CB 3.42Å; T196-L200 VanDerWaalsContact O-CG 3.31Å; T196-L200 WeakPolarHBondContact O-CG 3.43Å; T196-L200 PolarHBondContact O-N 3.28Å; T197-L200 PolarHBondContact O-N 3.04Å
201	Y	96.3	Very high	96.6	Very high	16 Å²	16	54.6 Å²	54.6	6%	0.063	27%	0.271	C	S	.	.	S	Bend	trans	-132.3	72.4	-177.1	-54.4	-69.3	0	0	0	111.5	N177 I181 T197 L204 I456 H460	N177-Y201 WeakPolarHBondContact CB-OH 3.17Å; I181-Y201 HydrophobicContact CD1-CD2 3.94Å; I181-Y201 HydrophobicContact CD1-CE2 3.64Å; T197-Y201 CarbonylContact O-C 3.58Å; T197-Y201 WeakPolarHBondContact O-CA 3.47Å; T197-Y201 WeakPolarHBondContact O-CB 3.49Å; T197-Y201 PolarHBondContact O-N 3.43Å; Y201-L204 HydrophobicContact CG-CD1 4.24Å; Y201-L204 VanDerWaalsContact O-CB 3.24Å; Y201-L204 WeakPolarHBondContact O-CB 3.24Å; Y201-L204 PolarHBondContact O-N 3.13Å; Y201-L204 VanDerWaalsContact O-N 3.17Å; Y201-I456 HydrophobicContact CD1-CG2 4.19Å; Y201-I456 HydrophobicContact CD2-CD1 4.13Å; Y201-I456 HydrophobicContact CD2-CG1 3.99Å; Y201-I456 HydrophobicContact CD2-CG2 4.05Å; Y201-I456 HydrophobicContact CE1-CG2 3.71Å; Y201-I456 HydrophobicContact CE2-CD1 3.95Å; Y201-I456 HydrophobicContact CE2-CG1 4.09Å; Y201-I456 HydrophobicContact CE2-CG2 3.57Å; Y201-I456 HydrophobicContact CG-CG2 4.33Å; Y201-H460 AromaticContact CD1-CE1 3.52Å; Y201-H460 AromaticContact CE1-CE1 3.43Å; Y201-H460 VanDerWaalsContact CE1-CE1 3.43Å; Y201-H460 WeakPolarHBondContact CE1-CE1 3.49Å; Y201-H460 AromaticContact CE1-NE2 3.96Å
202	P	95.7	Very high	96.7	Very high	96 Å²	96	55.9 Å²	55.9	62%	0.623	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	143.2	178.9	-26.6	35.4	0	0	0	112.7	L204	P202-L204 PolarHBondContact O-N 2.96Å; P202-L204 VanDerWaalsContact O-N 3.13Å
203	S	94.1	Very high	96.6	Very high	38 Å²	38	53.6 Å²	53.6	27%	0.266	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	-5.2	-174.1	78.5	0	0	0	0	117.9	L205 E206 R207	S203-L205 PolarHBondContact O-N 2.81Å; S203-E206 WeakPolarHBondContact CA-OE2 3.39Å; S203-E206 WeakPolarHBondContact CB-OE2 3.26Å; S203-E206 PolarHBondContact O-N 3.27Å; S203-R207 WeakPolarHBondContact O-CB 3.45Å; S203-R207 VanDerWaalsContact O-CG 3.29Å; S203-R207 WeakPolarHBondContact O-CG 3.34Å; S203-R207 PolarHBondContact O-N 2.86Å; S203-R207 PolarHBondContact OG-NE 3.17Å
204	L	97	Very high	96.6	Very high	3 Å²	3	55 Å²	55	2%	0.016	27%	0.274	C	S	.	.	H	α-helix	trans	-59	-49.6	-178.7	-177.4	155.6	0	0	0	112.2	T197 Y201 P202 N208 L211 L452 A455 I456 T459	T197-L204 HydrophobicContact CG2-CD2 4.21Å; Y201-L204 HydrophobicContact CG-CD1 4.24Å; Y201-L204 VanDerWaalsContact O-CB 3.24Å; Y201-L204 WeakPolarHBondContact O-CB 3.24Å; Y201-L204 PolarHBondContact O-N 3.13Å; Y201-L204 VanDerWaalsContact O-N 3.17Å; P202-L204 PolarHBondContact O-N 2.96Å; P202-L204 VanDerWaalsContact O-N 3.13Å; L204-N208 WeakPolarHBondContact O-CB 3.36Å; L204-N208 PolarHBondContact O-N 3.32Å; L204-N208 PolarHBondContact O-ND2 3.29Å; L204-L211 HydrophobicContact CD2-CD2 4.26Å; L204-L452 HydrophobicContact CD2-CD1 4.3Å; L204-A455 HydrophobicContact CD2-CB 4.46Å; L204-I456 HydrophobicContact CD1-CB 4.17Å; L204-I456 HydrophobicContact CD1-CG1 3.58Å; L204-T459 HydrophobicContact CD1-CG2 3.96Å; L204-T459 HydrophobicContact CG-CG2 4.03Å
205	L	97	Very high	96.6	Very high	4 Å²	4	54.8 Å²	54.8	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-75.4	-28.5	-179.6	-64.6	-177.9	0	0	0	112.8	I194 T197 Q198 S203 N208 L211 L212 L215 L452	I194-L205 HydrophobicContact CG2-CD1 3.92Å; T197-L205 HydrophobicContact CG2-CD1 4.07Å; T197-L205 HydrophobicContact CG2-CD2 4.28Å; T197-L205 HydrophobicContact CG2-CG 4.01Å; Q198-L205 HydrophobicContact CG-CD1 3.86Å; S203-L205 PolarHBondContact O-N 2.81Å; L205-N208 CarbonylContact O-C 3.57Å; L205-N208 VanDerWaalsContact O-C 3.32Å; L205-N208 PolarHBondContact O-N 3.17Å; L205-L211 HydrophobicContact CD2-CD2 4.2Å; L205-L211 HydrophobicContact CD2-CG 4.32Å; L205-L212 HydrophobicContact CB-CB 4.27Å; L205-L212 HydrophobicContact CB-CD1 4.28Å; L205-L212 HydrophobicContact CD1-CD1 4.03Å; L205-L215 HydrophobicContact CD1-CD1 4.35Å; L205-L215 HydrophobicContact CD2-CD1 3.54Å; L205-L452 HydrophobicContact CD2-CD1 4.42Å
206	E	94.2	Very high	96.6	Very high	146 Å²	146	51.3 Å²	51.3	68%	0.682	26%	0.256	S	S	*	.	H	α-helix	trans	-66.2	-41.2	174.6	-62.1	170.5	175.9	0	0	111.3	S203 N208	S203-E206 WeakPolarHBondContact CA-OE2 3.39Å; S203-E206 WeakPolarHBondContact CB-OE2 3.26Å; S203-E206 PolarHBondContact O-N 3.27Å; E206-N208 VanDerWaalsContact C-N 3.28Å; E206-N208 PolarHBondContact O-N 3.39Å
207	R	95	Very high	96.6	Very high	188 Å²	188	50.8 Å²	50.8	71%	0.709	25%	0.253	S	S	*	.	H	α-helix	trans	-74	-16.9	175.8	-67.8	174.4	-175.6	-169	3.4	113.4	S203 P209	S203-R207 WeakPolarHBondContact O-CB 3.45Å; S203-R207 VanDerWaalsContact O-CG 3.29Å; S203-R207 WeakPolarHBondContact O-CG 3.34Å; S203-R207 PolarHBondContact O-N 2.86Å; S203-R207 PolarHBondContact OG-NE 3.17Å; R207-P209 VanDerWaalsContact C-CD 3.46Å; R207-P209 WeakPolarHBondContact O-CD 3.31Å
208	N	95.8	Very high	96.6	Very high	52 Å²	52	51.3 Å²	51.3	28%	0.278	26%	0.255	S	S	.	.			trans	-124.1	65.2	-177	-67.8	-81.5	0	0	0	111.4	L204 L205 E206 N210 L211 L212	L204-N208 WeakPolarHBondContact O-CB 3.36Å; L204-N208 PolarHBondContact O-N 3.32Å; L204-N208 PolarHBondContact O-ND2 3.29Å; L205-N208 CarbonylContact O-C 3.57Å; L205-N208 VanDerWaalsContact O-C 3.32Å; L205-N208 PolarHBondContact O-N 3.17Å; E206-N208 VanDerWaalsContact C-N 3.28Å; E206-N208 PolarHBondContact O-N 3.39Å; N208-N210 VanDerWaalsContact C-N 3.28Å; N208-N210 PolarHBondContact O-N 2.96Å; N208-L211 HydrophobicContact CB-CB 3.91Å; N208-L211 HydrophobicContact CB-CD2 4.34Å; N208-L211 WeakPolarHBondContact O-CB 3.31Å; N208-L211 PolarHBondContact O-N 3.02Å; N208-L212 PolarHBondContact O-N 2.64Å
209	P	95.2	Very high	96.6	Very high	51 Å²	51	46.9 Å²	46.9	33%	0.331	24%	0.235	S	C	.	.	H	α-helix	trans	-66.6	-26.7	-170.3	29.1	-37.7	0	0	0	113.4	R207 F213 L405	R207-P209 VanDerWaalsContact C-CD 3.46Å; R207-P209 WeakPolarHBondContact O-CD 3.31Å; P209-F213 WeakPolarHBondContact O-CB 3.39Å; P209-F213 PolarHBondContact O-N 3Å; P209-L405 HydrophobicContact CB-CD2 3.96Å; P209-L405 HydrophobicContact CG-CD2 4.19Å
210	N	95	Very high	96.6	Very high	59 Å²	59	40 Å²	40	32%	0.316	20%	0.203	S	C	.	.	H	α-helix	trans	-69.4	-33.3	171.2	-73.4	-71.3	0	0	0	113	N208 T214 N412 N415	N208-N210 VanDerWaalsContact C-N 3.28Å; N208-N210 PolarHBondContact O-N 2.96Å; N210-T214 WeakPolarHBondContact O-CB 3.19Å; N210-T214 PolarHBondContact O-N 2.93Å; N210-T214 PolarHBondContact O-OG1 3.46Å; N210-N412 PolarHBondContact OD1-ND2 3.25Å; N210-N415 PolarHBondContact OD1-ND2 3.21Å
211	L	96.7	Very high	96.6	Very high	20 Å²	20	38 Å²	38	11%	0.105	19%	0.192	C	C	.	.	H	α-helix	trans	-70.6	-45.3	173.5	176	63.3	0	0	0	110.3	L204 L205 N208 F213 T214 L215 A451 L452 A455	L204-L211 HydrophobicContact CD2-CD2 4.26Å; L205-L211 HydrophobicContact CD2-CD2 4.2Å; L205-L211 HydrophobicContact CD2-CG 4.32Å; N208-L211 HydrophobicContact CB-CB 3.91Å; N208-L211 HydrophobicContact CB-CD2 4.34Å; N208-L211 WeakPolarHBondContact O-CB 3.31Å; N208-L211 PolarHBondContact O-N 3.02Å; L211-F213 VanDerWaalsContact C-N 3.29Å; L211-F213 PolarHBondContact O-N 3.22Å; L211-T214 WeakPolarHBondContact O-CB 3.39Å; L211-T214 PolarHBondContact O-N 3.3Å; L211-T214 VanDerWaalsContact O-N 3.17Å; L211-L215 HydrophobicContact CD1-CD1 4.33Å; L211-L215 HydrophobicContact CD1-CG 4.36Å; L211-L215 HydrophobicContact CG-CD1 4.03Å; L211-L215 WeakPolarHBondContact O-CG 3.2Å; L211-L215 PolarHBondContact O-N 3.25Å; L211-A451 HydrophobicContact CD1-CB 4.11Å; L211-L452 HydrophobicContact CD2-CD1 4.16Å; L211-A455 HydrophobicContact CD2-CB 3.48Å; L211-A455 VanDerWaalsContact CD2-CB 3.48Å
212	L	97.5	Very high	96.6	Very high	31 Å²	31	37.2 Å²	37.2	16%	0.162	19%	0.189	C	C	.	.	H	α-helix	trans	-56.7	-44.2	173.9	177.1	58.7	0	0	0	111.5	I194 L205 N208 L215 K216 M401	I194-L212 HydrophobicContact CG2-CD1 4.41Å; L205-L212 HydrophobicContact CB-CB 4.27Å; L205-L212 HydrophobicContact CB-CD1 4.28Å; L205-L212 HydrophobicContact CD1-CD1 4.03Å; N208-L212 PolarHBondContact O-N 2.64Å; L212-L215 PolarHBondContact O-N 3.04Å; L212-K216 HydrophobicContact CD1-CG 4.12Å; L212-K216 WeakPolarHBondContact O-CB 3.08Å; L212-K216 VanDerWaalsContact O-CG 3.32Å; L212-K216 WeakPolarHBondContact O-CG 3.4Å; L212-K216 PolarHBondContact O-N 2.93Å; L212-M401 HydrophobicContact CD2-CE 4.44Å; L212-M401 HydrophobicContact CG-CE 4.48Å
213	F	97.3	Very high	96.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.5	-47.5	174.4	-178	-101.6	0	0	0	112.1	P209 L211 L215 K216 V217 L398 M401 L405 N415 L419	P209-F213 WeakPolarHBondContact O-CB 3.39Å; P209-F213 PolarHBondContact O-N 3Å; L211-F213 VanDerWaalsContact C-N 3.29Å; L211-F213 PolarHBondContact O-N 3.22Å; F213-L215 VanDerWaalsContact C-N 3.32Å; F213-L215 PolarHBondContact O-N 3.42Å; F213-K216 CarbonylContact O-C 3.57Å; F213-K216 PolarHBondContact O-N 3.36Å; F213-K216 VanDerWaalsContact O-N 3.1Å; F213-V217 HydrophobicContact CD1-CG2 4.01Å; F213-V217 HydrophobicContact CE1-CG2 3.6Å; F213-V217 HydrophobicContact CE2-CG2 4.16Å; F213-V217 HydrophobicContact CG-CG2 4.46Å; F213-V217 HydrophobicContact CZ-CG2 3.69Å; F213-V217 WeakPolarHBondContact O-CG2 3.25Å; F213-V217 PolarHBondContact O-N 3.46Å; F213-L398 HydrophobicContact CD2-CD1 3.89Å; F213-L398 HydrophobicContact CE2-CD1 3.67Å; F213-L398 HydrophobicContact CE2-CG 4.26Å; F213-L398 HydrophobicContact CZ-CD1 4.48Å; F213-M401 HydrophobicContact CB-SD 4.28Å; F213-M401 HydrophobicContact CD2-CB 4.45Å; F213-M401 HydrophobicContact CD2-CG 3.98Å; F213-M401 HydrophobicContact CD2-SD 3.95Å; F213-L405 HydrophobicContact CB-CD1 3.48Å; F213-L405 VanDerWaalsContact CB-CD1 3.48Å; F213-L405 HydrophobicContact CD1-CD1 4.48Å; F213-L405 HydrophobicContact CD2-CD1 3.89Å; F213-L405 HydrophobicContact CG-CD1 3.7Å; F213-N415 HydrophobicContact CD1-CB 4.01Å; F213-N415 HydrophobicContact CE1-CB 3.58Å; F213-N415 HydrophobicContact CZ-CB 4.4Å; F213-L419 HydrophobicContact CZ-CB 4.2Å; F213-L419 HydrophobicContact CZ-CD1 4.13Å; F213-L419 HydrophobicContact CZ-CD2 4.32Å; F213-L419 HydrophobicContact CZ-CG 4.47Å
214	T	97.6	Very high	96.5	Very high	29 Å²	29	31 Å²	31	18%	0.178	15%	0.148	C	C	.	.	H	α-helix	trans	-57.4	-44.4	176.6	-58	0	0	0	0	111.9	N210 L211 K216 V217 R218 M418 V448	N210-T214 WeakPolarHBondContact O-CB 3.19Å; N210-T214 PolarHBondContact O-N 2.93Å; N210-T214 PolarHBondContact O-OG1 3.46Å; L211-T214 WeakPolarHBondContact O-CB 3.39Å; L211-T214 PolarHBondContact O-N 3.3Å; L211-T214 VanDerWaalsContact O-N 3.17Å; T214-K216 VanDerWaalsContact C-N 3.35Å; T214-K216 PolarHBondContact O-N 2.86Å; T214-V217 PolarHBondContact O-N 3.09Å; T214-R218 PolarHBondContact O-N 3.09Å; T214-M418 HydrophobicContact CG2-CE 3.89Å; T214-M418 HydrophobicContact CG2-SD 4.11Å; T214-V448 HydrophobicContact CG2-CG1 4.45Å; T214-V448 HydrophobicContact CG2-CG2 4.1Å
215	L	98.3	Very high	96.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.6	-40	175.4	-70.2	164.9	0	0	0	112	M190 I194 L205 L211 L212 F213 R218 Q219 V448 L452	M190-L215 HydrophobicContact CE-CB 4.39Å; M190-L215 HydrophobicContact CE-CD2 3.54Å; I194-L215 HydrophobicContact CD1-CB 3.94Å; I194-L215 HydrophobicContact CG1-CB 4.05Å; I194-L215 HydrophobicContact CG1-CD1 4.45Å; L205-L215 HydrophobicContact CD1-CD1 4.35Å; L205-L215 HydrophobicContact CD2-CD1 3.54Å; L211-L215 HydrophobicContact CD1-CD1 4.33Å; L211-L215 HydrophobicContact CD1-CG 4.36Å; L211-L215 HydrophobicContact CG-CD1 4.03Å; L211-L215 WeakPolarHBondContact O-CG 3.2Å; L211-L215 PolarHBondContact O-N 3.25Å; L212-L215 PolarHBondContact O-N 3.04Å; F213-L215 VanDerWaalsContact C-N 3.32Å; F213-L215 PolarHBondContact O-N 3.42Å; L215-R218 PolarHBondContact O-N 3.15Å; L215-Q219 WeakPolarHBondContact O-CB 3.32Å; L215-Q219 PolarHBondContact O-N 3.38Å; L215-V448 HydrophobicContact CD2-CG1 3.52Å; L215-V448 HydrophobicContact CG-CG1 4.33Å; L215-L452 HydrophobicContact CD1-CD1 4.3Å; L215-L452 HydrophobicContact CD1-CD2 4.32Å; L215-L452 HydrophobicContact CD2-CB 4.48Å; L215-L452 HydrophobicContact CD2-CD2 3.93Å
216	K	98.1	Very high	96	Very high	47 Å²	47	33.2 Å²	33.2	20%	0.204	16%	0.164	C	C	.	.	H	α-helix	trans	-72.7	-35.7	177.9	-71.2	-71.9	178.8	-170.7	0	112.7	I194 L212 F213 T214 Q219 F220 F394 L398 M401	I194-K216 HydrophobicContact CD1-CD 3.89Å; I194-K216 HydrophobicContact CD1-CG 4.29Å; L212-K216 HydrophobicContact CD1-CG 4.12Å; L212-K216 WeakPolarHBondContact O-CB 3.08Å; L212-K216 VanDerWaalsContact O-CG 3.32Å; L212-K216 WeakPolarHBondContact O-CG 3.4Å; L212-K216 PolarHBondContact O-N 2.93Å; F213-K216 CarbonylContact O-C 3.57Å; F213-K216 PolarHBondContact O-N 3.36Å; F213-K216 VanDerWaalsContact O-N 3.1Å; T214-K216 VanDerWaalsContact C-N 3.35Å; T214-K216 PolarHBondContact O-N 2.86Å; K216-Q219 WeakPolarHBondContact O-CB 3.37Å; K216-Q219 PolarHBondContact O-N 2.93Å; K216-F220 PolarHBondContact O-N 3.1Å; K216-F394 HydrophobicContact CB-CZ 4.25Å; K216-F394 HydrophobicContact CD-CE2 3.99Å; K216-F394 HydrophobicContact CD-CZ 3.5Å; K216-F394 VanDerWaalsContact O-CE1 3.3Å; K216-F394 WeakPolarHBondContact O-CE1 3.48Å; K216-L398 HydrophobicContact CB-CD1 3.78Å; K216-M401 HydrophobicContact CG-CE 4.38Å; K216-M401 HydrophobicContact CG-SD 4.46Å
217	V	98.1	Very high	95.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.5	-44.5	170	-178.6	0	0	0	0	110.4	F213 T214 Q219 F220 I221 L398 M418 L419 A422	F213-V217 HydrophobicContact CD1-CG2 4.01Å; F213-V217 HydrophobicContact CE1-CG2 3.6Å; F213-V217 HydrophobicContact CE2-CG2 4.16Å; F213-V217 HydrophobicContact CG-CG2 4.46Å; F213-V217 HydrophobicContact CZ-CG2 3.69Å; F213-V217 WeakPolarHBondContact O-CG2 3.25Å; F213-V217 PolarHBondContact O-N 3.46Å; T214-V217 PolarHBondContact O-N 3.09Å; V217-Q219 VanDerWaalsContact C-N 3.34Å; V217-Q219 PolarHBondContact O-N 3.07Å; V217-F220 WeakPolarHBondContact O-CB 3.42Å; V217-F220 PolarHBondContact O-N 3.1Å; V217-I221 HydrophobicContact CG1-CD1 4.25Å; V217-I221 WeakPolarHBondContact O-CG1 3.34Å; V217-I221 PolarHBondContact O-N 3.1Å; V217-I221 VanDerWaalsContact O-N 3.1Å; V217-L398 HydrophobicContact CB-CD2 4.39Å; V217-L398 HydrophobicContact CG2-CD1 3.96Å; V217-L398 HydrophobicContact CG2-CD2 4.02Å; V217-L398 HydrophobicContact CG2-CG 4.37Å; V217-M418 HydrophobicContact CB-CG 4.33Å; V217-M418 HydrophobicContact CB-SD 3.76Å; V217-M418 HydrophobicContact CG1-CG 3.78Å; V217-M418 HydrophobicContact CG1-SD 3.89Å; V217-M418 HydrophobicContact CG2-SD 3.99Å; V217-L419 HydrophobicContact CG2-CD1 4.39Å; V217-A422 HydrophobicContact CG1-CB 3.65Å
218	R	97.9	Very high	95.7	Very high	11 Å²	11	19.2 Å²	19.2	4%	0.042	11%	0.109	C	C	.	.	H	α-helix	trans	-60.6	-42.1	174.1	-170.9	67.2	-116.2	164.4	-8.1	111.7	M190 T214 L215 F220 I221 E222 Q439 V448	M190-R218 HydrophobicContact CE-CB 4.09Å; M190-R218 HydrophobicContact CE-CG 4.02Å; M190-R218 HydrophobicContact CG-CB 4.49Å; M190-R218 HydrophobicContact CG-CG 4.04Å; M190-R218 HydrophobicContact SD-CB 4.48Å; M190-R218 HydrophobicContact SD-CG 3.82Å; T214-R218 PolarHBondContact O-N 3.09Å; L215-R218 PolarHBondContact O-N 3.15Å; R218-F220 VanDerWaalsContact C-N 3.34Å; R218-F220 PolarHBondContact O-N 3.28Å; R218-I221 VanDerWaalsContact NH2-CG2 3.29Å; R218-I221 PolarHBondContact O-N 3.01Å; R218-I221 VanDerWaalsContact O-N 3.15Å; R218-E222 IonicContact CZ-OE1 3.98Å; R218-E222 IonicContact NE-OE1 3.1Å; R218-E222 PolarHBondContact NE-OE1 2.92Å; R218-E222 IonicContact NH2-OE1 2.65Å; R218-E222 PolarHBondContact NH2-OE1 3.25Å; R218-E222 IonicContact NH2-OE2 2.67Å; R218-E222 WeakPolarHBondContact O-CG 3.36Å; R218-E222 PolarHBondContact O-N 2.87Å; R218-Q439 VanDerWaalsContact CZ-O 3.28Å; R218-Q439 PolarHBondContact NH1-O 3.26Å; R218-Q439 PolarHBondContact NH2-O 2.77Å; R218-V448 HydrophobicContact CB-CG1 4.32Å; R218-V448 HydrophobicContact CB-CG2 4.28Å; R218-V448 HydrophobicContact CG-CG1 4.43Å; R218-V448 HydrophobicContact CG-CG2 4.24Å
219	Q	97.8	Very high	95.2	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-56.5	-46.9	173.9	-174.8	173.1	14.5	0	0	111.6	M190 L215 K216 V217 I221 E222 M223 D228 F394	M190-Q219 HydrophobicContact CB-CB 3.57Å; M190-Q219 HydrophobicContact CB-CG 3.89Å; M190-Q219 HydrophobicContact CG-CB 4.36Å; L215-Q219 WeakPolarHBondContact O-CB 3.32Å; L215-Q219 PolarHBondContact O-N 3.38Å; K216-Q219 WeakPolarHBondContact O-CB 3.37Å; K216-Q219 PolarHBondContact O-N 2.93Å; V217-Q219 VanDerWaalsContact C-N 3.34Å; V217-Q219 PolarHBondContact O-N 3.07Å; Q219-I221 VanDerWaalsContact C-N 3.31Å; Q219-I221 PolarHBondContact O-N 3.12Å; Q219-E222 CarbonylContact O-C 3.48Å; Q219-E222 PolarHBondContact O-N 3.41Å; Q219-E222 VanDerWaalsContact O-N 3.17Å; Q219-M223 HydrophobicContact CG-SD 4.4Å; Q219-M223 WeakPolarHBondContact O-CG 3.35Å; Q219-M223 PolarHBondContact O-N 3.44Å; Q219-D228 WeakPolarHBondContact CG-OD1 3.46Å; Q219-D228 PolarHBondContact NE2-OD1 2.67Å; Q219-F394 HydrophobicContact CB-CE1 4.39Å; Q219-F394 HydrophobicContact CB-CZ 3.83Å; Q219-F394 HydrophobicContact CG-CE2 4.09Å; Q219-F394 HydrophobicContact CG-CZ 3.77Å; Q219-F394 VanDerWaalsContact OE1-CE2 3.29Å; Q219-F394 VanDerWaalsContact OE1-CZ 3.3Å
220	F	97.6	Very high	94.5	Very high	1 Å²	1	17.8 Å²	17.8	0%	0.004	10%	0.099	C	C	.	.	H	α-helix	trans	-58	-41.8	175.9	176.2	-91.5	0	0	0	112.4	K216 V217 R218 M223 V224 M391 F394 L398 A422 F423 L426	K216-F220 PolarHBondContact O-N 3.1Å; V217-F220 WeakPolarHBondContact O-CB 3.42Å; V217-F220 PolarHBondContact O-N 3.1Å; R218-F220 VanDerWaalsContact C-N 3.34Å; R218-F220 PolarHBondContact O-N 3.28Å; F220-M223 WeakPolarHBondContact O-CB 3.49Å; F220-M223 PolarHBondContact O-N 2.96Å; F220-V224 HydrophobicContact CD1-CG2 4.21Å; F220-V224 HydrophobicContact CE1-CG2 3.73Å; F220-V224 HydrophobicContact CZ-CG2 4.05Å; F220-V224 WeakPolarHBondContact O-CG2 3.37Å; F220-V224 PolarHBondContact O-N 2.87Å; F220-M391 HydrophobicContact CD2-CG 4.09Å; F220-M391 HydrophobicContact CE2-CG 3.6Å; F220-M391 HydrophobicContact CE2-SD 4.42Å; F220-M391 HydrophobicContact CZ-CG 4.18Å; F220-M391 HydrophobicContact CZ-SD 4.43Å; F220-F394 HydrophobicContact CB-CD1 3.96Å; F220-F394 HydrophobicContact CB-CE1 3.84Å; F220-F394 HydrophobicContact CD2-CD1 4.09Å; F220-L398 HydrophobicContact CB-CD2 3.92Å; F220-L398 HydrophobicContact CG-CD2 4.32Å; F220-A422 HydrophobicContact CD1-CB 4.14Å; F220-A422 HydrophobicContact CE1-CB 4.48Å; F220-F423 HydrophobicContact CD1-CD1 4.26Å; F220-F423 HydrophobicContact CD1-CE1 4.4Å; F220-F423 HydrophobicContact CD2-CE1 4.44Å; F220-F423 AromaticContact CE1-CD1 3.72Å; F220-F423 HydrophobicContact CE1-CD1 3.72Å; F220-F423 HydrophobicContact CE1-CE1 4.18Å; F220-F423 HydrophobicContact CE2-CD1 4.36Å; F220-F423 HydrophobicContact CE2-CE1 4.19Å; F220-F423 AromaticContact CZ-CD1 3.77Å; F220-F423 HydrophobicContact CZ-CD1 3.77Å; F220-F423 HydrophobicContact CZ-CE1 4.06Å; F220-L426 HydrophobicContact CZ-CD1 3.95Å; F220-L426 HydrophobicContact CZ-CD2 4.06Å; F220-L426 HydrophobicContact CZ-CG 4.04Å
221	I	96.7	Very high	94	Very high	5 Å²	5	15 Å²	15	3%	0.026	9%	0.085	C	C	.	.	H	α-helix	trans	-67.6	-37.6	177.6	-56.8	162.7	0	0	0	111.2	V217 R218 Q219 M223 V224 N225 A422 L425 Q439 L440	V217-I221 HydrophobicContact CG1-CD1 4.25Å; V217-I221 WeakPolarHBondContact O-CG1 3.34Å; V217-I221 PolarHBondContact O-N 3.1Å; V217-I221 VanDerWaalsContact O-N 3.1Å; R218-I221 VanDerWaalsContact NH2-CG2 3.29Å; R218-I221 PolarHBondContact O-N 3.01Å; R218-I221 VanDerWaalsContact O-N 3.15Å; Q219-I221 VanDerWaalsContact C-N 3.31Å; Q219-I221 PolarHBondContact O-N 3.12Å; I221-M223 VanDerWaalsContact C-N 3.29Å; I221-M223 PolarHBondContact O-N 2.9Å; I221-V224 WeakPolarHBondContact O-CB 3.34Å; I221-V224 PolarHBondContact O-N 2.97Å; I221-N225 WeakPolarHBondContact O-CB 3.39Å; I221-N225 PolarHBondContact O-N 3.28Å; I221-A422 HydrophobicContact CD1-CB 3.97Å; I221-A422 HydrophobicContact CG1-CB 3.77Å; I221-L425 HydrophobicContact CG1-CD1 4.24Å; I221-L425 HydrophobicContact CG2-CD1 3.86Å; I221-Q439 HydrophobicContact CD1-CB 4.46Å; I221-Q439 HydrophobicContact CG2-CB 4.33Å; I221-L440 HydrophobicContact CG2-CD2 3.76Å; I221-L440 HydrophobicContact CG2-CG 4.49Å
222	E	96	Very high	93.1	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-70	-24.1	172.3	-58.7	-51.2	162.3	0	0	113.2	G188 M190 R218 Q219 N225 G226 T227 D228 R445	G188-E222 WeakPolarHBondContact O-CB 3.22Å; M190-E222 HydrophobicContact CG-CB 4.42Å; M190-E222 HydrophobicContact CG-CG 3.76Å; R218-E222 IonicContact CZ-OE1 3.98Å; R218-E222 IonicContact NE-OE1 3.1Å; R218-E222 PolarHBondContact NE-OE1 2.92Å; R218-E222 IonicContact NH2-OE1 2.65Å; R218-E222 PolarHBondContact NH2-OE1 3.25Å; R218-E222 IonicContact NH2-OE2 2.67Å; R218-E222 WeakPolarHBondContact O-CG 3.36Å; R218-E222 PolarHBondContact O-N 2.87Å; Q219-E222 CarbonylContact O-C 3.48Å; Q219-E222 PolarHBondContact O-N 3.41Å; Q219-E222 VanDerWaalsContact O-N 3.17Å; E222-N225 PolarHBondContact OE2-ND2 3.04Å; E222-G226 PolarHBondContact O-N 3.24Å; E222-T227 PolarHBondContact O-N 3.38Å; E222-T227 PolarHBondContact O-OG1 3.38Å; E222-T227 PolarHBondContact OE2-OG1 3.1Å; E222-D228 HydrophobicContact CB-CB 3.92Å; E222-D228 PolarHBondContact O-N 2.83Å; E222-R445 VanDerWaalsContact CD-NE 3.34Å; E222-R445 WeakPolarHBondContact OE1-CG 2.94Å; E222-R445 IonicContact OE1-CZ 3.69Å; E222-R445 IonicContact OE1-NE 2.84Å; E222-R445 PolarHBondContact OE1-NE 3.28Å; E222-R445 IonicContact OE1-NH2 3.68Å; E222-R445 IonicContact OE2-CZ 3.5Å; E222-R445 IonicContact OE2-NE 3.44Å; E222-R445 PolarHBondContact OE2-NE 2.98Å; E222-R445 IonicContact OE2-NH2 2.74Å; E222-R445 PolarHBondContact OE2-NH2 3.46Å
223	M	95.1	Very high	91.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-71	-43.4	169.1	-67.6	173.2	82	0	0	111.4	Q219 F220 I221 N225 G226 D228 E230 V231 C381 R390 M391 F394	Q219-M223 HydrophobicContact CG-SD 4.4Å; Q219-M223 WeakPolarHBondContact O-CG 3.35Å; Q219-M223 PolarHBondContact O-N 3.44Å; F220-M223 WeakPolarHBondContact O-CB 3.49Å; F220-M223 PolarHBondContact O-N 2.96Å; I221-M223 VanDerWaalsContact C-N 3.29Å; I221-M223 PolarHBondContact O-N 2.9Å; M223-N225 PolarHBondContact O-N 3Å; M223-G226 PolarHBondContact O-N 2.83Å; M223-G226 VanDerWaalsContact O-N 3.08Å; M223-D228 HydrophobicContact CG-CB 3.89Å; M223-E230 HydrophobicContact CE-CB 4.03Å; M223-V231 HydrophobicContact CB-CG1 4.01Å; M223-V231 HydrophobicContact CB-CG2 4.18Å; M223-V231 HydrophobicContact CE-CG1 3.74Å; M223-V231 HydrophobicContact CG-CG1 4.11Å; M223-V231 HydrophobicContact CG-CG2 4.29Å; M223-C381 PolarHBondContact O-SG 3.19Å; M223-R390 HydrophobicContact CE-CB 4.27Å; M223-M391 HydrophobicContact CB-CB 4.39Å; M223-M391 HydrophobicContact CB-CG 4.28Å; M223-M391 HydrophobicContact CE-CB 4.27Å; M223-F394 HydrophobicContact CE-CB 3.97Å; M223-F394 HydrophobicContact CE-CD2 4.49Å; M223-F394 HydrophobicContact CE-CG 4.3Å; M223-F394 HydrophobicContact SD-CB 3.94Å; M223-F394 HydrophobicContact SD-CD1 4Å; M223-F394 HydrophobicContact SD-CD2 3.88Å; M223-F394 HydrophobicContact SD-CE1 4.47Å; M223-F394 HydrophobicContact SD-CE2 4.33Å; M223-F394 HydrophobicContact SD-CG 3.67Å
224	V	93.7	Very high	90.6	Very high	4 Å²	4	27 Å²	27	2%	0.024	15%	0.146	C	C	.	.	H	α-helix	trans	-54.7	-43.4	170.6	169	0	0	0	0	110.4	F220 I221 G226 L380 C381 M391 L425 L426 P431 L440	F220-V224 HydrophobicContact CD1-CG2 4.21Å; F220-V224 HydrophobicContact CE1-CG2 3.73Å; F220-V224 HydrophobicContact CZ-CG2 4.05Å; F220-V224 WeakPolarHBondContact O-CG2 3.37Å; F220-V224 PolarHBondContact O-N 2.87Å; I221-V224 WeakPolarHBondContact O-CB 3.34Å; I221-V224 PolarHBondContact O-N 2.97Å; V224-G226 VanDerWaalsContact C-N 3.31Å; V224-G226 PolarHBondContact O-N 2.9Å; V224-L380 HydrophobicContact CG1-CD2 4.01Å; V224-C381 PolarHBondContact O-N 2.96Å; V224-M391 HydrophobicContact CB-SD 4.26Å; V224-M391 HydrophobicContact CG2-CG 4.43Å; V224-M391 HydrophobicContact CG2-SD 3.47Å; V224-M391 WeakPolarHBondContact CG2-SD 3.42Å; V224-L425 HydrophobicContact CG1-CB 4.15Å; V224-L425 HydrophobicContact CG1-CD1 4.26Å; V224-L426 HydrophobicContact CG2-CD2 4.19Å; V224-P431 HydrophobicContact CG1-CB 4.05Å; V224-P431 HydrophobicContact CG1-CG 4.04Å; V224-L440 HydrophobicContact CB-CD2 4.44Å; V224-L440 HydrophobicContact CG1-CD2 3.97Å
225	N	91.9	Very high	88.6	Confident	34 Å²	34	27.6 Å²	27.6	18%	0.182	16%	0.158	C	C	.	.	H	α-helix	trans	-70.3	-20.7	178.6	-156.5	14.5	0	0	0	114.1	I221 E222 M223 W432 L440	I221-N225 WeakPolarHBondContact O-CB 3.39Å; I221-N225 PolarHBondContact O-N 3.28Å; E222-N225 PolarHBondContact OE2-ND2 3.04Å; M223-N225 PolarHBondContact O-N 3Å; N225-W432 VanDerWaalsContact OD1-CZ2 3.25Å; N225-W432 WeakPolarHBondContact OD1-CZ2 3.46Å; N225-L440 HydrophobicContact CB-CD2 3.83Å
226	G	91	Very high	86.3	Confident	19 Å²	19	30.8 Å²	30.8	20%	0.196	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	6.4	-175.9	0	0	0	0	0	115.3	E222 M223 V224	E222-G226 PolarHBondContact O-N 3.24Å; M223-G226 PolarHBondContact O-N 2.83Å; M223-G226 VanDerWaalsContact O-N 3.08Å; V224-G226 VanDerWaalsContact C-N 3.31Å; V224-G226 PolarHBondContact O-N 2.9Å
227	T	89.8	Confident	83.3	Confident	41 Å²	41	40.2 Å²	40.2	25%	0.252	23%	0.225	S	C	.	.			trans	-90.7	-25	-177	52	0	0	0	0	114	E222 R445	E222-T227 PolarHBondContact O-N 3.38Å; E222-T227 PolarHBondContact O-OG1 3.38Å; E222-T227 PolarHBondContact OE2-OG1 3.1Å; T227-R445 PolarHBondContact OG1-NH2 2.82Å
228	D	92.7	Very high	80.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.26	C	S	.	.	S	Bend	trans	-68.5	143.7	178.2	-164.2	-119.1	0	0	0	111.6	M190 G191 Q219 E222 M223 E230 V231 R232	M190-D228 PolarHBondContact N-OD2 2.86Å; G191-D228 PolarHBondContact N-OD2 3.07Å; Q219-D228 WeakPolarHBondContact CG-OD1 3.46Å; Q219-D228 PolarHBondContact NE2-OD1 2.67Å; E222-D228 HydrophobicContact CB-CB 3.92Å; E222-D228 PolarHBondContact O-N 2.83Å; M223-D228 HydrophobicContact CG-CB 3.89Å; D228-E230 PolarHBondContact O-N 3.33Å; D228-E230 VanDerWaalsContact O-N 3.15Å; D228-E230 VanDerWaalsContact OD1-CG 3.24Å; D228-E230 WeakPolarHBondContact OD1-CG 3.32Å; D228-V231 HydrophobicContact CB-CG2 4.44Å; D228-V231 VanDerWaalsContact O-CG2 3.26Å; D228-V231 WeakPolarHBondContact O-CG2 3.46Å; D228-V231 PolarHBondContact O-N 3.07Å; D228-V231 VanDerWaalsContact O-N 3.14Å; D228-R232 VanDerWaalsContact O-CB 3.28Å; D228-R232 WeakPolarHBondContact O-CB 3.42Å; D228-R232 PolarHBondContact O-N 3.48Å
229	S	84.9	Confident	77.4	Confident	23 Å²	23	50.2 Å²	50.2	16%	0.161	30%	0.295	C	S	.	.	H	α-helix	trans	-58.4	-31.7	-174.8	50.3	0	0	0	0	113.6	E192 V231	E192-S229 VanDerWaalsContact OE1-CB 3.32Å; E192-S229 WeakPolarHBondContact OE1-CB 3.36Å; S229-V231 PolarHBondContact O-N 2.99Å
230	E	80.9	Confident	74.2	Confident	50 Å²	50	59.2 Å²	59.2	23%	0.234	33%	0.333	C	S	.	.	H	α-helix	trans	-62.7	-23.6	-179.4	-60.7	-76.5	-117.3	0	0	114	M223 D228 R390	M223-E230 HydrophobicContact CE-CB 4.03Å; D228-E230 PolarHBondContact O-N 3.33Å; D228-E230 VanDerWaalsContact O-N 3.15Å; D228-E230 VanDerWaalsContact OD1-CG 3.24Å; D228-E230 WeakPolarHBondContact OD1-CG 3.32Å; E230-R390 VanDerWaalsContact CD-NH2 3.34Å; E230-R390 IonicContact OE1-CZ 3.54Å; E230-R390 IonicContact OE1-NH1 2.7Å; E230-R390 PolarHBondContact OE1-NH1 3.44Å; E230-R390 IonicContact OE1-NH2 3.55Å; E230-R390 IonicContact OE2-CZ 3.27Å; E230-R390 VanDerWaalsContact OE2-CZ 3.27Å; E230-R390 IonicContact OE2-NH1 3.26Å; E230-R390 PolarHBondContact OE2-NH1 3.46Å; E230-R390 IonicContact OE2-NH2 2.65Å; E230-R390 PolarHBondContact OE2-NH2 3.29Å
231	V	83.5	Confident	71.3	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.006	37%	0.37	C	S	.	.	H	α-helix	trans	-116.9	-33.2	179.2	-69.2	0	0	0	0	113.1	M223 D228 S229 C233 L234 G235 A387 R390	M223-V231 HydrophobicContact CB-CG1 4.01Å; M223-V231 HydrophobicContact CB-CG2 4.18Å; M223-V231 HydrophobicContact CE-CG1 3.74Å; M223-V231 HydrophobicContact CG-CG1 4.11Å; M223-V231 HydrophobicContact CG-CG2 4.29Å; D228-V231 HydrophobicContact CB-CG2 4.44Å; D228-V231 VanDerWaalsContact O-CG2 3.26Å; D228-V231 WeakPolarHBondContact O-CG2 3.46Å; D228-V231 PolarHBondContact O-N 3.07Å; D228-V231 VanDerWaalsContact O-N 3.14Å; S229-V231 PolarHBondContact O-N 2.99Å; V231-C233 VanDerWaalsContact C-N 3.26Å; V231-C233 PolarHBondContact O-N 3.13Å; V231-L234 WeakPolarHBondContact O-CA 3.35Å; V231-L234 WeakPolarHBondContact O-CB 3.48Å; V231-L234 PolarHBondContact O-N 3.25Å; V231-G235 PolarHBondContact O-N 3.16Å; V231-A387 HydrophobicContact CB-CB 3.84Å; V231-A387 HydrophobicContact CG1-CB 3.89Å; V231-R390 HydrophobicContact CG1-CB 4.45Å
232	R	78.7	Confident	68.2	Low	124 Å²	124	72.7 Å²	72.7	47%	0.468	41%	0.408	S	S	.	.	H	α-helix	trans	-55.7	-41.3	-178.3	-177.1	179.4	62.1	151.6	-3.4	112	E192 D228 L234 G235	E192-R232 IonicContact OE1-NH2 3.66Å; D228-R232 VanDerWaalsContact O-CB 3.28Å; D228-R232 WeakPolarHBondContact O-CB 3.42Å; D228-R232 PolarHBondContact O-N 3.48Å; R232-L234 PolarHBondContact O-N 3.41Å; R232-G235 PolarHBondContact O-N 2.92Å
233	C	71.8	Confident	65.2	Low	107 Å²	107	79.1 Å²	79.1	72%	0.723	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-12.3	178.1	-62.4	0	0	0	0	114.2	V231	V231-C233 VanDerWaalsContact C-N 3.26Å; V231-C233 PolarHBondContact O-N 3.13Å
234	L	70.7	Confident	62.3	Low	71 Å²	71	83.9 Å²	83.9	37%	0.372	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-11	177.1	-56	176.9	0	0	0	112.1	V231 R232 G236 S384 A386 A387 R390	V231-L234 WeakPolarHBondContact O-CA 3.35Å; V231-L234 WeakPolarHBondContact O-CB 3.48Å; V231-L234 PolarHBondContact O-N 3.25Å; R232-L234 PolarHBondContact O-N 3.41Å; L234-G236 PolarHBondContact O-N 3.47Å; L234-S384 VanDerWaalsContact O-CB 3.28Å; L234-S384 WeakPolarHBondContact O-CB 3.36Å; L234-S384 PolarHBondContact O-OG 2.75Å; L234-A386 HydrophobicContact CD1-CB 4.28Å; L234-A387 HydrophobicContact CB-CB 4.13Å; L234-R390 HydrophobicContact CD1-CB 4.39Å; L234-R390 HydrophobicContact CD1-CG 3.9Å
235	G	54.8	Low	59.6	Low	41 Å²	41	93.8 Å²	93.8	42%	0.423	52%	0.515	S	S	.	.	S	Bend	trans	-84.4	83.4	174.7	0	0	0	0	0	112.4	V231 R232	V231-G235 PolarHBondContact O-N 3.16Å; R232-G235 PolarHBondContact O-N 2.92Å
236	G	50.2	Low	57	Low	68 Å²	68	97.7 Å²	97.7	70%	0.701	54%	0.542	S	S	*	.			trans	82.9	85	161.5	0	0	0	0	0	116.8	L234 S238	L234-G236 PolarHBondContact O-N 3.47Å; G236-S238 PolarHBondContact O-N 3.03Å
237	R	35.5	Very low	54.5	Low	244 Å²	244	103.2 Å²	103.2	92%	0.921	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-69.7	120.9	134.4	-78.2	-171.5	176.3	-148.7	-1.3	106.9
238	S	35	Very low	52	Low	105 Å²	105	106.7 Å²	106.7	73%	0.734	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-51.4	139.6	170.3	-170.1	0	0	0	0	110	G236 K240	G236-S238 PolarHBondContact O-N 3.03Å; S238-K240 PolarHBondContact O-N 3.29Å
239	P	36.4	Very low	49.4	Very low	117 Å²	117	112.1 Å²	112.1	76%	0.76	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-56.7	129.5	177.1	-21.6	32.6	0	0	0	109.7	S241	P239-S241 PolarHBondContact O-N 2.88Å
240	K	32	Very low	47.2	Very low	188 Å²	188	122.8 Å²	122.8	82%	0.817	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-51.3	129	173.1	-67.5	174.9	176.4	177.8	0	108.9	S238 Q242	S238-K240 PolarHBondContact O-N 3.29Å; K240-Q242 VanDerWaalsContact C-N 3.33Å; K240-Q242 PolarHBondContact O-N 3.06Å
241	S	36.7	Very low	45.1	Very low	110 Å²	110	125.5 Å²	125.5	77%	0.769	69%	0.691	S	S	*	*			trans	-58.8	96.6	164.2	51.3	0	0	0	0	109.2	P239 D243	P239-S241 PolarHBondContact O-N 2.88Å; S241-D243 PolarHBondContact O-N 3.26Å
242	Q	30.4	Very low	42.6	Very low	179 Å²	179	134.6 Å²	134.6	84%	0.836	73%	0.731	S	S	*	*			trans	-75.8	75.6	166.1	-75.7	-171.9	-57.7	0	0	109.1	K240	K240-Q242 VanDerWaalsContact C-N 3.33Å; K240-Q242 PolarHBondContact O-N 3.06Å
243	D	33.3	Very low	40.4	Very low	136 Å²	136	134.7 Å²	134.7	73%	0.727	75%	0.751	S	S	*	*			trans	-94	107.1	159.7	-87.1	-49.9	0	0	0	109.2	S241	S241-D243 PolarHBondContact O-N 3.26Å
244	S	33.9	Very low	38.8	Very low	99 Å²	99	134.9 Å²	134.9	69%	0.692	75%	0.754	S	S	*	*			trans	-95.3	109.3	176.3	-61.3	0	0	0	0	109.6
245	Y	36.7	Very low	37.4	Very low	212 Å²	212	137.1 Å²	137.1	83%	0.831	77%	0.772	S	S	*	*			trans	-132.2	110.9	161.2	-76	-76.4	0	0	0	110.3
246	P	38.2	Very low	36.2	Very low	117 Å²	117	139.6 Å²	139.6	76%	0.76	78%	0.783	S	S	*	*			trans	-82.4	133.3	160.9	32.8	-28.6	0	0	0	109
247	V	38.4	Very low	35.5	Very low	135 Å²	135	144 Å²	144	82%	0.818	79%	0.787	S	S	*	*			trans	-177.3	122.4	138	143	0	0	0	0	112
248	S	38.2	Very low	35.4	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	78%	0.78	S	S	*	*			trans	74	147.2	153	-71.3	0	0	0	0	122.4
249	P	38.1	Very low	35.8	Very low	114 Å²	114	138.8 Å²	138.8	74%	0.74	79%	0.785	S	S	*	*			trans	-114.8	154.7	-163.5	39.7	-26.6	0	0	0	113.9
250	R	37.6	Very low	36	Very low	247 Å²	247	139 Å²	139	93%	0.932	79%	0.79	S	S	*	*			trans	-138.6	155.2	157.4	-78.9	-157.7	177.2	-139.4	-2	111.9
251	P	37.8	Very low	36	Very low	107 Å²	107	139.6 Å²	139.6	70%	0.695	80%	0.795	S	S	*	*			trans	-107.8	161.1	-141.9	38.1	-33.1	0	0	0	115.4
252	F	30.1	Very low	35.9	Very low	192 Å²	192	138.2 Å²	138.2	84%	0.842	80%	0.798	S	S	*	*			trans	23.7	113	147.4	-70.5	-85	0	0	0	118.8
253	S	33.7	Very low	36.2	Very low	127 Å²	127	138.4 Å²	138.4	89%	0.888	80%	0.801	S	S	*	*			trans	-149.7	123.6	135.5	-78.5	0	0	0	0	109.8
254	S	37.7	Very low	36.2	Very low	111 Å²	111	139.3 Å²	139.3	78%	0.776	81%	0.806	S	S	*	*			trans	-93.9	169.6	-179.3	-72.2	0	0	0	0	111
255	P	41.6	Very low	36.1	Very low	117 Å²	117	140.9 Å²	140.9	76%	0.76	81%	0.805	S	S	*	*			trans	-102.4	-173.9	-148.8	40.4	-39	0	0	0	115.7
256	S	29.7	Very low	36.3	Very low	93 Å²	93	140.1 Å²	140.1	65%	0.65	81%	0.809	S	S	*	*			trans	88.7	134.5	163.8	80.4	0	0	0	0	117.7
257	M	34.6	Very low	36.1	Very low	160 Å²	160	141.2 Å²	141.2	79%	0.788	81%	0.808	S	S	*	*				-179.3	131.2	115.9	-95.2	-64.3	113.9	0	0	113.1
258	S	34.4	Very low	36	Very low	111 Å²	111	142.7 Å²	142.7	78%	0.776	81%	0.811	S	S	*	*			trans	-171.2	154.5	157.3	-77.2	0	0	0	0	106.1
259	P	42.8	Very low	36	Very low	130 Å²	130	141.4 Å²	141.4	84%	0.844	81%	0.807	S	S	*	*			cis	-124.4	-174.8	-1.8	41.3	-26.6	0	0	0	113
260	S	39.8	Very low	36	Very low	121 Å²	121	142 Å²	142	85%	0.846	81%	0.814	S	S	*	*			trans	-147.8	138	163.6	60.4	0	0	0	0	113.9
261	H	32.5	Very low	35.9	Very low	201 Å²	201	133.8 Å²	133.8	93%	0.931	81%	0.806	S	S	*	*			trans	-68.5	162	177.3	-78.1	-93.6	0	0	0	114.5
262	G	34.7	Very low	36.1	Very low	81 Å²	81	139.2 Å²	139.2	84%	0.835	82%	0.819	S	S	*	*			trans	176.9	105	158.1	0	0	0	0	0	113.9
263	M	35.6	Very low	36.3	Very low	182 Å²	182	133.4 Å²	133.4	90%	0.897	81%	0.813	S	S	*	*			trans	-87	141.2	172.4	-68.1	177.3	164.9	0	0	111.1
264	N	34.9	Very low	36.6	Very low	156 Å²	156	132.5 Å²	132.5	83%	0.834	81%	0.807	S	S	*	*				-174.3	166.4	108.5	-115.3	-41.1	0	0	0	115.9
265	I	31.1	Very low	36.5	Very low	132 Å²	132	133.6 Å²	133.6	68%	0.677	81%	0.809	S	S	*	*			trans	-85.4	147.8	-172.6	-67.3	164.4	0	0	0	112.4
266	H	41	Very low	36.4	Very low	195 Å²	195	132.9 Å²	132.9	90%	0.903	81%	0.813	S	S	*	*			trans	-166.1	136.6	133.3	-105.6	-73.4	0	0	0	113.3
267	N	33.1	Very low	36.5	Very low	140 Å²	140	136.6 Å²	136.6	75%	0.749	82%	0.82	S	S	*	*			trans	-78.6	152.7	178.1	-75.5	-31.9	0	0	0	113.2
268	L	37.7	Very low	36.4	Very low	167 Å²	167	139.3 Å²	139.3	87%	0.874	83%	0.828	S	S	*	*				-172.9	129.7	103.1	-136.7	66.5	0	0	0	116
269	A	37.2	Very low	36.2	Very low	85 Å²	85	139.3 Å²	139.3	70%	0.702	83%	0.828	S	S	*	*			trans	3.3	139.3	156.7	0	0	0	0	0	123.6
270	S	38.5	Very low	35.7	Very low	127 Å²	127	136.3 Å²	136.3	89%	0.888	82%	0.82	S	S	*	*				177	135.4	98	-76.7	0	0	0	0	114.9
271	G	36.2	Very low	35.4	Very low	75 Å²	75	139.4 Å²	139.4	77%	0.773	82%	0.819	S	S	*	*			trans	141.2	91.4	156.2	0	0	0	0	0	118.9
272	K	40.4	Very low	35.3	Very low	220 Å²	220	137 Å²	137	96%	0.957	81%	0.808	S	S	*	*			trans	11.2	133.5	148.3	-56	167.5	-180	177.6	0	117.6
273	G	35.1	Very low	35	Very low	71 Å²	71	138.5 Å²	138.5	73%	0.732	81%	0.805	S	S	*	*			cis	151.7	176.2	16.2	0	0	0	0	0	108.7
274	S	40.9	Very low	34.7	Very low	107 Å²	107	134.9 Å²	134.9	75%	0.748	80%	0.797	S	S	*	*			cis	-160.7	132.2	-0.8	-66.7	0	0	0	0	111.9
275	T	34.9	Very low	34.6	Very low	134 Å²	134	132.6 Å²	132.6	82%	0.822	79%	0.793	S	S	*	*			trans	43.5	117.8	144.3	60.5	0	0	0	0	123.1
276	A	38.8	Very low	34.6	Very low	102 Å²	102	134.4 Å²	134.4	84%	0.843	80%	0.804	S	S	*	*			trans	-150.3	140.6	130.2	0	0	0	0	0	110.5
277	H	32.9	Very low	34.1	Very low	172 Å²	172	128.9 Å²	128.9	80%	0.796	80%	0.8	S	S	*	*			trans	-76.2	141.6	-168.5	-75.2	-109.9	0	0	0	115
278	F	31.5	Very low	33.9	Very low	217 Å²	217	129.2 Å²	129.2	95%	0.952	81%	0.807	S	S	*	*				-157.7	140.1	119.7	-121.8	-83.8	0	0	0	110.2
279	S	31.3	Very low	33.9	Very low	111 Å²	111	129 Å²	129	78%	0.776	81%	0.805	S	S	*	*			trans	-152.8	133.1	-177.8	59	0	0	0	0	112.5
280	G	32.2	Very low	33.6	Very low	67 Å²	67	129.9 Å²	129.9	69%	0.691	81%	0.806	S	S	*	*			trans	163	99	176.7	0	0	0	0	0	106.4
281	F	33	Very low	33.4	Very low	186 Å²	186	131.6 Å²	131.6	82%	0.816	81%	0.805	S	S	*	*				60.1	122.1	80.2	-146.7	-114.1	0	0	0	109.7
282	E	30.8	Very low	33.1	Very low	151 Å²	151	137.4 Å²	137.4	71%	0.706	81%	0.809	S	S	*	*			cis	-155.5	172.4	32.4	-164.8	166.7	-162.1	0	0	111.3
283	S	29	Very low	32.7	Very low	111 Å²	111	131 Å²	131	78%	0.776	80%	0.797	S	S	*	*			trans	-131.1	121.8	171.4	179.7	0	0	0	0	110.4
284	C	29.2	Very low	32.5	Very low	106 Å²	106	136.6 Å²	136.6	72%	0.716	80%	0.804	S	S	*	*			trans	179.1	138.8	136.8	54.6	0	0	0	0	115
285	S	32.3	Very low	32.1	Very low	109 Å²	109	139.6 Å²	139.6	76%	0.762	81%	0.806	S	S	*	*			trans	61.9	116.2	135.3	-57.6	0	0	0	0	123.9
286	N	29.9	Very low	32	Very low	170 Å²	170	138.6 Å²	138.6	91%	0.909	81%	0.805	S	S	*	*			trans	23.3	124.1	135.3	-67.9	-10.4	0	0	0	120.9
287	G	31.2	Very low	31.6	Very low	79 Å²	79	143.6 Å²	143.6	81%	0.814	80%	0.803	S	S	*	*			trans	-148.2	115	156.1	0	0	0	0	0	112
288	V	29.2	Very low	31.2	Very low	147 Å²	147	140.4 Å²	140.4	89%	0.891	80%	0.799	S	S	*	*			trans	-97.9	117.1	170.9	177.7	0	0	0	0	108.4
289	I	36.9	Very low	31.2	Very low	161 Å²	161	139 Å²	139	83%	0.826	80%	0.795	S	S	*	*			trans	-131.7	124.8	163.8	-64.3	-176.3	0	0	0	109.3
290	S	32.5	Very low	31	Very low	104 Å²	104	138.8 Å²	138.8	73%	0.727	79%	0.794	S	S	*	*			trans	-76	141.4	172.6	-155.7	0	0	0	0	110
291	N	32.7	Very low	31	Very low	164 Å²	164	143.4 Å²	143.4	88%	0.877	80%	0.802	S	S	*	*			trans	-140.2	139.9	157.3	-125.3	-10.7	0	0	0	112.2
292	K	31.4	Very low	30.8	Very low	196 Å²	196	142.7 Å²	142.7	85%	0.852	80%	0.799	S	S	*	*			trans	-96.9	165.4	-171.4	-106.8	177.5	176.6	175.7	0	111.6
293	A	31.2	Very low	30.9	Very low	86 Å²	86	145 Å²	145	71%	0.711	81%	0.809	S	S	*	*			trans	73.8	104	154.1	0	0	0	0	0	118.2
294	H	31.2	Very low	30.9	Very low	189 Å²	189	147.6 Å²	147.6	88%	0.875	81%	0.809	S	S	*	*				-127.1	113.7	111.6	-108.9	-75.6	0	0	0	109.9
295	Q	31.9	Very low	30.9	Very low	169 Å²	169	148.5 Å²	148.5	79%	0.79	82%	0.817	S	S	*	*			trans	-85.5	137.5	152	-82.1	178.2	-23.5	0	0	107.2
296	S	32.1	Very low	30.9	Very low	114 Å²	114	148.1 Å²	148.1	80%	0.797	81%	0.814	S	S	*	*			trans	-136.7	122.1	159.8	53.6	0	0	0	0	108.3
297	Y	31.8	Very low	30.6	Very low	207 Å²	207	147.4 Å²	147.4	81%	0.812	81%	0.811	S	S	*	*			trans	-70	162	-177.6	-100.6	-105.2	0	0	0	112.8
298	C	23.8	Very low	30.6	Very low	104 Å²	104	151.2 Å²	151.2	70%	0.703	81%	0.811	S	S	*	*			trans	-52.2	145.7	171.8	-11.6	0	0	0	0	113.1
299	H	31.5	Very low	30.6	Very low	188 Å²	188	151.4 Å²	151.4	87%	0.87	81%	0.807	S	S	*	*				-154.4	142.8	123.8	-114.7	-62.3	0	0	0	113.3
300	S	26.6	Very low	30.4	Very low	107 Å²	107	150.1 Å²	150.1	75%	0.748	81%	0.807	S	S	*	*			trans	-64.6	148.3	-178	-29.4	0	0	0	0	113.1
301	N	32.1	Very low	30.3	Very low	163 Å²	163	150.3 Å²	150.3	87%	0.872	81%	0.806	S	S	*	*			trans	-142.2	148.2	142.8	-137.7	-9.4	0	0	0	112.8
302	K	28.9	Very low	30.1	Very low	171 Å²	171	150.9 Å²	150.9	74%	0.743	80%	0.803	S	S	*	*			trans	-81.7	143.4	-171.8	-63.7	164.2	175.6	172.5	0	110.9
303	H	33.1	Very low	29.9	Very low	200 Å²	200	150.2 Å²	150.2	93%	0.926	81%	0.808	S	S	*	*			trans	-132.7	131.5	137	-101.1	-81.7	0	0	0	110.5
304	Q	29.2	Very low	29.8	Very low	165 Å²	165	152.5 Å²	152.5	77%	0.771	81%	0.808	S	S	*	*			trans	-96.2	171.3	174.8	-71.3	172.6	-58.5	0	0	110.2
305	S	29.8	Very low	29.7	Very low	125 Å²	125	148.7 Å²	148.7	87%	0.874	80%	0.802	S	S	*	*			trans	70.5	139.9	175.2	69.7	0	0	0	0	115.5
306	S	31	Very low	29.8	Very low	102 Å²	102	148.9 Å²	148.9	71%	0.713	81%	0.807	S	S	*	*			cis	-134.8	134.4	7	52.5	0	0	0	0	112.8
307	N	25.3	Very low	29.7	Very low	155 Å²	155	150.8 Å²	150.8	83%	0.829	81%	0.808	S	S	*	*			trans	-68.9	128.4	166.3	-69.6	-18.6	0	0	0	109.9
308	L	30.6	Very low	29.7	Very low	158 Å²	158	148.3 Å²	148.3	83%	0.827	81%	0.806	S	S	*	*			trans	-109.1	100.7	157.7	-80.6	167.8	0	0	0	107.9	V310	L308-V310 PolarHBondContact O-N 2.89Å
309	N	28.7	Very low	30.2	Very low	151 Å²	151	148 Å²	148	81%	0.807	81%	0.805	S	S	*	*			trans	-67.6	117.4	168.7	-84	-2.9	0	0	0	108.8
310	V	32.2	Very low	30.1	Very low	134 Å²	134	149.2 Å²	149.2	81%	0.812	80%	0.802	S	S	*	*			trans	-102.5	111.8	158.2	-176.5	0	0	0	0	106.2	L308	L308-V310 PolarHBondContact O-N 2.89Å
311	P	31.6	Very low	30.4	Very low	109 Å²	109	149.6 Å²	149.6	71%	0.708	81%	0.805	S	S	*	*			trans	-75.2	138.9	-178.8	29.7	-33	0	0	0	111.1	L313	P311-L313 PolarHBondContact O-N 3.23Å
312	E	27.4	Very low	30.4	Very low	175 Å²	175	148.4 Å²	148.4	82%	0.818	79%	0.794	S	S	*	*			trans	-58.8	125.9	170.4	-69.3	173.2	90.7	0	0	111.1
313	L	28.4	Very low	30.5	Very low	182 Å²	182	149.7 Å²	149.7	95%	0.953	80%	0.803	S	S	*	*			trans	-94.3	92.2	162.1	-83.6	166.6	0	0	0	108.9	P311	P311-L313 PolarHBondContact O-N 3.23Å
314	N	29.4	Very low	30.3	Very low	135 Å²	135	145.8 Å²	145.8	72%	0.722	79%	0.793	S	S	*	*			trans	-130.5	147.1	171.2	-113.5	-29.2	0	0	0	109.9
315	S	28.8	Very low	30.5	Very low	108 Å²	108	145.3 Å²	145.3	76%	0.755	80%	0.796	S	S	*	*			trans	76.9	81.8	172.7	-46.6	0	0	0	0	118.2	N317	S315-N317 PolarHBondContact O-N 2.92Å
316	I	32.4	Very low	30.3	Very low	173 Å²	173	146.3 Å²	146.3	89%	0.887	79%	0.791	S	S	*	*			trans	-85.3	93.7	145.6	-52.8	176.3	0	0	0	107
317	N	30.1	Very low	30.4	Very low	154 Å²	154	151.3 Å²	151.3	82%	0.824	80%	0.8	S	S	*	*			trans	-101.9	102.5	178.9	-162.3	0.2	0	0	0	109.3	S315	S315-N317 PolarHBondContact O-N 2.92Å
318	M	33	Very low	30.6	Very low	156 Å²	156	150.3 Å²	150.3	77%	0.768	80%	0.8	S	S	*	*			trans	-92.9	114.1	-177.7	-110.5	-66.9	164.5	0	0	112
319	S	33.4	Very low	30.6	Very low	98 Å²	98	147.6 Å²	147.6	69%	0.685	79%	0.794	S	S	*	*			trans	51.7	87.7	150.3	-60.8	0	0	0	0	118.6	S321	S319-S321 PolarHBondContact O-N 3.38Å
320	R	29.2	Very low	30.8	Very low	212 Å²	212	147.5 Å²	147.5	80%	0.8	79%	0.794	S	S	*	*			trans	-71.3	107.3	159.8	173.1	-176.9	172.2	174.7	-1.3	110.8	Q322	R320-Q322 HydrophobicContact CG-CG 4.23Å; R320-Q322 VanDerWaalsContact CZ-OE1 3.32Å
321	S	32.8	Very low	30.5	Very low	115 Å²	115	148.5 Å²	148.5	80%	0.804	79%	0.794	S	S	*	*			trans	-109.9	106.8	157.9	54.5	0	0	0	0	109.8	S319	S319-S321 PolarHBondContact O-N 3.38Å
322	Q	32.2	Very low	30.7	Very low	138 Å²	138	150.3 Å²	150.3	65%	0.645	80%	0.803	S	S	*	*			trans	-85.7	123.9	171	-73.7	176.9	-73.7	0	0	109.8	R320	R320-Q322 HydrophobicContact CG-CG 4.23Å; R320-Q322 VanDerWaalsContact CZ-OE1 3.32Å
323	Q	32.2	Very low	30.7	Very low	199 Å²	199	149.6 Å²	149.6	93%	0.93	81%	0.805	S	S	*	*			trans	-137.3	146.6	145.4	-111.7	177.5	1	0	0	109.6
324	V	29.3	Very low	31.2	Very low	118 Å²	118	149.1 Å²	149.1	72%	0.715	80%	0.8	S	S	*	*			trans	-107.3	138.2	-160.5	-168	0	0	0	0	108.9
325	N	32.9	Very low	31.3	Very low	155 Å²	155	149.1 Å²	149.1	83%	0.829	80%	0.796	S	S	*	*			trans	-163.1	126.5	143.5	-98.4	-23.2	0	0	0	110.9
326	N	26.1	Very low	31.5	Very low	146 Å²	146	149.3 Å²	149.3	78%	0.781	79%	0.792	S	S	*	*			trans	-83.2	131.8	170	-82.4	-16.2	0	0	0	109.7
327	F	33.3	Very low	31.5	Very low	207 Å²	207	148.6 Å²	148.6	91%	0.908	79%	0.79	S	S	*	*			trans	-140.5	132.9	144.5	-88.9	-74.6	0	0	0	110.2
328	T	28.2	Very low	31.6	Very low	134 Å²	134	149.7 Å²	149.7	82%	0.822	79%	0.79	S	S	*	*			trans	-93.1	134.5	178.7	50.4	0	0	0	0	110.6
329	S	31.1	Very low	31.3	Very low	100 Å²	100	153 Å²	153	70%	0.699	80%	0.796	S	S	*	*			trans	-176	122.8	141.5	-161.4	0	0	0	0	113.6
330	N	32.8	Very low	31.1	Very low	150 Å²	150	153.9 Å²	153.9	80%	0.802	80%	0.802	S	S	*	*			trans	58.4	143.7	143.2	-58.9	-3.1	0	0	0	123.7
331	D	26.6	Very low	31	Very low	154 Å²	154	151 Å²	151	82%	0.824	80%	0.802	S	S	*	*			trans	-61.2	146.1	176.5	-54.2	-85.2	0	0	0	115.2
332	V	34.9	Very low	30.8	Very low	148 Å²	148	148.9 Å²	148.9	90%	0.897	80%	0.798	S	S	*	*				-159.6	121.2	125.2	-99.5	0	0	0	0	110
333	D	27.7	Very low	30.6	Very low	159 Å²	159	148.4 Å²	148.4	85%	0.85	81%	0.805	S	S	*	*			trans	-71.2	135.4	166	-89.1	-47.1	0	0	0	110.6
334	M	39.4	Very low	30.5	Very low	172 Å²	172	142 Å²	142	85%	0.847	79%	0.791	S	S	*	*			trans	-149.3	105.5	154.2	-91.5	-65.6	-87.6	0	0	109
335	E	31.5	Very low	30.3	Very low	136 Å²	136	145 Å²	145	64%	0.636	80%	0.798	S	S	*	*			trans	-73	133.9	169.8	-69.9	179.5	169.8	0	0	109.5	K416	E335-K416 IonicContact OE1-NZ 3.52Å; E335-K416 PolarHBondContact OE1-NZ 3.42Å
336	T	32.9	Very low	30.1	Very low	111 Å²	111	142.9 Å²	142.9	68%	0.681	79%	0.791	S	S	*	*			trans	-152.6	74.7	158.8	-51.2	0	0	0	0	109.9
337	D	31.8	Very low	30.1	Very low	159 Å²	159	141.9 Å²	141.9	85%	0.85	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-94.9	135.2	168.4	-79.7	-43.7	0	0	0	110.5
338	H	32.2	Very low	30.2	Very low	176 Å²	176	134.7 Å²	134.7	82%	0.815	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-71.8	139.4	-171.4	-79.2	-93.6	0	0	0	113.2	S340	H338-S340 PolarHBondContact O-N 3.14Å
339	Y	26.2	Very low	30.3	Very low	226 Å²	226	133.7 Å²	133.7	89%	0.886	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-62.3	126	168.8	-65.3	-93.2	0	0	0	110.9
340	S	30.4	Very low	30.1	Very low	116 Å²	116	132.6 Å²	132.6	81%	0.811	77%	0.765	S	S	*	*			trans	-128.5	105.2	160.2	-170.4	0	0	0	0	108.6	H338 G342	H338-S340 PolarHBondContact O-N 3.14Å; S340-G342 VanDerWaalsContact C-N 3.3Å; S340-G342 PolarHBondContact O-N 3.02Å
341	N	27.5	Very low	30.1	Very low	152 Å²	152	134 Å²	134	81%	0.813	76%	0.764	S	S	*	*			trans	-77.6	82.4	173.5	-85.3	-5.4	0	0	0	109.3	V343	N341-V343 PolarHBondContact O-N 3.03Å
342	G	28.5	Very low	30.3	Very low	70 Å²	70	135.1 Å²	135.1	72%	0.722	77%	0.769	S	S	*	*			trans	-76.2	97.9	164.8	0	0	0	0	0	110.1	S340 G344	S340-G342 VanDerWaalsContact C-N 3.3Å; S340-G342 PolarHBondContact O-N 3.02Å; G342-G344 PolarHBondContact O-N 2.87Å; G342-G344 VanDerWaalsContact O-N 3.16Å
343	V	26.8	Very low	30.4	Very low	129 Å²	129	133.8 Å²	133.8	78%	0.782	76%	0.757	S	S	*	*			trans	-71.2	103.2	164.5	177.1	0	0	0	0	107.3	N341 E345	N341-V343 PolarHBondContact O-N 3.03Å; V343-E345 HydrophobicContact CG1-CG 4.37Å
344	G	29.9	Very low	30.3	Very low	63 Å²	63	129.5 Å²	129.5	65%	0.649	75%	0.75	S	S	*	*			trans	-84.1	106.1	167	0	0	0	0	0	109	G342 T346	G342-G344 PolarHBondContact O-N 2.87Å; G342-G344 VanDerWaalsContact O-N 3.16Å; G344-T346 PolarHBondContact O-N 3.46Å; G344-T346 VanDerWaalsContact O-N 3.12Å
345	E	25.1	Very low	30.1	Very low	181 Å²	181	127.1 Å²	127.1	85%	0.846	75%	0.75	S	S	*	*			trans	-69.1	102.9	171.5	-64.9	-177.6	155.7	0	0	109.1	V343	V343-E345 HydrophobicContact CG1-CG 4.37Å
346	T	29.1	Very low	30.2	Very low	112 Å²	112	126.4 Å²	126.4	69%	0.687	76%	0.761	S	S	*	*			trans	-108.3	97.2	172.3	56.5	0	0	0	0	109.7	G344 S348	G344-T346 PolarHBondContact O-N 3.46Å; G344-T346 VanDerWaalsContact O-N 3.12Å; T346-S348 PolarHBondContact O-N 3.47Å
347	S	25.8	Very low	30.2	Very low	124 Å²	124	130.9 Å²	130.9	87%	0.867	77%	0.771	S	S	*	*			trans	-63.1	114	171.1	-54.1	0	0	0	0	110.3
348	S	36.4	Very low	30.3	Very low	57 Å²	57	131.8 Å²	131.8	40%	0.399	77%	0.769	S	S	.	*			trans	-109.4	123.1	168.3	84.3	0	0	0	0	111	T346 G350 E446	T346-S348 PolarHBondContact O-N 3.47Å; S348-G350 PolarHBondContact O-N 2.75Å; S348-E446 PolarHBondContact OG-OE1 2.96Å; S348-E446 VanDerWaalsContact OG-OE1 3.13Å
349	N	28.8	Very low	30.1	Very low	113 Å²	113	129.7 Å²	129.7	60%	0.604	76%	0.764	S	S	*	*			trans	-82.5	91	-178.8	-87	-14.9	0	0	0	110.7	F351	N349-F351 HydrophobicContact CB-CD2 4.2Å; N349-F351 HydrophobicContact CB-CE2 4.17Å; N349-F351 PolarHBondContact O-N 2.94Å; N349-F351 VanDerWaalsContact O-N 3.17Å
350	G	27.7	Very low	30.6	Very low	77 Å²	77	127.5 Å²	127.5	79%	0.794	76%	0.762	S	S	*	*			trans	-79	85.3	174.6	0	0	0	0	0	113.5	S348	S348-G350 PolarHBondContact O-N 2.75Å
351	F	34	Very low	30.5	Very low	178 Å²	178	130.6 Å²	130.6	78%	0.781	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-92	121.8	172	-78.5	-76.4	0	0	0	113	N349	N349-F351 HydrophobicContact CB-CD2 4.2Å; N349-F351 HydrophobicContact CB-CE2 4.17Å; N349-F351 PolarHBondContact O-N 2.94Å; N349-F351 VanDerWaalsContact O-N 3.17Å
352	L	28.9	Very low	31.1	Very low	178 Å²	178	131.9 Å²	131.9	93%	0.932	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-70.9	125.3	172.1	-69.4	159.3	0	0	0	110.1
353	N	37.5	Very low	31.2	Very low	120 Å²	120	138.5 Å²	138.5	64%	0.642	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-89.8	121.8	-179.7	-166.9	12.7	0	0	0	111.5
354	G	25.6	Very low	31.6	Very low	69 Å²	69	139.2 Å²	139.2	71%	0.711	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-83.1	129.3	176	0	0	0	0	0	112.3
355	S	36.5	Very low	31.7	Very low	122 Å²	122	141.2 Å²	141.2	85%	0.853	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-92.7	134.7	173.1	44.6	0	0	0	0	111.8
356	S	32.2	Very low	32.1	Very low	121 Å²	121	139.8 Å²	139.8	85%	0.846	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-95.1	150.2	166.3	51.5	0	0	0	0	110.4
357	K	32.6	Very low	32.6	Very low	206 Å²	206	139.3 Å²	139.3	90%	0.896	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-82.2	138.2	-170	-64.5	-178.9	173.7	-173.7	0	112.9
358	H	34.2	Very low	33	Very low	177 Å²	177	142.2 Å²	142.2	82%	0.819	78%	0.776	S	S	*	*			trans	-155.2	152.7	136.4	-134.8	-66.6	0	0	0	111.5
359	D	29.1	Very low	32.9	Very low	132 Å²	132	147.3 Å²	147.3	71%	0.706	80%	0.796	S	S	*	*			trans	-54.6	134.2	-168.6	-51.5	-74.1	0	0	0	116.9
360	H	36.6	Very low	33.3	Very low	180 Å²	180	150.8 Å²	150.8	83%	0.833	81%	0.808	S	S	*	*				-161.4	147.7	116.1	-115.4	-71.4	0	0	0	111.6	M362	H360-M362 PolarHBondContact O-N 2.94Å
361	E	28.8	Very low	33.4	Very low	181 Å²	181	153.3 Å²	153.3	85%	0.846	81%	0.808	S	S	*	*			trans	-65.2	115.2	-173.7	-58.6	164.7	130.6	0	0	113.2
362	M	38.6	Very low	33.3	Very low	179 Å²	179	150.5 Å²	150.5	88%	0.882	80%	0.801	S	S	*	*			trans	-144.7	138	158.4	-79.6	-72	-78.9	0	0	107.4	H360 D364	H360-M362 PolarHBondContact O-N 2.94Å; M362-D364 PolarHBondContact O-N 2.96Å; M362-D364 VanDerWaalsContact O-N 3.14Å
363	E	30.5	Very low	33.2	Very low	209 Å²	209	147.5 Å²	147.5	98%	0.977	80%	0.795	S	S	*	*			trans	-62.7	111.7	-179.4	-65.1	172.9	124.7	0	0	110.8
364	D	35.3	Very low	33	Very low	144 Å²	144	144.5 Å²	144.5	77%	0.77	78%	0.784	S	S	*	*			trans	-100	135.7	169.5	-147.4	-12.5	0	0	0	110	M362 D366	M362-D364 PolarHBondContact O-N 2.96Å; M362-D364 VanDerWaalsContact O-N 3.14Å; D364-D366 PolarHBondContact O-N 3.14Å
365	C	33.1	Very low	33.8	Very low	105 Å²	105	151.1 Å²	151.1	71%	0.709	80%	0.796	S	S	*	*			trans	-101.4	82.6	-176.6	-173.1	0	0	0	0	108.7	T367	C365-T367 PolarHBondContact O-N 3.23Å
366	D	33.6	Very low	34.2	Very low	151 Å²	151	151.9 Å²	151.9	81%	0.807	79%	0.79	S	S	*	*			trans	-59.6	96.7	173.1	-81.4	-41.5	0	0	0	110.1	D364	D364-D366 PolarHBondContact O-N 3.14Å
367	T	38.6	Very low	35.2	Very low	102 Å²	102	156.3 Å²	156.3	63%	0.626	79%	0.788	S	S	*	*			trans	-102.3	94.2	165	-55.2	0	0	0	0	107.7	C365 M369	C365-T367 PolarHBondContact O-N 3.23Å; T367-M369 PolarHBondContact O-N 2.91Å; T367-M369 VanDerWaalsContact O-N 3.1Å
368	E	33.6	Very low	36.8	Very low	185 Å²	185	153.5 Å²	153.5	86%	0.864	77%	0.772	S	S	*	*			trans	-58.6	112.2	168	-64	-174.3	144.8	0	0	108.9	E370	E368-E370 PolarHBondContact O-N 3.48Å
369	M	36.2	Very low	38.6	Very low	165 Å²	165	150.1 Å²	150.1	81%	0.813	76%	0.756	S	S	*	*			trans	-88.1	101.1	175.3	-72	-91.2	-74.3	0	0	108.4	T367 V371	T367-M369 PolarHBondContact O-N 2.91Å; T367-M369 VanDerWaalsContact O-N 3.1Å; M369-V371 PolarHBondContact O-N 3.46Å
370	E	35.3	Very low	40.9	Very low	185 Å²	185	145.5 Å²	145.5	86%	0.864	73%	0.731	S	S	*	*			trans	-55.6	123.9	169.9	-70.8	-171.8	132.2	0	0	110.3	E368 D372	E368-E370 PolarHBondContact O-N 3.48Å; E370-D372 VanDerWaalsContact C-N 3.27Å; E370-D372 PolarHBondContact O-N 2.96Å
371	V	31.6	Very low	42.9	Very low	130 Å²	130	137.1 Å²	137.1	79%	0.788	69%	0.693	S	S	*	*			trans	-81.4	78.2	171.2	-178	0	0	0	0	108.1	M369 S373	M369-V371 PolarHBondContact O-N 3.46Å; V371-S373 PolarHBondContact O-N 3.38Å; V371-S373 VanDerWaalsContact O-N 3.09Å; V371-S373 PolarHBondContact O-OG 2.99Å
372	D	31.3	Very low	45	Very low	120 Å²	120	131.4 Å²	131.4	64%	0.642	68%	0.682	S	S	*	*			trans	-62.9	115.6	174.8	-177.7	32.2	0	0	0	110	E370 S374	E370-D372 VanDerWaalsContact C-N 3.27Å; E370-D372 PolarHBondContact O-N 2.96Å; D372-S374 VanDerWaalsContact C-N 3.3Å; D372-S374 PolarHBondContact O-N 3.24Å; D372-S374 VanDerWaalsContact O-N 3.11Å; D372-S374 PolarHBondContact OD2-OG 3.43Å
373	S	27.5	Very low	46.8	Very low	114 Å²	114	124.5 Å²	124.5	80%	0.797	66%	0.657	S	S	*	*			trans	-89.5	66.9	-175.1	-66.4	0	0	0	0	110.2	V371	V371-S373 PolarHBondContact O-N 3.38Å; V371-S373 VanDerWaalsContact O-N 3.09Å; V371-S373 PolarHBondContact O-OG 2.99Å
374	S	32.8	Very low	49.3	Very low	58 Å²	58	115.6 Å²	115.6	41%	0.406	62%	0.618	S	S	.	*			trans	-127.5	133.9	175.3	67.9	0	0	0	0	112	D372 L376	D372-S374 VanDerWaalsContact C-N 3.3Å; D372-S374 PolarHBondContact O-N 3.24Å; D372-S374 VanDerWaalsContact O-N 3.11Å; D372-S374 PolarHBondContact OD2-OG 3.43Å; S374-L376 PolarHBondContact O-N 3.09Å; S374-L376 WeakPolarHBondContact OG-CD1 3.29Å
375	Q	41.3	Very low	51.8	Low	208 Å²	208	114.6 Å²	114.6	97%	0.972	61%	0.609	S	S	*	*			trans	-76	51.4	178.1	-67.9	179	-18.4	0	0	111.6	R377	Q375-R377 PolarHBondContact O-N 3.33Å
376	L	44.5	Very low	54.5	Low	137 Å²	137	111.8 Å²	111.8	72%	0.717	59%	0.594	S	S	*	*			trans	-58	122.2	168.8	-88.5	156.5	0	0	0	108.7	S374 R378	S374-L376 PolarHBondContact O-N 3.09Å; S374-L376 WeakPolarHBondContact OG-CD1 3.29Å; L376-R378 PolarHBondContact O-N 2.98Å; L376-R378 VanDerWaalsContact O-N 3.07Å
377	R	53.8	Low	57.2	Low	215 Å²	215	104.6 Å²	104.6	81%	0.811	56%	0.555	S	S	*	*			trans	-40.2	117.8	174.8	-95.1	178.7	162.7	177.6	-5.3	109.5	Q375 Q379	Q375-R377 PolarHBondContact O-N 3.33Å; R377-Q379 VanDerWaalsContact C-N 3.29Å; R377-Q379 HydrophobicContact CB-CG 4.26Å; R377-Q379 WeakPolarHBondContact O-CG 3.04Å; R377-Q379 PolarHBondContact O-N 2.65Å
378	R	67.5	Low	59.7	Low	147 Å²	147	101.7 Å²	101.7	56%	0.555	54%	0.535	S	S	*	.			trans	-69.9	86.1	177.8	-67.5	-173.8	176.9	-170.5	-1.2	109.5	L376	L376-R378 PolarHBondContact O-N 2.98Å; L376-R378 VanDerWaalsContact O-N 3.07Å
379	Q	70.4	Confident	62.5	Low	106 Å²	106	98.1 Å²	98.1	50%	0.495	52%	0.518	S	S	.	.			trans	-82.5	147.3	-177.2	-71.1	173.6	27.3	0	0	111.4	R377 C381 G382	R377-Q379 VanDerWaalsContact C-N 3.29Å; R377-Q379 HydrophobicContact CB-CG 4.26Å; R377-Q379 WeakPolarHBondContact O-CG 3.04Å; R377-Q379 PolarHBondContact O-N 2.65Å; Q379-C381 PolarHBondContact O-N 3.15Å; Q379-G382 PolarHBondContact O-N 3.42Å
380	L	78.2	Confident	65.2	Low	35 Å²	35	95 Å²	95	18%	0.183	50%	0.497	C	S	.	.	G	3₁₀ helix	trans	-43.6	124.6	169.5	-80.6	158.8	0	0	0	111.2	V224 G382 G383 L426 P431	V224-L380 HydrophobicContact CG1-CD2 4.01Å; L380-G382 PolarHBondContact O-N 3.45Å; L380-G382 VanDerWaalsContact O-N 3.13Å; L380-G383 PolarHBondContact O-N 3.4Å; L380-L426 HydrophobicContact CD2-CD2 4.06Å; L380-P431 HydrophobicContact CD2-CG 3.46Å; L380-P431 VanDerWaalsContact CD2-CG 3.46Å; L380-P431 HydrophobicContact CG-CG 3.72Å
381	C	78.6	Confident	68	Low	3 Å²	3	86.3 Å²	86.3	2%	0.02	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	52.2	32.2	-180	-52.1	0	0	0	0	114.6	M223 V224 Q379 G383 A387 I388 M391	M223-C381 PolarHBondContact O-SG 3.19Å; V224-C381 PolarHBondContact O-N 2.96Å; Q379-C381 PolarHBondContact O-N 3.15Å; C381-G383 PolarHBondContact O-N 3.08Å; C381-A387 HydrophobicContact CB-CB 3.63Å; C381-I388 HydrophobicContact CB-CG1 4.03Å; C381-M391 PolarHBondContact SG-SD 3.26Å
382	G	73.4	Confident	71	Confident	61 Å²	61	83.7 Å²	83.7	63%	0.629	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	67.2	16.8	-176.5	0	0	0	0	0	114.5	Q379 L380 S384	Q379-G382 PolarHBondContact O-N 3.42Å; L380-G382 PolarHBondContact O-N 3.45Å; L380-G382 VanDerWaalsContact O-N 3.13Å; G382-S384 VanDerWaalsContact C-N 3.35Å; G382-S384 PolarHBondContact O-N 2.91Å
383	G	76.4	Confident	74.1	Confident	35 Å²	35	83.3 Å²	83.3	36%	0.361	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	80.5	5.1	178.5	0	0	0	0	0	115.5	L380 C381	L380-G383 PolarHBondContact O-N 3.4Å; C381-G383 PolarHBondContact O-N 3.08Å
384	S	83.3	Confident	77.4	Confident	22 Å²	22	78.6 Å²	78.6	15%	0.154	40%	0.397	C	S	.	.			trans	-82.6	118.6	178.4	177.5	0	0	0	0	111.9	L234 G382 A386 A387 I388	L234-S384 VanDerWaalsContact O-CB 3.28Å; L234-S384 WeakPolarHBondContact O-CB 3.36Å; L234-S384 PolarHBondContact O-OG 2.75Å; G382-S384 VanDerWaalsContact C-N 3.35Å; G382-S384 PolarHBondContact O-N 2.91Å; S384-A386 VanDerWaalsContact C-N 3.29Å; S384-A386 PolarHBondContact O-N 3.26Å; S384-A387 WeakPolarHBondContact O-CA 3.19Å; S384-A387 WeakPolarHBondContact O-CB 3.37Å; S384-A387 PolarHBondContact O-N 2.96Å; S384-I388 WeakPolarHBondContact O-CG1 3.14Å; S384-I388 PolarHBondContact O-N 3.38Å
385	Q	87	Confident	80.5	Confident	122 Å²	122	76.2 Å²	76.2	57%	0.57	38%	0.382	S	S	*	.	H	α-helix	trans	-54.7	-43.3	176.7	179.5	63.1	21.9	0	0	112.3	A387 I388 E389	Q385-A387 VanDerWaalsContact C-N 3.29Å; Q385-A387 PolarHBondContact O-N 3.02Å; Q385-I388 PolarHBondContact O-N 2.93Å; Q385-E389 PolarHBondContact NE2-OE1 3.27Å; Q385-E389 WeakPolarHBondContact O-CG 3.38Å; Q385-E389 PolarHBondContact O-N 3.39Å
386	A	90.2	Very high	83.1	Confident	47 Å²	47	75 Å²	75	39%	0.388	37%	0.369	S	S	.	.	H	α-helix	trans	-64.9	-34.6	178.1	0	0	0	0	0	112.1	L234 S384 R390	L234-A386 HydrophobicContact CD1-CB 4.28Å; S384-A386 VanDerWaalsContact C-N 3.29Å; S384-A386 PolarHBondContact O-N 3.26Å; A386-R390 WeakPolarHBondContact O-CB 3.24Å; A386-R390 PolarHBondContact O-N 3.22Å
387	A	90.6	Very high	85.7	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-69.5	-40.3	174.8	0	0	0	0	0	112.2	V231 L234 C381 S384 Q385 R390 M391	V231-A387 HydrophobicContact CB-CB 3.84Å; V231-A387 HydrophobicContact CG1-CB 3.89Å; L234-A387 HydrophobicContact CB-CB 4.13Å; C381-A387 HydrophobicContact CB-CB 3.63Å; S384-A387 WeakPolarHBondContact O-CA 3.19Å; S384-A387 WeakPolarHBondContact O-CB 3.37Å; S384-A387 PolarHBondContact O-N 2.96Å; Q385-A387 VanDerWaalsContact C-N 3.29Å; Q385-A387 PolarHBondContact O-N 3.02Å; A387-R390 WeakPolarHBondContact O-CB 3.4Å; A387-R390 PolarHBondContact O-N 3.31Å; A387-M391 WeakPolarHBondContact O-CB 3.41Å; A387-M391 PolarHBondContact O-N 2.94Å
388	I	90.5	Very high	87.7	Confident	41 Å²	41	63.6 Å²	63.6	21%	0.21	32%	0.321	C	S	.	.	H	α-helix	trans	-62.7	-44.3	175.1	-66.6	167.3	0	0	0	110.5	C381 S384 Q385 M391 I392	C381-I388 HydrophobicContact CB-CG1 4.03Å; S384-I388 WeakPolarHBondContact O-CG1 3.14Å; S384-I388 PolarHBondContact O-N 3.38Å; Q385-I388 PolarHBondContact O-N 2.93Å; I388-M391 HydrophobicContact CG2-CE 4.25Å; I388-M391 PolarHBondContact O-N 2.67Å; I388-I392 HydrophobicContact CG2-CD1 3.82Å; I388-I392 HydrophobicContact CG2-CG1 4.48Å; I388-I392 VanDerWaalsContact O-CG1 3.3Å; I388-I392 WeakPolarHBondContact O-CG1 3.46Å; I388-I392 PolarHBondContact O-N 2.65Å
389	E	92.3	Very high	89.1	Confident	109 Å²	109	60 Å²	60	51%	0.509	31%	0.311	S	S	.	.	H	α-helix	trans	-62.6	-43.1	176.1	-73.5	171.5	-165.5	0	0	112.1	Q385 I392 H393	Q385-E389 PolarHBondContact NE2-OE1 3.27Å; Q385-E389 WeakPolarHBondContact O-CG 3.38Å; Q385-E389 PolarHBondContact O-N 3.39Å; E389-I392 PolarHBondContact O-N 2.77Å; E389-H393 PolarHBondContact O-N 3.4Å
390	R	93.5	Very high	90.4	Very high	99 Å²	99	57.6 Å²	57.6	37%	0.374	31%	0.309	S	S	.	.	H	α-helix	trans	-55.5	-49.4	171.2	-108.9	-72.2	-155.2	149.6	16.1	112.4	M223 E230 V231 L234 A386 A387 H393 F394	M223-R390 HydrophobicContact CE-CB 4.27Å; E230-R390 VanDerWaalsContact CD-NH2 3.34Å; E230-R390 IonicContact OE1-CZ 3.54Å; E230-R390 IonicContact OE1-NH1 2.7Å; E230-R390 PolarHBondContact OE1-NH1 3.44Å; E230-R390 IonicContact OE1-NH2 3.55Å; E230-R390 IonicContact OE2-CZ 3.27Å; E230-R390 VanDerWaalsContact OE2-CZ 3.27Å; E230-R390 IonicContact OE2-NH1 3.26Å; E230-R390 PolarHBondContact OE2-NH1 3.46Å; E230-R390 IonicContact OE2-NH2 2.65Å; E230-R390 PolarHBondContact OE2-NH2 3.29Å; V231-R390 HydrophobicContact CG1-CB 4.45Å; L234-R390 HydrophobicContact CD1-CB 4.39Å; L234-R390 HydrophobicContact CD1-CG 3.9Å; A386-R390 WeakPolarHBondContact O-CB 3.24Å; A386-R390 PolarHBondContact O-N 3.22Å; A387-R390 WeakPolarHBondContact O-CB 3.4Å; A387-R390 PolarHBondContact O-N 3.31Å; R390-H393 PolarHBondContact O-N 2.89Å; R390-F394 WeakPolarHBondContact O-CB 3.39Å; R390-F394 PolarHBondContact O-N 2.89Å
391	M	94.1	Very high	91.2	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.015	31%	0.314	C	S	.	.	H	α-helix	trans	-62.8	-42.3	178.8	175.6	-162.6	63.4	0	0	111.5	F220 M223 V224 C381 A387 I388 F394 G395 L426	F220-M391 HydrophobicContact CD2-CG 4.09Å; F220-M391 HydrophobicContact CE2-CG 3.6Å; F220-M391 HydrophobicContact CE2-SD 4.42Å; F220-M391 HydrophobicContact CZ-CG 4.18Å; F220-M391 HydrophobicContact CZ-SD 4.43Å; M223-M391 HydrophobicContact CB-CB 4.39Å; M223-M391 HydrophobicContact CB-CG 4.28Å; M223-M391 HydrophobicContact CE-CB 4.27Å; V224-M391 HydrophobicContact CB-SD 4.26Å; V224-M391 HydrophobicContact CG2-CG 4.43Å; V224-M391 HydrophobicContact CG2-SD 3.47Å; V224-M391 WeakPolarHBondContact CG2-SD 3.42Å; C381-M391 PolarHBondContact SG-SD 3.26Å; A387-M391 WeakPolarHBondContact O-CB 3.41Å; A387-M391 PolarHBondContact O-N 2.94Å; I388-M391 HydrophobicContact CG2-CE 4.25Å; I388-M391 PolarHBondContact O-N 2.67Å; M391-F394 PolarHBondContact O-N 2.93Å; M391-G395 PolarHBondContact O-N 3.37Å; M391-L426 HydrophobicContact CE-CD2 3.42Å; M391-L426 VanDerWaalsContact CE-CD2 3.42Å; M391-L426 HydrophobicContact SD-CD2 3.72Å
392	I	94.1	Very high	92.1	Very high	76 Å²	76	59.7 Å²	59.7	39%	0.39	32%	0.32	S	S	.	.	H	α-helix	trans	-65.1	-40.3	177.2	-70.4	168.2	0	0	0	111.1	I388 E389 G395 R396	I388-I392 HydrophobicContact CG2-CD1 3.82Å; I388-I392 HydrophobicContact CG2-CG1 4.48Å; I388-I392 VanDerWaalsContact O-CG1 3.3Å; I388-I392 WeakPolarHBondContact O-CG1 3.46Å; I388-I392 PolarHBondContact O-N 2.65Å; E389-I392 PolarHBondContact O-N 2.77Å; I392-G395 PolarHBondContact O-N 3.19Å; I392-R396 WeakPolarHBondContact O-CG 3.33Å; I392-R396 PolarHBondContact O-N 3.1Å
393	H	96.1	Very high	93.1	Very high	112 Å²	112	60.5 Å²	60.5	52%	0.519	31%	0.308	S	S	.	.	H	α-helix	trans	-60.1	-51.7	174	-171.8	-79.4	0	0	0	111.1	E389 R390 G395 R396 E397	E389-H393 PolarHBondContact O-N 3.4Å; R390-H393 PolarHBondContact O-N 2.89Å; H393-G395 VanDerWaalsContact C-N 3.28Å; H393-G395 PolarHBondContact O-N 2.84Å; H393-R396 WeakPolarHBondContact O-CB 3.44Å; H393-R396 PolarHBondContact O-N 3.46Å; H393-E397 IonicContact CE1-OE1 2.62Å; H393-E397 PolarHBondContact CE1-OE1 3.38Å; H393-E397 IonicContact CE1-OE2 3.98Å; H393-E397 VanDerWaalsContact ND1-CD 3.28Å; H393-E397 IonicContact ND1-OE1 3.68Å; H393-E397 IonicContact ND1-OE2 2.98Å; H393-E397 PolarHBondContact ND1-OE2 3.11Å; H393-E397 PolarHBondContact O-N 3.46Å; H393-E397 VanDerWaalsContact O-N 3.14Å
394	F	97	Very high	94.1	Very high	14 Å²	14	62.7 Å²	62.7	6%	0.061	31%	0.309	C	S	.	.	H	α-helix	trans	-58.3	-39.6	178.2	-171.8	-78.9	0	0	0	112.3	K216 Q219 F220 M223 R390 M391 R396 E397 L398	K216-F394 HydrophobicContact CB-CZ 4.25Å; K216-F394 HydrophobicContact CD-CE2 3.99Å; K216-F394 HydrophobicContact CD-CZ 3.5Å; K216-F394 VanDerWaalsContact O-CE1 3.3Å; K216-F394 WeakPolarHBondContact O-CE1 3.48Å; Q219-F394 HydrophobicContact CB-CE1 4.39Å; Q219-F394 HydrophobicContact CB-CZ 3.83Å; Q219-F394 HydrophobicContact CG-CE2 4.09Å; Q219-F394 HydrophobicContact CG-CZ 3.77Å; Q219-F394 VanDerWaalsContact OE1-CE2 3.29Å; Q219-F394 VanDerWaalsContact OE1-CZ 3.3Å; F220-F394 HydrophobicContact CB-CD1 3.96Å; F220-F394 HydrophobicContact CB-CE1 3.84Å; F220-F394 HydrophobicContact CD2-CD1 4.09Å; M223-F394 HydrophobicContact CE-CB 3.97Å; M223-F394 HydrophobicContact CE-CD2 4.49Å; M223-F394 HydrophobicContact CE-CG 4.3Å; M223-F394 HydrophobicContact SD-CB 3.94Å; M223-F394 HydrophobicContact SD-CD1 4Å; M223-F394 HydrophobicContact SD-CD2 3.88Å; M223-F394 HydrophobicContact SD-CE1 4.47Å; M223-F394 HydrophobicContact SD-CE2 4.33Å; M223-F394 HydrophobicContact SD-CG 3.67Å; R390-F394 WeakPolarHBondContact O-CB 3.39Å; R390-F394 PolarHBondContact O-N 2.89Å; M391-F394 PolarHBondContact O-N 2.93Å; F394-R396 VanDerWaalsContact C-N 3.29Å; F394-R396 PolarHBondContact O-N 3.07Å; F394-E397 WeakPolarHBondContact CA-OE2 3.45Å; F394-E397 PolarHBondContact O-N 2.81Å; F394-L398 HydrophobicContact CE1-CD2 4.5Å; F394-L398 WeakPolarHBondContact O-CB 3.3Å; F394-L398 PolarHBondContact O-N 2.88Å
395	G	97.3	Very high	94.6	Very high	9 Å²	9	62.3 Å²	62.3	9%	0.093	31%	0.305	C	S	.	.	H	α-helix	trans	-60	-35.5	174.4	0	0	0	0	0	113.3	M391 I392 H393 L398 Q399 F423	M391-G395 PolarHBondContact O-N 3.37Å; I392-G395 PolarHBondContact O-N 3.19Å; H393-G395 VanDerWaalsContact C-N 3.28Å; H393-G395 PolarHBondContact O-N 2.84Å; G395-L398 PolarHBondContact O-N 3.32Å; G395-Q399 PolarHBondContact O-N 3.01Å; G395-F423 WeakPolarHBondContact O-CZ 3.44Å
396	R	97.4	Very high	95	Very high	183 Å²	183	63.7 Å²	63.7	69%	0.691	31%	0.305	S	S	*	.	H	α-helix	trans	-70.1	-40.8	174.7	-65.9	172.7	-176.8	-80.7	-0.3	112	I392 H393 F394 L398 Q399 A400	I392-R396 WeakPolarHBondContact O-CG 3.33Å; I392-R396 PolarHBondContact O-N 3.1Å; H393-R396 WeakPolarHBondContact O-CB 3.44Å; H393-R396 PolarHBondContact O-N 3.46Å; F394-R396 VanDerWaalsContact C-N 3.29Å; F394-R396 PolarHBondContact O-N 3.07Å; R396-L398 VanDerWaalsContact C-N 3.32Å; R396-Q399 PolarHBondContact O-N 2.96Å; R396-A400 PolarHBondContact O-N 3.42Å
397	E	97.3	Very high	95.2	Very high	108 Å²	108	68.6 Å²	68.6	51%	0.505	31%	0.313	S	S	.	.	H	α-helix	trans	-62.8	-40.7	174.6	-65.1	173.4	121.1	0	0	111.2	H393 F394 A400 M401	H393-E397 IonicContact CE1-OE1 2.62Å; H393-E397 PolarHBondContact CE1-OE1 3.38Å; H393-E397 IonicContact CE1-OE2 3.98Å; H393-E397 VanDerWaalsContact ND1-CD 3.28Å; H393-E397 IonicContact ND1-OE1 3.68Å; H393-E397 IonicContact ND1-OE2 2.98Å; H393-E397 PolarHBondContact ND1-OE2 3.11Å; H393-E397 PolarHBondContact O-N 3.46Å; H393-E397 VanDerWaalsContact O-N 3.14Å; F394-E397 WeakPolarHBondContact CA-OE2 3.45Å; F394-E397 PolarHBondContact O-N 2.81Å; E397-A400 PolarHBondContact O-N 3.23Å; E397-M401 WeakPolarHBondContact O-CB 3.5Å; E397-M401 PolarHBondContact O-N 3.34Å
398	L	96.7	Very high	95.3	Very high	4 Å²	4	73.7 Å²	73.7	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-66.6	-39.6	176.8	-174.1	62.6	0	0	0	112.7	F213 K216 V217 F220 F394 G395 R396 M401 S402 L419 F423	F213-L398 HydrophobicContact CD2-CD1 3.89Å; F213-L398 HydrophobicContact CE2-CD1 3.67Å; F213-L398 HydrophobicContact CE2-CG 4.26Å; F213-L398 HydrophobicContact CZ-CD1 4.48Å; K216-L398 HydrophobicContact CB-CD1 3.78Å; V217-L398 HydrophobicContact CB-CD2 4.39Å; V217-L398 HydrophobicContact CG2-CD1 3.96Å; V217-L398 HydrophobicContact CG2-CD2 4.02Å; V217-L398 HydrophobicContact CG2-CG 4.37Å; F220-L398 HydrophobicContact CB-CD2 3.92Å; F220-L398 HydrophobicContact CG-CD2 4.32Å; F394-L398 HydrophobicContact CE1-CD2 4.5Å; F394-L398 WeakPolarHBondContact O-CB 3.3Å; F394-L398 PolarHBondContact O-N 2.88Å; G395-L398 PolarHBondContact O-N 3.32Å; R396-L398 VanDerWaalsContact C-N 3.32Å; L398-M401 PolarHBondContact O-N 2.96Å; L398-S402 PolarHBondContact O-N 2.91Å; L398-L419 HydrophobicContact CD2-CD1 3.66Å; L398-L419 HydrophobicContact CG-CD1 3.66Å; L398-F423 HydrophobicContact CD2-CE1 4.14Å; L398-F423 HydrophobicContact CD2-CZ 4.42Å
399	Q	96.9	Very high	95.3	Very high	72 Å²	72	75.7 Å²	75.7	34%	0.336	36%	0.357	S	S	.	.	H	α-helix	trans	-61	-46.8	171.6	176.5	62.2	28.6	0	0	111.2	G395 R396 M401 S402 E403 F423	G395-Q399 PolarHBondContact O-N 3.01Å; R396-Q399 PolarHBondContact O-N 2.96Å; Q399-M401 VanDerWaalsContact C-N 3.32Å; Q399-M401 PolarHBondContact O-N 3.49Å; Q399-S402 WeakPolarHBondContact O-CB 3.3Å; Q399-S402 PolarHBondContact O-N 3.09Å; Q399-S402 VanDerWaalsContact O-N 3.15Å; Q399-E403 PolarHBondContact NE2-OE1 3.18Å; Q399-E403 PolarHBondContact O-N 2.94Å; Q399-F423 HydrophobicContact CB-CE2 4.35Å; Q399-F423 HydrophobicContact CB-CZ 4.43Å
400	A	97.2	Very high	95.3	Very high	55 Å²	55	72.1 Å²	72.1	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-61.5	-39.4	176.6	0	0	0	0	0	112.1	R396 E397 E403 Q404	R396-A400 PolarHBondContact O-N 3.42Å; E397-A400 PolarHBondContact O-N 3.23Å; A400-E403 PolarHBondContact O-N 3.13Å; A400-Q404 WeakPolarHBondContact O-CB 3.38Å; A400-Q404 PolarHBondContact O-N 3.34Å
401	M	96.2	Very high	95.2	Very high	60 Å²	60	77.1 Å²	77.1	30%	0.296	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-41.2	173.1	-174.9	-178.9	-74.8	0	0	112	L212 F213 K216 E397 L398 Q399 E403 Q404 L405	L212-M401 HydrophobicContact CD2-CE 4.44Å; L212-M401 HydrophobicContact CG-CE 4.48Å; F213-M401 HydrophobicContact CB-SD 4.28Å; F213-M401 HydrophobicContact CD2-CB 4.45Å; F213-M401 HydrophobicContact CD2-CG 3.98Å; F213-M401 HydrophobicContact CD2-SD 3.95Å; K216-M401 HydrophobicContact CG-CE 4.38Å; K216-M401 HydrophobicContact CG-SD 4.46Å; E397-M401 WeakPolarHBondContact O-CB 3.5Å; E397-M401 PolarHBondContact O-N 3.34Å; L398-M401 PolarHBondContact O-N 2.96Å; Q399-M401 VanDerWaalsContact C-N 3.32Å; Q399-M401 PolarHBondContact O-N 3.49Å; M401-E403 VanDerWaalsContact C-N 3.32Å; M401-E403 PolarHBondContact O-N 3.42Å; M401-Q404 PolarHBondContact O-N 2.96Å; M401-L405 HydrophobicContact CG-CD1 4.46Å; M401-L405 WeakPolarHBondContact O-CB 3.49Å; M401-L405 PolarHBondContact O-N 3.49Å
402	S	96.3	Very high	95.1	Very high	21 Å²	21	79.9 Å²	79.9	15%	0.147	39%	0.388	C	S	.	.	H	α-helix	trans	-63.9	-37	175	-172.5	0	0	0	0	112.5	L398 Q399 R406	L398-S402 PolarHBondContact O-N 2.91Å; Q399-S402 WeakPolarHBondContact O-CB 3.3Å; Q399-S402 PolarHBondContact O-N 3.09Å; Q399-S402 VanDerWaalsContact O-N 3.15Å; S402-R406 WeakPolarHBondContact O-CB 3.47Å; S402-R406 PolarHBondContact O-N 2.9Å
403	E	95.7	Very high	95.1	Very high	78 Å²	78	82 Å²	82	36%	0.364	41%	0.405	S	S	.	.	H	α-helix	trans	-72.2	-35.8	177.4	-72.7	175.7	-163.9	0	0	112.3	Q399 A400 M401 R406 R407	Q399-E403 PolarHBondContact NE2-OE1 3.18Å; Q399-E403 PolarHBondContact O-N 2.94Å; A400-E403 PolarHBondContact O-N 3.13Å; M401-E403 VanDerWaalsContact C-N 3.32Å; M401-E403 PolarHBondContact O-N 3.42Å; E403-R406 PolarHBondContact O-N 3.04Å; E403-R407 WeakPolarHBondContact O-CG 3.16Å; E403-R407 PolarHBondContact O-N 2.82Å; E403-R407 VanDerWaalsContact O-N 3.14Å; E403-R407 PolarHBondContact O-NE 3.43Å
404	Q	95.5	Very high	95	Very high	82 Å²	82	79.4 Å²	79.4	38%	0.383	40%	0.403	S	S	.	.	H	α-helix	trans	-61.5	-54	170.7	-174.2	67.8	36.5	0	0	110.9	A400 M401 R406 R407 D408	A400-Q404 WeakPolarHBondContact O-CB 3.38Å; A400-Q404 PolarHBondContact O-N 3.34Å; M401-Q404 PolarHBondContact O-N 2.96Å; Q404-R406 PolarHBondContact O-N 3.47Å; Q404-R407 WeakPolarHBondContact O-CA 3.11Å; Q404-R407 WeakPolarHBondContact O-CB 3.47Å; Q404-R407 PolarHBondContact O-N 3.31Å; Q404-R407 VanDerWaalsContact OE1-CZ 3.23Å; Q404-D408 WeakPolarHBondContact CG-OD2 3.11Å; Q404-D408 VanDerWaalsContact NE2-CG 3.28Å; Q404-D408 PolarHBondContact NE2-OD1 3.39Å; Q404-D408 PolarHBondContact NE2-OD2 3.08Å; Q404-D408 PolarHBondContact O-N 3.12Å
405	L	95.1	Very high	94.8	Very high	14 Å²	14	79.3 Å²	79.3	7%	0.073	40%	0.403	C	S	.	.	H	α-helix	trans	-55.6	-38.8	176.2	-91.8	165.7	0	0	0	113	P209 F213 M401 R407 D408 C409	P209-L405 HydrophobicContact CB-CD2 3.96Å; P209-L405 HydrophobicContact CG-CD2 4.19Å; F213-L405 HydrophobicContact CB-CD1 3.48Å; F213-L405 VanDerWaalsContact CB-CD1 3.48Å; F213-L405 HydrophobicContact CD1-CD1 4.48Å; F213-L405 HydrophobicContact CD2-CD1 3.89Å; F213-L405 HydrophobicContact CG-CD1 3.7Å; M401-L405 HydrophobicContact CG-CD1 4.46Å; M401-L405 WeakPolarHBondContact O-CB 3.49Å; M401-L405 PolarHBondContact O-N 3.49Å; L405-R407 VanDerWaalsContact C-N 3.32Å; L405-R407 PolarHBondContact O-N 2.87Å; L405-D408 PolarHBondContact O-N 3.43Å; L405-C409 WeakPolarHBondContact O-CA 3.03Å; L405-C409 WeakPolarHBondContact O-CB 3.38Å; L405-C409 PolarHBondContact O-N 3Å
406	R	94.8	Very high	94.7	Very high	151 Å²	151	84.8 Å²	84.8	57%	0.57	43%	0.425	S	S	*	.	H	α-helix	trans	-66.2	-33	176.4	-174.2	-179.9	64.4	165.6	-2.9	112.9	S402 E403 Q404 G410	S402-R406 WeakPolarHBondContact O-CB 3.47Å; S402-R406 PolarHBondContact O-N 2.9Å; E403-R406 PolarHBondContact O-N 3.04Å; Q404-R406 PolarHBondContact O-N 3.47Å; R406-G410 WeakPolarHBondContact CA-O 3.45Å; R406-G410 CarbonylContact O-C 3.41Å; R406-G410 VanDerWaalsContact O-CA 3.25Å; R406-G410 WeakPolarHBondContact O-CA 3.5Å; R406-G410 PolarHBondContact O-N 2.95Å
407	R	94.6	Very high	94.6	Very high	150 Å²	150	82.3 Å²	82.3	57%	0.566	42%	0.419	S	S	*	.	H	α-helix	trans	-75.4	-40.2	176.2	-75.7	-178	-79.8	99.3	-7.1	111.8	E403 Q404 L405	E403-R407 WeakPolarHBondContact O-CG 3.16Å; E403-R407 PolarHBondContact O-N 2.82Å; E403-R407 VanDerWaalsContact O-N 3.14Å; E403-R407 PolarHBondContact O-NE 3.43Å; Q404-R407 WeakPolarHBondContact O-CA 3.11Å; Q404-R407 WeakPolarHBondContact O-CB 3.47Å; Q404-R407 PolarHBondContact O-N 3.31Å; Q404-R407 VanDerWaalsContact OE1-CZ 3.23Å; L405-R407 VanDerWaalsContact C-N 3.32Å; L405-R407 PolarHBondContact O-N 2.87Å
408	D	93.5	Very high	94.5	Very high	106 Å²	106	79.8 Å²	79.8	57%	0.567	41%	0.408	S	S	*	.	H	α-helix	trans	-86.4	-34.1	-172.5	-58.1	-13.5	0	0	0	113.1	Q404 L405	Q404-D408 WeakPolarHBondContact CG-OD2 3.11Å; Q404-D408 VanDerWaalsContact NE2-CG 3.28Å; Q404-D408 PolarHBondContact NE2-OD1 3.39Å; Q404-D408 PolarHBondContact NE2-OD2 3.08Å; Q404-D408 PolarHBondContact O-N 3.12Å; L405-D408 PolarHBondContact O-N 3.43Å
409	C	90.4	Very high	94.4	Very high	84 Å²	84	80.1 Å²	80.1	57%	0.568	41%	0.409	S	S	*	.	H	α-helix	trans	-119.3	0.3	-174.9	-56.7	0	0	0	0	114.1	L405	L405-C409 WeakPolarHBondContact O-CA 3.03Å; L405-C409 WeakPolarHBondContact O-CB 3.38Å; L405-C409 PolarHBondContact O-N 3Å
410	G	91.9	Very high	94.4	Very high	33 Å²	33	82.8 Å²	82.8	34%	0.34	42%	0.42	S	S	.	.			trans	80.5	-167.8	-178.5	0	0	0	0	0	114.7	R406 N412	R406-G410 WeakPolarHBondContact CA-O 3.45Å; R406-G410 CarbonylContact O-C 3.41Å; R406-G410 VanDerWaalsContact O-CA 3.25Å; R406-G410 WeakPolarHBondContact O-CA 3.5Å; R406-G410 PolarHBondContact O-N 2.95Å; G410-N412 PolarHBondContact O-N 3.18Å
411	K	90.8	Very high	94.3	Very high	204 Å²	204	81.8 Å²	81.8	89%	0.887	41%	0.407	S	S	*	.			trans	-70.9	115.9	-177.1	-67.6	-176.1	-179.5	-178.3	0	110.9
412	N	92.4	Very high	94.3	Very high	61 Å²	61	78.9 Å²	78.9	33%	0.326	39%	0.393	S	S	.	.			trans	-110.8	111.4	169.1	-178.6	-23.9	0	0	0	109.8	N210 G410 A414 N415 K416	N210-N412 PolarHBondContact OD1-ND2 3.25Å; G410-N412 PolarHBondContact O-N 3.18Å; N412-A414 WeakPolarHBondContact OD1-CB 3.31Å; N412-A414 PolarHBondContact OD1-N 2.83Å; N412-N415 HydrophobicContact CB-CB 4.09Å; N412-N415 VanDerWaalsContact CG-CG 3.42Å; N412-N415 PolarHBondContact ND2-ND2 3.17Å; N412-N415 PolarHBondContact ND2-OD1 3.07Å; N412-N415 PolarHBondContact OD1-N 3.11Å; N412-K416 PolarHBondContact O-N 3.42Å; N412-K416 VanDerWaalsContact O-N 3.14Å
413	T	93.9	Very high	94.3	Very high	120 Å²	120	80.6 Å²	80.6	74%	0.736	40%	0.397	S	S	*	.	H	α-helix	trans	-70.1	-36.2	-178.1	48.2	0	0	0	0	112.7	K416 K417	T413-K416 PolarHBondContact O-N 3.03Å; T413-K417 WeakPolarHBondContact O-CB 3.49Å; T413-K417 PolarHBondContact O-N 2.89Å
414	A	93.5	Very high	94.3	Very high	58 Å²	58	78.8 Å²	78.8	48%	0.479	39%	0.394	S	S	.	.	H	α-helix	trans	-64.1	-45	176.5	0	0	0	0	0	111.1	N412 K417 M418	N412-A414 WeakPolarHBondContact OD1-CB 3.31Å; N412-A414 PolarHBondContact OD1-N 2.83Å; A414-K417 PolarHBondContact O-N 3.1Å; A414-M418 WeakPolarHBondContact O-CB 3.47Å; A414-M418 PolarHBondContact O-N 3.14Å
415	N	93.6	Very high	94.3	Very high	12 Å²	12	74.9 Å²	74.9	6%	0.064	38%	0.375	C	S	.	.	H	α-helix	trans	-62.6	-44.6	175.3	-68.3	10	0	0	0	111.6	N210 F213 N412 K417 M418 L419	N210-N415 PolarHBondContact OD1-ND2 3.21Å; F213-N415 HydrophobicContact CD1-CB 4.01Å; F213-N415 HydrophobicContact CE1-CB 3.58Å; F213-N415 HydrophobicContact CZ-CB 4.4Å; N412-N415 HydrophobicContact CB-CB 4.09Å; N412-N415 VanDerWaalsContact CG-CG 3.42Å; N412-N415 PolarHBondContact ND2-ND2 3.17Å; N412-N415 PolarHBondContact ND2-OD1 3.07Å; N412-N415 PolarHBondContact OD1-N 3.11Å; N415-K417 VanDerWaalsContact C-N 3.32Å; N415-K417 PolarHBondContact O-N 3Å; N415-M418 PolarHBondContact O-N 3Å; N415-L419 WeakPolarHBondContact O-CB 3.29Å; N415-L419 PolarHBondContact O-N 3.04Å
416	K	94.2	Very high	94.2	Very high	125 Å²	125	77.5 Å²	77.5	54%	0.543	39%	0.389	S	S	.	.	H	α-helix	trans	-57.1	-45.3	175.4	-176.5	-168.4	173.6	-164.3	0	110.9	E335 N412 T413 K420	E335-K416 IonicContact OE1-NZ 3.52Å; E335-K416 PolarHBondContact OE1-NZ 3.42Å; N412-K416 PolarHBondContact O-N 3.42Å; N412-K416 VanDerWaalsContact O-N 3.14Å; T413-K416 PolarHBondContact O-N 3.03Å; K416-K420 WeakPolarHBondContact O-CB 3.27Å; K416-K420 PolarHBondContact O-N 3.14Å; K416-K420 VanDerWaalsContact O-N 3.09Å
417	K	95.4	Very high	94	Very high	130 Å²	130	74.2 Å²	74.2	57%	0.565	39%	0.394	S	S	*	.	H	α-helix	trans	-64.8	-54	179.1	-174.6	-177.7	-173.8	-62	0	111.3	T413 A414 N415 L419 K420 D421	T413-K417 WeakPolarHBondContact O-CB 3.49Å; T413-K417 PolarHBondContact O-N 2.89Å; A414-K417 PolarHBondContact O-N 3.1Å; N415-K417 VanDerWaalsContact C-N 3.32Å; N415-K417 PolarHBondContact O-N 3Å; K417-L419 VanDerWaalsContact C-N 3.26Å; K417-L419 PolarHBondContact O-N 3.16Å; K417-K420 PolarHBondContact O-N 3.04Å; K417-K420 VanDerWaalsContact O-N 3.09Å; K417-D421 WeakPolarHBondContact CG-OD2 3.32Å; K417-D421 IonicContact NZ-OD2 2.82Å; K417-D421 PolarHBondContact NZ-OD2 2.9Å; K417-D421 WeakPolarHBondContact O-CB 3.29Å; K417-D421 PolarHBondContact O-N 3.38Å
418	M	95	Very high	93.8	Very high	56 Å²	56	71.6 Å²	71.6	28%	0.276	39%	0.385	S	S	.	.	H	α-helix	trans	-56.3	-41.1	-177.9	-160.7	-162.9	-60.4	0	0	112	T214 V217 A414 N415 A422	T214-M418 HydrophobicContact CG2-CE 3.89Å; T214-M418 HydrophobicContact CG2-SD 4.11Å; V217-M418 HydrophobicContact CB-CG 4.33Å; V217-M418 HydrophobicContact CB-SD 3.76Å; V217-M418 HydrophobicContact CG1-CG 3.78Å; V217-M418 HydrophobicContact CG1-SD 3.89Å; V217-M418 HydrophobicContact CG2-SD 3.99Å; A414-M418 WeakPolarHBondContact O-CB 3.47Å; A414-M418 PolarHBondContact O-N 3.14Å; N415-M418 PolarHBondContact O-N 3Å; M418-A422 VanDerWaalsContact O-CB 3.28Å; M418-A422 WeakPolarHBondContact O-CB 3.48Å; M418-A422 PolarHBondContact O-N 3.49Å
419	L	96	Very high	93.4	Very high	10 Å²	10	72.2 Å²	72.2	5%	0.052	40%	0.397	C	S	.	.	H	α-helix	trans	-68.6	-43.8	176.6	-168.4	66.5	0	0	0	112.7	F213 V217 L398 N415 K417 A422 F423	F213-L419 HydrophobicContact CZ-CB 4.2Å; F213-L419 HydrophobicContact CZ-CD1 4.13Å; F213-L419 HydrophobicContact CZ-CD2 4.32Å; F213-L419 HydrophobicContact CZ-CG 4.47Å; V217-L419 HydrophobicContact CG2-CD1 4.39Å; L398-L419 HydrophobicContact CD2-CD1 3.66Å; L398-L419 HydrophobicContact CG-CD1 3.66Å; N415-L419 WeakPolarHBondContact O-CB 3.29Å; N415-L419 PolarHBondContact O-N 3.04Å; K417-L419 VanDerWaalsContact C-N 3.26Å; K417-L419 PolarHBondContact O-N 3.16Å; L419-A422 PolarHBondContact O-N 2.89Å; L419-F423 HydrophobicContact CD1-CD1 4.42Å; L419-F423 HydrophobicContact CD1-CD2 4.27Å; L419-F423 HydrophobicContact CD1-CE1 3.83Å; L419-F423 HydrophobicContact CD1-CE2 3.65Å; L419-F423 HydrophobicContact CD1-CZ 3.41Å; L419-F423 VanDerWaalsContact CD1-CZ 3.41Å; L419-F423 HydrophobicContact CD2-CE2 4.04Å; L419-F423 HydrophobicContact CG-CD2 4.01Å; L419-F423 HydrophobicContact CG-CE2 3.64Å; L419-F423 HydrophobicContact CG-CZ 3.97Å; L419-F423 WeakPolarHBondContact O-CB 2.92Å; L419-F423 WeakPolarHBondContact O-CG 3.16Å; L419-F423 PolarHBondContact O-N 3.35Å
420	K	95.9	Very high	93.4	Very high	128 Å²	128	70.3 Å²	70.3	56%	0.557	38%	0.382	S	S	*	.	H	α-helix	trans	-60.7	-45.3	176.5	-176.8	-175.9	179	-175.8	0	111	K416 K417 S424	K416-K420 WeakPolarHBondContact O-CB 3.27Å; K416-K420 PolarHBondContact O-N 3.14Å; K416-K420 VanDerWaalsContact O-N 3.09Å; K417-K420 PolarHBondContact O-N 3.04Å; K417-K420 VanDerWaalsContact O-N 3.09Å; K420-S424 WeakPolarHBondContact O-CB 3.21Å; K420-S424 PolarHBondContact O-N 2.94Å; K420-S424 PolarHBondContact O-OG 3.43Å
421	D	95.3	Very high	93.3	Very high	34 Å²	34	69 Å²	69	18%	0.182	37%	0.367	C	S	.	.	H	α-helix	trans	-66.5	-43.8	-179.6	-63.1	-13	0	0	0	110.7	K417 S424 Q439	K417-D421 WeakPolarHBondContact CG-OD2 3.32Å; K417-D421 IonicContact NZ-OD2 2.82Å; K417-D421 PolarHBondContact NZ-OD2 2.9Å; K417-D421 WeakPolarHBondContact O-CB 3.29Å; K417-D421 PolarHBondContact O-N 3.38Å; D421-S424 PolarHBondContact O-N 2.89Å; D421-Q439 PolarHBondContact O-NE2 2.95Å
422	A	96.6	Very high	93.4	Very high	0 Å²	0	63 Å²	63	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-62.5	-47.6	176.5	0	0	0	0	0	112.2	V217 F220 I221 M418 L419 S424 L425	V217-A422 HydrophobicContact CG1-CB 3.65Å; F220-A422 HydrophobicContact CD1-CB 4.14Å; F220-A422 HydrophobicContact CE1-CB 4.48Å; I221-A422 HydrophobicContact CD1-CB 3.97Å; I221-A422 HydrophobicContact CG1-CB 3.77Å; M418-A422 VanDerWaalsContact O-CB 3.28Å; M418-A422 WeakPolarHBondContact O-CB 3.48Å; M418-A422 PolarHBondContact O-N 3.49Å; L419-A422 PolarHBondContact O-N 2.89Å; A422-S424 VanDerWaalsContact C-N 3.29Å; A422-S424 PolarHBondContact O-N 2.93Å; A422-L425 WeakPolarHBondContact O-CB 3.45Å; A422-L425 PolarHBondContact O-N 3.25Å
423	F	97	Very high	93.4	Very high	56 Å²	56	66.6 Å²	66.6	25%	0.246	36%	0.358	C	S	.	.	H	α-helix	trans	-68.8	-25.7	178	-69.1	-12.6	0	0	0	113.3	F220 G395 L398 Q399 L419 L425 L426	F220-F423 HydrophobicContact CD1-CD1 4.26Å; F220-F423 HydrophobicContact CD1-CE1 4.4Å; F220-F423 HydrophobicContact CD2-CE1 4.44Å; F220-F423 AromaticContact CE1-CD1 3.72Å; F220-F423 HydrophobicContact CE1-CD1 3.72Å; F220-F423 HydrophobicContact CE1-CE1 4.18Å; F220-F423 HydrophobicContact CE2-CD1 4.36Å; F220-F423 HydrophobicContact CE2-CE1 4.19Å; F220-F423 AromaticContact CZ-CD1 3.77Å; F220-F423 HydrophobicContact CZ-CD1 3.77Å; F220-F423 HydrophobicContact CZ-CE1 4.06Å; G395-F423 WeakPolarHBondContact O-CZ 3.44Å; L398-F423 HydrophobicContact CD2-CE1 4.14Å; L398-F423 HydrophobicContact CD2-CZ 4.42Å; Q399-F423 HydrophobicContact CB-CE2 4.35Å; Q399-F423 HydrophobicContact CB-CZ 4.43Å; L419-F423 HydrophobicContact CD1-CD1 4.42Å; L419-F423 HydrophobicContact CD1-CD2 4.27Å; L419-F423 HydrophobicContact CD1-CE1 3.83Å; L419-F423 HydrophobicContact CD1-CE2 3.65Å; L419-F423 HydrophobicContact CD1-CZ 3.41Å; L419-F423 VanDerWaalsContact CD1-CZ 3.41Å; L419-F423 HydrophobicContact CD2-CE2 4.04Å; L419-F423 HydrophobicContact CG-CD2 4.01Å; L419-F423 HydrophobicContact CG-CE2 3.64Å; L419-F423 HydrophobicContact CG-CZ 3.97Å; L419-F423 WeakPolarHBondContact O-CB 2.92Å; L419-F423 WeakPolarHBondContact O-CG 3.16Å; L419-F423 PolarHBondContact O-N 3.35Å; F423-L425 PolarHBondContact O-N 3.14Å; F423-L426 WeakPolarHBondContact O-CB 3.28Å; F423-L426 PolarHBondContact O-N 3.23Å
424	S	96	Very high	93.3	Very high	41 Å²	41	61.4 Å²	61.4	29%	0.287	33%	0.327	S	S	.	.	H	α-helix	trans	-63.1	-22.8	176	-64.5	0	0	0	0	113	K420 D421 A422 L426 A427 Y428	K420-S424 WeakPolarHBondContact O-CB 3.21Å; K420-S424 PolarHBondContact O-N 2.94Å; K420-S424 PolarHBondContact O-OG 3.43Å; D421-S424 PolarHBondContact O-N 2.89Å; A422-S424 VanDerWaalsContact C-N 3.29Å; A422-S424 PolarHBondContact O-N 2.93Å; S424-L426 PolarHBondContact O-N 3.21Å; S424-A427 WeakPolarHBondContact O-CB 3.49Å; S424-A427 PolarHBondContact O-N 3.48Å; S424-A427 VanDerWaalsContact O-N 3.15Å; S424-Y428 VanDerWaalsContact O-CD2 3.28Å; S424-Y428 WeakPolarHBondContact O-CD2 3.38Å; S424-Y428 WeakPolarHBondContact O-CE2 3.46Å
425	L	94.6	Very high	93.4	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-59.6	-30.1	172.5	-67.3	165.7	0	0	0	112.6	I221 V224 A422 F423 A427 P431 V436 Q439 L440	I221-L425 HydrophobicContact CG1-CD1 4.24Å; I221-L425 HydrophobicContact CG2-CD1 3.86Å; V224-L425 HydrophobicContact CG1-CB 4.15Å; V224-L425 HydrophobicContact CG1-CD1 4.26Å; A422-L425 WeakPolarHBondContact O-CB 3.45Å; A422-L425 PolarHBondContact O-N 3.25Å; F423-L425 PolarHBondContact O-N 3.14Å; L425-A427 VanDerWaalsContact C-N 3.25Å; L425-A427 PolarHBondContact O-N 3.3Å; L425-P431 HydrophobicContact CB-CB 4.36Å; L425-P431 HydrophobicContact CD2-CB 4.12Å; L425-V436 HydrophobicContact CD2-CG2 3.86Å; L425-V436 HydrophobicContact CG-CG2 4.11Å; L425-Q439 HydrophobicContact CD1-CB 4.43Å; L425-L440 HydrophobicContact CD1-CD2 4.36Å; L425-L440 HydrophobicContact CD2-CD1 4.08Å; L425-L440 HydrophobicContact CD2-CG 4.28Å
426	L	92.2	Very high	93.4	Very high	69 Å²	69	64.5 Å²	64.5	36%	0.361	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-71.9	-16.2	178.7	-59.2	-173	0	0	0	113.8	F220 V224 L380 M391 F423 S424 Y428	F220-L426 HydrophobicContact CZ-CD1 3.95Å; F220-L426 HydrophobicContact CZ-CD2 4.06Å; F220-L426 HydrophobicContact CZ-CG 4.04Å; V224-L426 HydrophobicContact CG2-CD2 4.19Å; L380-L426 HydrophobicContact CD2-CD2 4.06Å; M391-L426 HydrophobicContact CE-CD2 3.42Å; M391-L426 VanDerWaalsContact CE-CD2 3.42Å; M391-L426 HydrophobicContact SD-CD2 3.72Å; F423-L426 WeakPolarHBondContact O-CB 3.28Å; F423-L426 PolarHBondContact O-N 3.23Å; S424-L426 PolarHBondContact O-N 3.21Å; L426-Y428 PolarHBondContact O-N 3.35Å
427	A	92.1	Very high	93.4	Very high	81 Å²	81	58.8 Å²	58.8	67%	0.669	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-76.4	-5.4	-179.1	0	0	0	0	0	113.3	S424 L425	S424-A427 WeakPolarHBondContact O-CB 3.49Å; S424-A427 PolarHBondContact O-N 3.48Å; S424-A427 VanDerWaalsContact O-N 3.15Å; L425-A427 VanDerWaalsContact C-N 3.25Å; L425-A427 PolarHBondContact O-N 3.3Å
428	Y	90.6	Very high	93.4	Very high	95 Å²	95	57.8 Å²	57.8	37%	0.373	32%	0.319	S	S	.	.	S	Bend	trans	-123.2	136.4	-173.4	-59.1	-90.6	0	0	0	111	S424 L426 D430 S434 P435	S424-Y428 VanDerWaalsContact O-CD2 3.28Å; S424-Y428 WeakPolarHBondContact O-CD2 3.38Å; S424-Y428 WeakPolarHBondContact O-CE2 3.46Å; L426-Y428 PolarHBondContact O-N 3.35Å; Y428-D430 PolarHBondContact O-N 2.93Å; Y428-S434 VanDerWaalsContact CG-CB 3.46Å; Y428-P435 VanDerWaalsContact CZ-CD 3.41Å; Y428-P435 WeakPolarHBondContact OH-CD 3.5Å
429	S	85	Confident	93.4	Very high	119 Å²	119	56.1 Å²	56.1	83%	0.832	31%	0.311	S	S	*	.	S	Bend	trans	-64.7	-28.3	178	-41.8	0	0	0	0	113
430	D	88.8	Confident	93.3	Very high	45 Å²	45	55.7 Å²	55.7	24%	0.241	31%	0.308	C	S	.	.	S	Bend	trans	-124.9	101.3	170.3	179.5	-9.2	0	0	0	107.8	Y428 W432 N433	Y428-D430 PolarHBondContact O-N 2.93Å; D430-W432 PolarHBondContact O-N 3.41Å; D430-W432 WeakPolarHBondContact OD1-CB 3.14Å; D430-W432 PolarHBondContact OD1-N 2.82Å; D430-N433 HydrophobicContact CB-CB 4.45Å; D430-N433 PolarHBondContact O-N 3.16Å; D430-N433 PolarHBondContact OD2-ND2 3.48Å
431	P	91.5	Very high	93.3	Very high	4 Å²	4	53 Å²	53	3%	0.026	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-60.5	-26.6	-179.1	-29.2	38.3	0	0	0	114.6	V224 L380 L425 N433 S434 G437 L440	V224-P431 HydrophobicContact CG1-CB 4.05Å; V224-P431 HydrophobicContact CG1-CG 4.04Å; L380-P431 HydrophobicContact CD2-CG 3.46Å; L380-P431 VanDerWaalsContact CD2-CG 3.46Å; L380-P431 HydrophobicContact CG-CG 3.72Å; L425-P431 HydrophobicContact CB-CB 4.36Å; L425-P431 HydrophobicContact CD2-CB 4.12Å; P431-N433 VanDerWaalsContact C-N 3.35Å; P431-S434 WeakPolarHBondContact O-CB 3.49Å; P431-S434 PolarHBondContact O-N 3.36Å; P431-S434 PolarHBondContact O-OG 3.17Å; P431-G437 VanDerWaalsContact O-CA 3.29Å; P431-G437 WeakPolarHBondContact O-CA 3.23Å; P431-L440 HydrophobicContact CB-CD1 3.67Å
432	W	92	Very high	93.4	Very high	80 Å²	80	54.7 Å²	54.7	30%	0.303	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-70.8	-33.5	-179.6	-72.8	88.4	0	0	0	112.2	N225 D430 S434 L440	N225-W432 VanDerWaalsContact OD1-CZ2 3.25Å; N225-W432 WeakPolarHBondContact OD1-CZ2 3.46Å; D430-W432 PolarHBondContact O-N 3.41Å; D430-W432 WeakPolarHBondContact OD1-CB 3.14Å; D430-W432 PolarHBondContact OD1-N 2.82Å; W432-S434 VanDerWaalsContact C-N 3.26Å; W432-S434 PolarHBondContact O-N 3.22Å; W432-L440 HydrophobicContact CD2-CB 4.04Å; W432-L440 HydrophobicContact CD2-CD1 3.95Å; W432-L440 HydrophobicContact CE3-CB 4.03Å; W432-L440 HydrophobicContact CG-CD1 3.95Å; W432-L440 HydrophobicContact CH2-CB 3.78Å; W432-L440 VanDerWaalsContact CH2-O 3.31Å; W432-L440 WeakPolarHBondContact CH2-O 3.33Å; W432-L440 HydrophobicContact CZ2-CB 3.8Å; W432-L440 HydrophobicContact CZ3-CB 3.89Å
433	N	91.9	Very high	93.4	Very high	135 Å²	135	57.2 Å²	57.2	72%	0.722	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-87.3	13.2	176	-77.6	-55.3	0	0	0	113.2	D430 P431	D430-N433 HydrophobicContact CB-CB 4.45Å; D430-N433 PolarHBondContact O-N 3.16Å; D430-N433 PolarHBondContact OD2-ND2 3.48Å; P431-N433 VanDerWaalsContact C-N 3.35Å
434	S	92.9	Very high	93.4	Very high	12 Å²	12	58.2 Å²	58.2	8%	0.084	33%	0.331	C	S	.	.	S	Bend	trans	-85	158.9	175.5	76.2	0	0	0	0	112.6	Y428 P431 W432 V436 G437	Y428-S434 VanDerWaalsContact CG-CB 3.46Å; P431-S434 WeakPolarHBondContact O-CB 3.49Å; P431-S434 PolarHBondContact O-N 3.36Å; P431-S434 PolarHBondContact O-OG 3.17Å; W432-S434 VanDerWaalsContact C-N 3.26Å; W432-S434 PolarHBondContact O-N 3.22Å; S434-V436 PolarHBondContact O-N 2.81Å; S434-V436 PolarHBondContact OG-N 3.43Å; S434-G437 PolarHBondContact O-N 3.19Å; S434-G437 PolarHBondContact OG-N 3.4Å
435	P	94.2	Very high	93.4	Very high	106 Å²	106	57.1 Å²	57.1	69%	0.688	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-12	173.6	-24.3	35.3	0	0	0	115.1	Y428	Y428-P435 VanDerWaalsContact CZ-CD 3.41Å; Y428-P435 WeakPolarHBondContact OH-CD 3.5Å
436	V	93.9	Very high	93.5	Very high	29 Å²	29	61.2 Å²	61.2	18%	0.176	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	16	178.3	-61.4	0	0	0	0	112.2	L425 S434 N438 Q439	L425-V436 HydrophobicContact CD2-CG2 3.86Å; L425-V436 HydrophobicContact CG-CG2 4.11Å; S434-V436 PolarHBondContact O-N 2.81Å; S434-V436 PolarHBondContact OG-N 3.43Å; V436-N438 PolarHBondContact O-N 2.86Å; V436-N438 PolarHBondContact O-OD1 3.46Å; V436-Q439 WeakPolarHBondContact O-CB 3.22Å; V436-Q439 PolarHBondContact O-N 3.37Å; V436-Q439 VanDerWaalsContact O-N 3.13Å; V436-Q439 PolarHBondContact O-NE2 2.86Å
437	G	94.2	Very high	93.7	Very high	5 Å²	5	61.8 Å²	61.8	5%	0.052	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-65	-21	-177.5	0	0	0	0	0	113.8	P431 S434 Q439 L440	P431-G437 VanDerWaalsContact O-CA 3.29Å; P431-G437 WeakPolarHBondContact O-CA 3.23Å; S434-G437 PolarHBondContact O-N 3.19Å; S434-G437 PolarHBondContact OG-N 3.4Å; G437-Q439 PolarHBondContact O-N 3.17Å; G437-Q439 VanDerWaalsContact O-N 3.13Å; G437-L440 WeakPolarHBondContact O-CB 3.48Å; G437-L440 PolarHBondContact O-N 3.38Å
438	N	95.3	Very high	94	Very high	108 Å²	108	58.6 Å²	58.6	58%	0.578	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-57.4	-22.3	170.8	64.5	-11.4	0	0	0	113.5	V436 L440 D441 Q444	V436-N438 PolarHBondContact O-N 2.86Å; V436-N438 PolarHBondContact O-OD1 3.46Å; N438-L440 PolarHBondContact O-N 3.27Å; N438-D441 VanDerWaalsContact O-CB 3.25Å; N438-D441 WeakPolarHBondContact O-CB 3.4Å; N438-D441 PolarHBondContact O-N 3.08Å; N438-Q444 VanDerWaalsContact O-CG 3.24Å; N438-Q444 WeakPolarHBondContact O-CG 3.38Å
439	Q	95	Very high	94.3	Very high	21 Å²	21	54.5 Å²	54.5	10%	0.098	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-63.3	-20.6	172.1	-72.5	-178.9	101	0	0	113.8	R218 I221 D421 L425 V436 G437 D441	R218-Q439 VanDerWaalsContact CZ-O 3.28Å; R218-Q439 PolarHBondContact NH1-O 3.26Å; R218-Q439 PolarHBondContact NH2-O 2.77Å; I221-Q439 HydrophobicContact CD1-CB 4.46Å; I221-Q439 HydrophobicContact CG2-CB 4.33Å; D421-Q439 PolarHBondContact O-NE2 2.95Å; L425-Q439 HydrophobicContact CD1-CB 4.43Å; V436-Q439 WeakPolarHBondContact O-CB 3.22Å; V436-Q439 PolarHBondContact O-N 3.37Å; V436-Q439 VanDerWaalsContact O-N 3.13Å; V436-Q439 PolarHBondContact O-NE2 2.86Å; G437-Q439 PolarHBondContact O-N 3.17Å; G437-Q439 VanDerWaalsContact O-N 3.13Å; Q439-D441 VanDerWaalsContact C-N 3.34Å
440	L	95.4	Very high	94.8	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-85.6	-9.7	178.7	-62.3	163.1	0	0	0	112.7	I221 V224 N225 L425 P431 W432 G437 N438	I221-L440 HydrophobicContact CG2-CD2 3.76Å; I221-L440 HydrophobicContact CG2-CG 4.49Å; V224-L440 HydrophobicContact CB-CD2 4.44Å; V224-L440 HydrophobicContact CG1-CD2 3.97Å; N225-L440 HydrophobicContact CB-CD2 3.83Å; L425-L440 HydrophobicContact CD1-CD2 4.36Å; L425-L440 HydrophobicContact CD2-CD1 4.08Å; L425-L440 HydrophobicContact CD2-CG 4.28Å; P431-L440 HydrophobicContact CB-CD1 3.67Å; W432-L440 HydrophobicContact CD2-CB 4.04Å; W432-L440 HydrophobicContact CD2-CD1 3.95Å; W432-L440 HydrophobicContact CE3-CB 4.03Å; W432-L440 HydrophobicContact CG-CD1 3.95Å; W432-L440 HydrophobicContact CH2-CB 3.78Å; W432-L440 VanDerWaalsContact CH2-O 3.31Å; W432-L440 WeakPolarHBondContact CH2-O 3.33Å; W432-L440 HydrophobicContact CZ2-CB 3.8Å; W432-L440 HydrophobicContact CZ3-CB 3.89Å; G437-L440 WeakPolarHBondContact O-CB 3.48Å; G437-L440 PolarHBondContact O-N 3.38Å; N438-L440 PolarHBondContact O-N 3.27Å
441	D	95.8	Very high	95.2	Very high	72 Å²	72	51.2 Å²	51.2	39%	0.385	29%	0.289	S	S	.	.	S	Bend	trans	-62.7	129.3	175.3	-167.4	-48.1	0	0	0	110.5	N438 Q439 I443 Q444	N438-D441 VanDerWaalsContact O-CB 3.25Å; N438-D441 WeakPolarHBondContact O-CB 3.4Å; N438-D441 PolarHBondContact O-N 3.08Å; Q439-D441 VanDerWaalsContact C-N 3.34Å; D441-I443 HydrophobicContact CB-CG2 4.11Å; D441-I443 PolarHBondContact O-N 2.62Å; D441-I443 VanDerWaalsContact O-N 3.08Å; D441-I443 WeakPolarHBondContact OD1-CB 3.26Å; D441-I443 VanDerWaalsContact OD1-CG2 3.29Å; D441-I443 WeakPolarHBondContact OD1-CG2 3.38Å; D441-I443 PolarHBondContact OD1-N 3.12Å; D441-Q444 HydrophobicContact CB-CG 4.31Å; D441-Q444 WeakPolarHBondContact O-CB 3.25Å; D441-Q444 WeakPolarHBondContact O-CG 3.29Å; D441-Q444 PolarHBondContact O-N 3.3Å
442	P	96	Very high	95.5	Very high	69 Å²	69	51.1 Å²	51.1	45%	0.448	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-49.9	-29.3	174.5	-29.5	36.6	0	0	0	115.2	Q444 R445	P442-Q444 PolarHBondContact O-N 2.86Å; P442-R445 VanDerWaalsContact O-CB 3.23Å; P442-R445 WeakPolarHBondContact O-CB 3.28Å; P442-R445 VanDerWaalsContact O-CG 3.31Å; P442-R445 WeakPolarHBondContact O-CG 3.42Å; P442-R445 PolarHBondContact O-N 3.47Å
443	I	96.4	Very high	95.8	Very high	53 Å²	53	47.5 Å²	47.5	27%	0.272	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-60.1	-28.2	177.7	-157.1	172.7	0	0	0	112.2	D441 R445 E446	D441-I443 HydrophobicContact CB-CG2 4.11Å; D441-I443 PolarHBondContact O-N 2.62Å; D441-I443 VanDerWaalsContact O-N 3.08Å; D441-I443 WeakPolarHBondContact OD1-CB 3.26Å; D441-I443 VanDerWaalsContact OD1-CG2 3.29Å; D441-I443 WeakPolarHBondContact OD1-CG2 3.38Å; D441-I443 PolarHBondContact OD1-N 3.12Å; I443-R445 PolarHBondContact O-N 3Å; I443-E446 WeakPolarHBondContact O-CB 3.24Å; I443-E446 PolarHBondContact O-N 3.28Å
444	Q	96.8	Very high	96	Very high	77 Å²	77	41.9 Å²	41.9	36%	0.36	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-69.2	-4.9	177.8	-57	-61.3	-42.8	0	0	113.4	N438 D441 P442	N438-Q444 VanDerWaalsContact O-CG 3.24Å; N438-Q444 WeakPolarHBondContact O-CG 3.38Å; D441-Q444 HydrophobicContact CB-CG 4.31Å; D441-Q444 WeakPolarHBondContact O-CB 3.25Å; D441-Q444 WeakPolarHBondContact O-CG 3.29Å; D441-Q444 PolarHBondContact O-N 3.3Å; P442-Q444 PolarHBondContact O-N 2.86Å
445	R	97.7	Very high	96.2	Very high	19 Å²	19	41.7 Å²	41.7	7%	0.072	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-81.7	-26.5	171.2	-58.9	167.7	179.8	167.4	0.9	111.9	V185 L186 E222 T227 P442 I443 V448 C449	V185-R445 WeakPolarHBondContact O-CD 3.49Å; L186-R445 HydrophobicContact CD2-CB 4.35Å; L186-R445 WeakPolarHBondContact O-CD 3.31Å; L186-R445 PolarHBondContact O-NH1 2.91Å; E222-R445 VanDerWaalsContact CD-NE 3.34Å; E222-R445 WeakPolarHBondContact OE1-CG 2.94Å; E222-R445 IonicContact OE1-CZ 3.69Å; E222-R445 IonicContact OE1-NE 2.84Å; E222-R445 PolarHBondContact OE1-NE 3.28Å; E222-R445 IonicContact OE1-NH2 3.68Å; E222-R445 IonicContact OE2-CZ 3.5Å; E222-R445 IonicContact OE2-NE 3.44Å; E222-R445 PolarHBondContact OE2-NE 2.98Å; E222-R445 IonicContact OE2-NH2 2.74Å; E222-R445 PolarHBondContact OE2-NH2 3.46Å; T227-R445 PolarHBondContact OG1-NH2 2.82Å; P442-R445 VanDerWaalsContact O-CB 3.23Å; P442-R445 WeakPolarHBondContact O-CB 3.28Å; P442-R445 VanDerWaalsContact O-CG 3.31Å; P442-R445 WeakPolarHBondContact O-CG 3.42Å; P442-R445 PolarHBondContact O-N 3.47Å; I443-R445 PolarHBondContact O-N 3Å; R445-V448 PolarHBondContact O-N 3.42Å; R445-C449 VanDerWaalsContact O-CB 3.26Å; R445-C449 WeakPolarHBondContact O-CB 3.5Å; R445-C449 PolarHBondContact O-N 2.9Å
446	E	96.7	Very high	96.3	Very high	85 Å²	85	36.7 Å²	36.7	40%	0.397	21%	0.213	S	C	.	.	H	α-helix	trans	-60.6	-46.5	-176	-62.9	-176.6	-169	0	0	113.6	L186 S348 I443 V448 C449 S450	L186-E446 HydrophobicContact CD2-CG 4.22Å; S348-E446 PolarHBondContact OG-OE1 2.96Å; S348-E446 VanDerWaalsContact OG-OE1 3.13Å; I443-E446 WeakPolarHBondContact O-CB 3.24Å; I443-E446 PolarHBondContact O-N 3.28Å; E446-V448 VanDerWaalsContact C-N 3.32Å; E446-V448 PolarHBondContact O-N 2.84Å; E446-C449 WeakPolarHBondContact O-CB 3.34Å; E446-C449 PolarHBondContact O-N 3.3Å; E446-S450 PolarHBondContact O-N 3.17Å
447	P	96.2	Very high	96.4	Very high	82 Å²	82	35.6 Å²	35.6	53%	0.532	21%	0.205	S	C	.	.	H	α-helix	trans	-63.9	-38.4	-179.2	-22.6	35	0	0	0	112.4	S450 A451	P447-S450 PolarHBondContact O-N 2.94Å; P447-A451 WeakPolarHBondContact O-CB 3.34Å; P447-A451 PolarHBondContact O-N 2.89Å
448	V	97.1	Very high	96.3	Very high	14 Å²	14	39.4 Å²	39.4	9%	0.085	22%	0.222	C	C	.	.	H	α-helix	trans	-69.3	-41.3	177.8	-177.2	0	0	0	0	110.7	M190 T214 L215 R218 R445 E446 A451 L452	M190-V448 HydrophobicContact CE-CG1 4.14Å; T214-V448 HydrophobicContact CG2-CG1 4.45Å; T214-V448 HydrophobicContact CG2-CG2 4.1Å; L215-V448 HydrophobicContact CD2-CG1 3.52Å; L215-V448 HydrophobicContact CG-CG1 4.33Å; R218-V448 HydrophobicContact CB-CG1 4.32Å; R218-V448 HydrophobicContact CB-CG2 4.28Å; R218-V448 HydrophobicContact CG-CG1 4.43Å; R218-V448 HydrophobicContact CG-CG2 4.24Å; R445-V448 PolarHBondContact O-N 3.42Å; E446-V448 VanDerWaalsContact C-N 3.32Å; E446-V448 PolarHBondContact O-N 2.84Å; V448-A451 PolarHBondContact O-N 3.18Å; V448-L452 WeakPolarHBondContact O-CB 3.46Å; V448-L452 PolarHBondContact O-N 2.87Å
449	C	97.7	Very high	96.2	Very high	8 Å²	8	37.1 Å²	37.1	5%	0.054	21%	0.212	C	C	.	.	H	α-helix	trans	-60.2	-46.9	174.2	-170.2	0	0	0	0	111.6	V185 L186 R445 E446 L452 N453	V185-C449 HydrophobicContact CB-CB 4.26Å; V185-C449 HydrophobicContact CG1-CB 3.66Å; L186-C449 HydrophobicContact CD2-CB 4.11Å; L186-C449 HydrophobicContact CG-CB 4.47Å; R445-C449 VanDerWaalsContact O-CB 3.26Å; R445-C449 WeakPolarHBondContact O-CB 3.5Å; R445-C449 PolarHBondContact O-N 2.9Å; E446-C449 WeakPolarHBondContact O-CB 3.34Å; E446-C449 PolarHBondContact O-N 3.3Å; C449-L452 PolarHBondContact O-N 2.83Å; C449-N453 WeakPolarHBondContact O-CB 3.36Å; C449-N453 PolarHBondContact O-N 2.83Å
450	S	96	Very high	95.9	Very high	51 Å²	51	40.4 Å²	40.4	36%	0.357	23%	0.227	S	C	.	.	H	α-helix	trans	-64	-46	177	-170.7	0	0	0	0	111.8	E446 P447 L452 N453 S454	E446-S450 PolarHBondContact O-N 3.17Å; P447-S450 PolarHBondContact O-N 2.94Å; S450-L452 VanDerWaalsContact C-N 3.31Å; S450-L452 PolarHBondContact O-N 3.37Å; S450-N453 PolarHBondContact O-N 3.13Å; S450-S454 WeakPolarHBondContact O-CB 3.17Å; S450-S454 PolarHBondContact O-N 3.19Å; S450-S454 PolarHBondContact O-OG 3.27Å; S450-S454 VanDerWaalsContact O-OG 3.08Å
451	A	96.9	Very high	95.8	Very high	45 Å²	45	47.8 Å²	47.8	37%	0.372	27%	0.267	S	S	.	.	H	α-helix	trans	-60.2	-40.7	179.3	0	0	0	0	0	112.3	L211 P447 V448 A455	L211-A451 HydrophobicContact CD1-CB 4.11Å; P447-A451 WeakPolarHBondContact O-CB 3.34Å; P447-A451 PolarHBondContact O-N 2.89Å; V448-A451 PolarHBondContact O-N 3.18Å; A451-A455 WeakPolarHBondContact O-CB 3.25Å; A451-A455 PolarHBondContact O-N 3.21Å; A451-A455 VanDerWaalsContact O-N 3.07Å
452	L	97.9	Very high	95.6	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-66.9	-45.8	175.1	177.9	53.9	0	0	0	112.1	I181 V185 T197 L204 L205 L211 L215 V448 C449 S450 S454 A455 I456	I181-L452 HydrophobicContact CG2-CD2 3.47Å; I181-L452 VanDerWaalsContact CG2-CD2 3.47Å; I181-L452 HydrophobicContact CG2-CG 4.18Å; V185-L452 HydrophobicContact CG2-CD2 4.16Å; T197-L452 HydrophobicContact CG2-CD1 3.88Å; L204-L452 HydrophobicContact CD2-CD1 4.3Å; L205-L452 HydrophobicContact CD2-CD1 4.42Å; L211-L452 HydrophobicContact CD2-CD1 4.16Å; L215-L452 HydrophobicContact CD1-CD1 4.3Å; L215-L452 HydrophobicContact CD1-CD2 4.32Å; L215-L452 HydrophobicContact CD2-CB 4.48Å; L215-L452 HydrophobicContact CD2-CD2 3.93Å; V448-L452 WeakPolarHBondContact O-CB 3.46Å; V448-L452 PolarHBondContact O-N 2.87Å; C449-L452 PolarHBondContact O-N 2.83Å; S450-L452 VanDerWaalsContact C-N 3.31Å; S450-L452 PolarHBondContact O-N 3.37Å; L452-S454 PolarHBondContact O-N 2.92Å; L452-A455 PolarHBondContact O-N 3.03Å; L452-I456 HydrophobicContact CD1-CD1 4.04Å; L452-I456 HydrophobicContact CD1-CG1 4.23Å; L452-I456 HydrophobicContact CG-CD1 4.06Å; L452-I456 WeakPolarHBondContact O-CG1 3.49Å; L452-I456 PolarHBondContact O-N 3.23Å
453	N	97.3	Very high	95.4	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.016	27%	0.265	C	S	.	.	H	α-helix	trans	-60.4	-44	176.6	-172.4	54.3	0	0	0	111.7	H150 R178 C449 S450 A455 I456 L457	H150-N453 PolarHBondContact CE1-ND2 2.95Å; H150-N453 PolarHBondContact O-ND2 3.31Å; R178-N453 WeakPolarHBondContact CD-OD1 3.37Å; R178-N453 PolarHBondContact NH1-OD1 2.95Å; C449-N453 WeakPolarHBondContact O-CB 3.36Å; C449-N453 PolarHBondContact O-N 2.83Å; S450-N453 PolarHBondContact O-N 3.13Å; N453-A455 VanDerWaalsContact C-N 3.33Å; N453-A455 PolarHBondContact O-N 3.32Å; N453-I456 PolarHBondContact O-N 3.4Å; N453-L457 WeakPolarHBondContact O-CG 3.44Å; N453-L457 PolarHBondContact O-N 3.29Å
454	S	96.7	Very high	95.3	Very high	17 Å²	17	49.7 Å²	49.7	12%	0.119	27%	0.273	C	S	.	.	H	α-helix	trans	-59.4	-39.6	174.6	-66.9	0	0	0	0	113	S450 L452 L457 E458 K464	S450-S454 WeakPolarHBondContact O-CB 3.17Å; S450-S454 PolarHBondContact O-N 3.19Å; S450-S454 PolarHBondContact O-OG 3.27Å; S450-S454 VanDerWaalsContact O-OG 3.08Å; L452-S454 PolarHBondContact O-N 2.92Å; S454-L457 PolarHBondContact O-N 2.66Å; S454-E458 PolarHBondContact O-N 3.33Å; S454-K464 WeakPolarHBondContact CB-O 3.13Å; S454-K464 PolarHBondContact OG-O 3.07Å
455	A	97.2	Very high	95.2	Very high	8 Å²	8	51 Å²	51	7%	0.066	28%	0.279	C	S	.	.	H	α-helix	trans	-70.6	-36.9	177.2	0	0	0	0	0	112.7	L204 L211 A451 L452 N453 L457 E458 T459	L204-A455 HydrophobicContact CD2-CB 4.46Å; L211-A455 HydrophobicContact CD2-CB 3.48Å; L211-A455 VanDerWaalsContact CD2-CB 3.48Å; A451-A455 WeakPolarHBondContact O-CB 3.25Å; A451-A455 PolarHBondContact O-N 3.21Å; A451-A455 VanDerWaalsContact O-N 3.07Å; L452-A455 PolarHBondContact O-N 3.03Å; N453-A455 VanDerWaalsContact C-N 3.33Å; N453-A455 PolarHBondContact O-N 3.32Å; A455-L457 VanDerWaalsContact C-N 3.35Å; A455-E458 PolarHBondContact O-N 3.43Å; A455-T459 PolarHBondContact O-N 2.83Å; A455-T459 VanDerWaalsContact O-N 3.13Å
456	I	96.6	Very high	95	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-64	-41.3	173.4	-65.2	162.2	0	0	0	110.9	R178 I181 Y201 L204 L452 N453 T459 H460	R178-I456 HydrophobicContact CG-CG2 3.79Å; I181-I456 HydrophobicContact CD1-CD1 3.85Å; Y201-I456 HydrophobicContact CD1-CG2 4.19Å; Y201-I456 HydrophobicContact CD2-CD1 4.13Å; Y201-I456 HydrophobicContact CD2-CG1 3.99Å; Y201-I456 HydrophobicContact CD2-CG2 4.05Å; Y201-I456 HydrophobicContact CE1-CG2 3.71Å; Y201-I456 HydrophobicContact CE2-CD1 3.95Å; Y201-I456 HydrophobicContact CE2-CG1 4.09Å; Y201-I456 HydrophobicContact CE2-CG2 3.57Å; Y201-I456 HydrophobicContact CG-CG2 4.33Å; L204-I456 HydrophobicContact CD1-CB 4.17Å; L204-I456 HydrophobicContact CD1-CG1 3.58Å; L452-I456 HydrophobicContact CD1-CD1 4.04Å; L452-I456 HydrophobicContact CD1-CG1 4.23Å; L452-I456 HydrophobicContact CG-CD1 4.06Å; L452-I456 WeakPolarHBondContact O-CG1 3.49Å; L452-I456 PolarHBondContact O-N 3.23Å; N453-I456 PolarHBondContact O-N 3.4Å; I456-T459 PolarHBondContact O-OG1 2.68Å; I456-H460 PolarHBondContact O-ND1 2.74Å
457	L	94.9	Very high	94.9	Very high	5 Å²	5	48.8 Å²	48.8	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-65.6	-43.2	176.2	-69.4	167.7	0	0	0	111.3	H150 N453 S454 A455 T459 H460 N461 L462	H150-L457 WeakPolarHBondContact CD2-CD1 3.39Å; H150-L457 WeakPolarHBondContact NE2-CD1 3.39Å; N453-L457 WeakPolarHBondContact O-CG 3.44Å; N453-L457 PolarHBondContact O-N 3.29Å; S454-L457 PolarHBondContact O-N 2.66Å; A455-L457 VanDerWaalsContact C-N 3.35Å; L457-T459 PolarHBondContact O-N 3.31Å; L457-H460 CarbonylContact O-C 3.58Å; L457-H460 PolarHBondContact O-N 3.16Å; L457-H460 VanDerWaalsContact O-N 3.1Å; L457-N461 PolarHBondContact O-N 3.35Å; L457-L462 CarbonylContact C-O 3.54Å; L457-L462 HydrophobicContact CB-CB 3.99Å; L457-L462 HydrophobicContact CD2-CB 3.87Å; L457-L462 HydrophobicContact CD2-CD1 3.73Å; L457-L462 HydrophobicContact CD2-CG 4.47Å; L457-L462 WeakPolarHBondContact O-CB 3.48Å; L457-L462 PolarHBondContact O-N 2.93Å
458	E	93.6	Very high	94.8	Very high	86 Å²	86	47.5 Å²	47.5	40%	0.402	26%	0.263	S	S	.	.	H	α-helix	trans	-58.1	-41.8	176.5	175.8	168.1	-142.4	0	0	113.3	S454 A455 H460 N461 K464	S454-E458 PolarHBondContact O-N 3.33Å; A455-E458 PolarHBondContact O-N 3.43Å; E458-H460 PolarHBondContact O-N 3.34Å; E458-N461 PolarHBondContact O-N 2.61Å; E458-K464 HydrophobicContact CB-CG 4.23Å; E458-K464 WeakPolarHBondContact OE1-CE 3.47Å; E458-K464 IonicContact OE1-NZ 3.13Å; E458-K464 PolarHBondContact OE1-NZ 3.36Å; E458-K464 WeakPolarHBondContact OE2-CE 3.44Å; E458-K464 IonicContact OE2-NZ 2.72Å; E458-K464 PolarHBondContact OE2-NZ 3.03Å
459	T	91.5	Very high	94.5	Very high	59 Å²	59	48.8 Å²	48.8	36%	0.362	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-15.2	179.6	54.7	0	0	0	0	113.7	L204 A455 I456 L457	L204-T459 HydrophobicContact CD1-CG2 3.96Å; L204-T459 HydrophobicContact CG-CG2 4.03Å; A455-T459 PolarHBondContact O-N 2.83Å; A455-T459 VanDerWaalsContact O-N 3.13Å; I456-T459 PolarHBondContact O-OG1 2.68Å; L457-T459 PolarHBondContact O-N 3.31Å
460	H	90.5	Very high	94.4	Very high	90 Å²	90	52.9 Å²	52.9	42%	0.417	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	11.2	175.3	-59	80.4	0	0	0	112.9	Y201 I456 L457 E458 L462	Y201-H460 AromaticContact CD1-CE1 3.52Å; Y201-H460 AromaticContact CE1-CE1 3.43Å; Y201-H460 VanDerWaalsContact CE1-CE1 3.43Å; Y201-H460 WeakPolarHBondContact CE1-CE1 3.49Å; Y201-H460 AromaticContact CE1-NE2 3.96Å; I456-H460 PolarHBondContact O-ND1 2.74Å; L457-H460 CarbonylContact O-C 3.58Å; L457-H460 PolarHBondContact O-N 3.16Å; L457-H460 VanDerWaalsContact O-N 3.1Å; E458-H460 PolarHBondContact O-N 3.34Å; H460-L462 HydrophobicContact CB-CD1 4.2Å; H460-L462 HydrophobicContact CB-CG 4.19Å; H460-L462 PolarHBondContact O-N 2.76Å
461	N	91.7	Very high	94.3	Very high	157 Å²	157	52.3 Å²	52.3	84%	0.84	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	26.9	-172.8	-52.3	-74.9	0	0	0	114.1	L457 E458	L457-N461 PolarHBondContact O-N 3.35Å; E458-N461 PolarHBondContact O-N 2.61Å
462	L	92.7	Very high	94.1	Very high	53 Å²	53	53.1 Å²	53.1	28%	0.277	29%	0.291	S	S	.	.			trans	-90.6	155.5	174.3	-62.6	174.3	0	0	0	111	E170 L457 H460 K464	E170-L462 HydrophobicContact CG-CD1 3.93Å; L457-L462 CarbonylContact C-O 3.54Å; L457-L462 HydrophobicContact CB-CB 3.99Å; L457-L462 HydrophobicContact CD2-CB 3.87Å; L457-L462 HydrophobicContact CD2-CD1 3.73Å; L457-L462 HydrophobicContact CD2-CG 4.47Å; L457-L462 WeakPolarHBondContact O-CB 3.48Å; L457-L462 PolarHBondContact O-N 2.93Å; H460-L462 HydrophobicContact CB-CD1 4.2Å; H460-L462 HydrophobicContact CB-CG 4.19Å; H460-L462 PolarHBondContact O-N 2.76Å; L462-K464 PolarHBondContact O-N 3.49Å
463	P	92.4	Very high	93.9	Very high	81 Å²	81	54.8 Å²	54.8	53%	0.526	31%	0.309	S	S	.	.			trans	-60	126	-178.7	-25	35.1	0	0	0	113.1	Q465	P463-Q465 PolarHBondContact O-N 3.02Å
464	K	93.8	Very high	93.8	Very high	100 Å²	100	61 Å²	61	44%	0.435	34%	0.338	S	S	.	.	S	Bend	trans	-59.8	-31.1	177.3	-58.8	-166.4	-162.8	-156	0	113.4	H150 S454 E458 L462	H150-K464 PolarHBondContact NE2-O 3.41Å; S454-K464 WeakPolarHBondContact CB-O 3.13Å; S454-K464 PolarHBondContact OG-O 3.07Å; E458-K464 HydrophobicContact CB-CG 4.23Å; E458-K464 WeakPolarHBondContact OE1-CE 3.47Å; E458-K464 IonicContact OE1-NZ 3.13Å; E458-K464 PolarHBondContact OE1-NZ 3.36Å; E458-K464 WeakPolarHBondContact OE2-CE 3.44Å; E458-K464 IonicContact OE2-NZ 2.72Å; E458-K464 PolarHBondContact OE2-NZ 3.03Å; L462-K464 PolarHBondContact O-N 3.49Å
465	Q	93.6	Very high	93.7	Very high	104 Å²	104	62.2 Å²	62.2	49%	0.486	35%	0.348	S	S	.	.	S	Bend	trans	-132.6	145.4	-178.1	-71.1	179.6	-25.6	0	0	108.7	P463 L470	P463-Q465 PolarHBondContact O-N 3.02Å; Q465-L470 HydrophobicContact CB-CD2 4.41Å; Q465-L470 HydrophobicContact CB-CG 4.23Å; Q465-L470 VanDerWaalsContact OE1-CD2 3.23Å
466	P	94.1	Very high	93.6	Very high	3 Å²	3	64.6 Å²	64.6	2%	0.019	36%	0.362	C	S	.	.			trans	-71	147.8	175.5	29.8	-32.1	0	0	0	110.2	Y147 H150 L468 A469 L470	Y147-P466 HydrophobicContact CD2-CB 4.29Å; Y147-P466 HydrophobicContact CD2-CG 3.79Å; H150-P466 HydrophobicContact CB-CB 4.14Å; H150-P466 HydrophobicContact CB-CG 4.46Å; P466-L468 PolarHBondContact O-N 2.78Å; P466-L468 VanDerWaalsContact O-N 3.08Å; P466-A469 HydrophobicContact CG-CB 3.88Å; P466-A469 PolarHBondContact O-N 3.44Å; P466-L470 PolarHBondContact O-N 2.72Å
467	P	94.3	Very high	93.6	Very high	55 Å²	55	70 Å²	70	36%	0.357	39%	0.388	S	S	.	.	H	α-helix	trans	-55.2	-29.5	179.1	-28.1	36.4	0	0	0	114.2	M143 S146 L470 A471	M143-P467 HydrophobicContact CG-CB 4.23Å; S146-P467 WeakPolarHBondContact OG-CD 3.48Å; P467-L470 PolarHBondContact O-N 2.85Å; P467-A471 WeakPolarHBondContact O-CB 3.46Å; P467-A471 PolarHBondContact O-N 2.89Å
468	L	93.6	Very high	93.6	Very high	55 Å²	55	72.4 Å²	72.4	29%	0.288	40%	0.404	S	S	.	.	H	α-helix	trans	-61	-47.8	174.4	-177.5	59.3	0	0	0	112.3	M143 Y147 P466 L470 A471 M472	M143-L468 HydrophobicContact CB-CB 4.48Å; M143-L468 HydrophobicContact CE-CB 4.36Å; M143-L468 HydrophobicContact CE-CD1 4.08Å; Y147-L468 HydrophobicContact CD2-CD2 4.18Å; Y147-L468 HydrophobicContact CG-CD2 4.19Å; P466-L468 PolarHBondContact O-N 2.78Å; P466-L468 VanDerWaalsContact O-N 3.08Å; L468-L470 VanDerWaalsContact C-N 3.32Å; L468-L470 PolarHBondContact O-N 2.86Å; L468-A471 PolarHBondContact O-N 2.84Å; L468-M472 HydrophobicContact CD1-SD 4.45Å; L468-M472 HydrophobicContact CG-SD 4.19Å; L468-M472 VanDerWaalsContact O-CG 3.31Å; L468-M472 WeakPolarHBondContact O-CG 3.43Å; L468-M472 PolarHBondContact O-N 2.88Å
469	A	92.5	Very high	93.7	Very high	41 Å²	41	70.2 Å²	70.2	34%	0.339	40%	0.395	S	S	.	.	H	α-helix	trans	-66.5	-35.3	178.3	0	0	0	0	0	112	P466 G473	P466-A469 HydrophobicContact CG-CB 3.88Å; P466-A469 PolarHBondContact O-N 3.44Å; A469-G473 PolarHBondContact O-N 3.24Å
470	L	94.7	Very high	93.8	Very high	94 Å²	94	68.5 Å²	68.5	49%	0.492	39%	0.389	S	S	.	.	H	α-helix	trans	-64.7	-43.9	173.2	-70.7	171.3	0	0	0	111.8	Q465 P466 P467 L468 G473 Q474	Q465-L470 HydrophobicContact CB-CD2 4.41Å; Q465-L470 HydrophobicContact CB-CG 4.23Å; Q465-L470 VanDerWaalsContact OE1-CD2 3.23Å; P466-L470 PolarHBondContact O-N 2.72Å; P467-L470 PolarHBondContact O-N 2.85Å; L468-L470 VanDerWaalsContact C-N 3.32Å; L468-L470 PolarHBondContact O-N 2.86Å; L470-G473 PolarHBondContact O-N 3.4Å; L470-Q474 WeakPolarHBondContact O-CB 3.36Å; L470-Q474 PolarHBondContact O-N 2.95Å
471	A	93.6	Very high	94.1	Very high	39 Å²	39	68.7 Å²	68.7	32%	0.322	39%	0.393	S	S	.	.	H	α-helix	trans	-64.2	-42.4	177.4	0	0	0	0	0	112.1	M143 P467 L468 Q474 A475	M143-A471 HydrophobicContact CE-CB 3.7Å; P467-A471 WeakPolarHBondContact O-CB 3.46Å; P467-A471 PolarHBondContact O-N 2.89Å; L468-A471 PolarHBondContact O-N 2.84Å; A471-Q474 PolarHBondContact O-N 2.91Å; A471-A475 WeakPolarHBondContact O-CB 3.38Å; A471-A475 PolarHBondContact O-N 3.04Å
472	M	93.2	Very high	94.3	Very high	61 Å²	61	64 Å²	64	30%	0.3	37%	0.366	S	S	.	.	H	α-helix	trans	-61.1	-50.8	173.8	-69.2	168.9	61.9	0	0	111.4	L468 Q474 A475 T476 L499	L468-M472 HydrophobicContact CD1-SD 4.45Å; L468-M472 HydrophobicContact CG-SD 4.19Å; L468-M472 VanDerWaalsContact O-CG 3.31Å; L468-M472 WeakPolarHBondContact O-CG 3.43Å; L468-M472 PolarHBondContact O-N 2.88Å; M472-Q474 VanDerWaalsContact C-N 3.29Å; M472-Q474 PolarHBondContact O-N 2.88Å; M472-A475 WeakPolarHBondContact O-CB 3.34Å; M472-A475 PolarHBondContact O-N 3.39Å; M472-A475 VanDerWaalsContact O-N 3.09Å; M472-T476 PolarHBondContact O-N 3.05Å; M472-T476 PolarHBondContact O-OG1 3.24Å; M472-T476 VanDerWaalsContact O-OG1 3.13Å; M472-L499 HydrophobicContact CE-CD1 3.47Å; M472-L499 VanDerWaalsContact CE-CD1 3.47Å; M472-L499 HydrophobicContact CE-CD2 3.65Å; M472-L499 HydrophobicContact CE-CG 4.22Å; M472-L499 HydrophobicContact SD-CD2 4.19Å
473	G	93.7	Very high	94.3	Very high	37 Å²	37	64.3 Å²	64.3	38%	0.381	38%	0.377	S	S	.	.	H	α-helix	trans	-60.2	-37.9	177.4	0	0	0	0	0	112.9	A469 L470 Q477	A469-G473 PolarHBondContact O-N 3.24Å; L470-G473 PolarHBondContact O-N 3.4Å; G473-Q477 WeakPolarHBondContact O-CG 3.47Å; G473-Q477 PolarHBondContact O-N 2.93Å
474	Q	95.4	Very high	94.4	Very high	135 Å²	135	68.6 Å²	68.6	63%	0.631	38%	0.382	S	S	*	.	H	α-helix	trans	-63.8	-45.3	172.6	-177.6	177.3	-9.1	0	0	111.5	L470 A471 M472 T476 Q477 C478	L470-Q474 WeakPolarHBondContact O-CB 3.36Å; L470-Q474 PolarHBondContact O-N 2.95Å; A471-Q474 PolarHBondContact O-N 2.91Å; M472-Q474 VanDerWaalsContact C-N 3.29Å; M472-Q474 PolarHBondContact O-N 2.88Å; Q474-T476 PolarHBondContact O-N 3.14Å; Q474-Q477 PolarHBondContact O-N 2.93Å; Q474-C478 WeakPolarHBondContact O-CB 3.37Å; Q474-C478 PolarHBondContact O-N 3.04Å; Q474-C478 PolarHBondContact O-SG 2.77Å; Q474-C478 VanDerWaalsContact O-SG 3.36Å
475	A	94.6	Very high	94.4	Very high	41 Å²	41	68.3 Å²	68.3	34%	0.339	39%	0.393	S	S	.	.	H	α-helix	trans	-59.7	-46.3	177.3	0	0	0	0	0	111.8	A471 M472 Q477 C478 L479 V495	A471-A475 WeakPolarHBondContact O-CB 3.38Å; A471-A475 PolarHBondContact O-N 3.04Å; M472-A475 WeakPolarHBondContact O-CB 3.34Å; M472-A475 PolarHBondContact O-N 3.39Å; M472-A475 VanDerWaalsContact O-N 3.09Å; A475-Q477 VanDerWaalsContact C-N 3.34Å; A475-Q477 PolarHBondContact O-N 2.83Å; A475-C478 WeakPolarHBondContact O-CB 3.14Å; A475-C478 PolarHBondContact O-N 3.05Å; A475-L479 PolarHBondContact O-N 2.96Å; A475-V495 HydrophobicContact CB-CG2 3.84Å
476	T	94.7	Very high	94.2	Very high	59 Å²	59	65.9 Å²	65.9	36%	0.362	40%	0.396	S	S	.	.	H	α-helix	trans	-59.6	-42.2	175	-50	0	0	0	0	111.8	M472 Q474 L479 G480	M472-T476 PolarHBondContact O-N 3.05Å; M472-T476 PolarHBondContact O-OG1 3.24Å; M472-T476 VanDerWaalsContact O-OG1 3.13Å; Q474-T476 PolarHBondContact O-N 3.14Å; T476-L479 PolarHBondContact O-N 2.79Å; T476-G480 PolarHBondContact O-N 2.99Å
477	Q	95.9	Very high	94.2	Very high	115 Å²	115	69.5 Å²	69.5	54%	0.537	41%	0.414	S	S	.	.	H	α-helix	trans	-69.1	-34.9	175.9	-70.1	-56.4	-41.4	0	0	112.9	G473 Q474 A475 G480 L481	G473-Q477 WeakPolarHBondContact O-CG 3.47Å; G473-Q477 PolarHBondContact O-N 2.93Å; Q474-Q477 PolarHBondContact O-N 2.93Å; A475-Q477 VanDerWaalsContact C-N 3.34Å; A475-Q477 PolarHBondContact O-N 2.83Å; Q477-G480 PolarHBondContact O-N 2.88Å; Q477-L481 WeakPolarHBondContact O-CB 3.3Å; Q477-L481 VanDerWaalsContact O-CG 3.3Å; Q477-L481 WeakPolarHBondContact O-CG 3.28Å; Q477-L481 PolarHBondContact O-N 2.89Å
478	C	95.7	Very high	94.1	Very high	56 Å²	56	67.6 Å²	67.6	38%	0.378	41%	0.405	S	S	.	.	H	α-helix	trans	-63.7	-45.5	173.2	-76.2	0	0	0	0	111.5	Q474 A475 G480 L481 M482	Q474-C478 WeakPolarHBondContact O-CB 3.37Å; Q474-C478 PolarHBondContact O-N 3.04Å; Q474-C478 PolarHBondContact O-SG 2.77Å; Q474-C478 VanDerWaalsContact O-SG 3.36Å; A475-C478 WeakPolarHBondContact O-CB 3.14Å; A475-C478 PolarHBondContact O-N 3.05Å; C478-G480 VanDerWaalsContact C-N 3.34Å; C478-G480 PolarHBondContact O-N 2.9Å; C478-L481 WeakPolarHBondContact O-CB 3.44Å; C478-L481 PolarHBondContact O-N 2.74Å; C478-M482 VanDerWaalsContact O-CG 3.29Å; C478-M482 WeakPolarHBondContact O-CG 3.41Å; C478-M482 PolarHBondContact O-N 3.27Å
479	L	94.8	Very high	94.1	Very high	40 Å²	40	66.3 Å²	66.3	21%	0.209	40%	0.4	C	S	.	.	H	α-helix	trans	-60	-43.6	173	-69.9	170.5	0	0	0	111.5	A475 T476 L481 M482 A483 C490 A493 V495	A475-L479 PolarHBondContact O-N 2.96Å; T476-L479 PolarHBondContact O-N 2.79Å; L479-L481 VanDerWaalsContact C-N 3.31Å; L479-L481 PolarHBondContact O-N 3.44Å; L479-M482 HydrophobicContact CD2-SD 4.33Å; L479-M482 WeakPolarHBondContact O-CB 3.44Å; L479-M482 PolarHBondContact O-N 3.44Å; L479-A483 PolarHBondContact O-N 2.74Å; L479-C490 HydrophobicContact CD2-CB 3.94Å; L479-A493 HydrophobicContact CD2-CB 4.19Å; L479-V495 HydrophobicContact CD1-CG2 3.89Å
480	G	95.2	Very high	94.2	Very high	23 Å²	23	65.2 Å²	65.2	24%	0.237	39%	0.39	C	S	.	.	H	α-helix	trans	-63.6	-32.2	174.9	0	0	0	0	0	114	T476 Q477 C478 R484	T476-G480 PolarHBondContact O-N 2.99Å; Q477-G480 PolarHBondContact O-N 2.88Å; C478-G480 VanDerWaalsContact C-N 3.34Å; C478-G480 PolarHBondContact O-N 2.9Å; G480-R484 WeakPolarHBondContact O-CG 3.33Å; G480-R484 VanDerWaalsContact O-CZ 3.29Å; G480-R484 PolarHBondContact O-N 3.44Å; G480-R484 PolarHBondContact O-NE 3.42Å
481	L	96.4	Very high	94.2	Very high	93 Å²	93	64.2 Å²	64.2	49%	0.487	40%	0.396	S	S	.	.	H	α-helix	trans	-71.2	-45.8	171.7	-75.6	165.3	0	0	0	111.4	Q477 C478 L479 A483 R484 S485	Q477-L481 WeakPolarHBondContact O-CB 3.3Å; Q477-L481 VanDerWaalsContact O-CG 3.3Å; Q477-L481 WeakPolarHBondContact O-CG 3.28Å; Q477-L481 PolarHBondContact O-N 2.89Å; C478-L481 WeakPolarHBondContact O-CB 3.44Å; C478-L481 PolarHBondContact O-N 2.74Å; L479-L481 VanDerWaalsContact C-N 3.31Å; L479-L481 PolarHBondContact O-N 3.44Å; L481-A483 VanDerWaalsContact C-N 3.3Å; L481-A483 PolarHBondContact O-N 3.45Å; L481-R484 VanDerWaalsContact CD2-NH2 3.34Å; L481-R484 PolarHBondContact O-N 3.37Å; L481-S485 WeakPolarHBondContact O-CB 3.35Å; L481-S485 PolarHBondContact O-N 3.34Å; L481-S485 PolarHBondContact O-OG 3.3Å
482	M	95.2	Very high	94.2	Very high	58 Å²	58	63.5 Å²	63.5	29%	0.286	39%	0.385	S	S	.	.	H	α-helix	trans	-55.6	-44.7	175.9	-71.6	170.9	73	0	0	111.6	C478 L479 S485 G486 I487 C490	C478-M482 VanDerWaalsContact O-CG 3.29Å; C478-M482 WeakPolarHBondContact O-CG 3.41Å; C478-M482 PolarHBondContact O-N 3.27Å; L479-M482 HydrophobicContact CD2-SD 4.33Å; L479-M482 WeakPolarHBondContact O-CB 3.44Å; L479-M482 PolarHBondContact O-N 3.44Å; M482-S485 CarbonylContact O-C 3.59Å; M482-S485 PolarHBondContact O-N 3.46Å; M482-G486 PolarHBondContact O-N 2.84Å; M482-G486 VanDerWaalsContact O-N 3.13Å; M482-I487 HydrophobicContact CB-CB 4.11Å; M482-I487 HydrophobicContact CB-CD1 4.35Å; M482-I487 HydrophobicContact CE-CG2 3.83Å; M482-I487 HydrophobicContact CG-CD1 4.16Å; M482-I487 PolarHBondContact O-N 2.83Å; M482-C490 HydrophobicContact CB-CB 3.73Å; M482-C490 HydrophobicContact CE-CB 4.09Å; M482-C490 HydrophobicContact SD-CB 4.37Å
483	A	93.7	Very high	94.1	Very high	60 Å²	60	61.2 Å²	61.2	50%	0.496	38%	0.376	S	S	.	.	H	α-helix	trans	-60.2	-48.3	175.9	0	0	0	0	0	112.1	L479 L481 S485 G486 C490	L479-A483 PolarHBondContact O-N 2.74Å; L481-A483 VanDerWaalsContact C-N 3.3Å; L481-A483 PolarHBondContact O-N 3.45Å; A483-S485 PolarHBondContact O-N 2.85Å; A483-G486 PolarHBondContact O-N 2.81Å; A483-C490 VanDerWaalsContact CA-SG 3.53Å; A483-C490 PolarHBondContact N-SG 2.85Å; A483-C490 VanDerWaalsContact N-SG 3.43Å
484	R	93.7	Very high	93.8	Very high	171 Å²	171	61.8 Å²	61.8	65%	0.645	37%	0.372	S	S	*	.	H	α-helix	trans	-64.7	-26.5	176.3	-72.3	-175.5	-65.3	-101.8	3.9	113.3	G480 L481 G486	G480-R484 WeakPolarHBondContact O-CG 3.33Å; G480-R484 VanDerWaalsContact O-CZ 3.29Å; G480-R484 PolarHBondContact O-N 3.44Å; G480-R484 PolarHBondContact O-NE 3.42Å; L481-R484 VanDerWaalsContact CD2-NH2 3.34Å; L481-R484 PolarHBondContact O-N 3.37Å; R484-G486 VanDerWaalsContact C-N 3.34Å
485	S	93.6	Very high	93.5	Very high	94 Å²	94	56.3 Å²	56.3	66%	0.657	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	1.8	174.3	-66.9	0	0	0	0	113.9	L481 M482 A483	L481-S485 WeakPolarHBondContact O-CB 3.35Å; L481-S485 PolarHBondContact O-N 3.34Å; L481-S485 PolarHBondContact O-OG 3.3Å; M482-S485 CarbonylContact O-C 3.59Å; M482-S485 PolarHBondContact O-N 3.46Å; A483-S485 PolarHBondContact O-N 2.85Å
486	G	90.7	Very high	93.2	Very high	53 Å²	53	59.6 Å²	59.6	55%	0.546	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	20	177.9	0	0	0	0	0	114.9	M482 A483 R484 G488	M482-G486 PolarHBondContact O-N 2.84Å; M482-G486 VanDerWaalsContact O-N 3.13Å; A483-G486 PolarHBondContact O-N 2.81Å; R484-G486 VanDerWaalsContact C-N 3.34Å; G486-G488 PolarHBondContact O-N 3.45Å
487	I	93.2	Very high	92.6	Very high	79 Å²	79	60.3 Å²	60.3	41%	0.405	36%	0.358	S	S	.	.			trans	-82.2	93.8	179.9	-57.9	175.8	0	0	0	108.8	M482 S489 C490	M482-I487 HydrophobicContact CB-CB 4.11Å; M482-I487 HydrophobicContact CB-CD1 4.35Å; M482-I487 HydrophobicContact CE-CG2 3.83Å; M482-I487 HydrophobicContact CG-CD1 4.16Å; M482-I487 PolarHBondContact O-N 2.83Å; I487-S489 WeakPolarHBondContact CG2-OG 3.08Å; I487-S489 PolarHBondContact O-N 3.23Å; I487-C490 PolarHBondContact O-N 3.29Å; I487-C490 PolarHBondContact O-SG 2.8Å
488	G	92.5	Very high	91.9	Very high	16 Å²	16	59.7 Å²	59.7	17%	0.165	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-59	-18.3	-170.1	0	0	0	0	0	116.5	L58 G486 C490 A491	L58-G488 WeakPolarHBondContact O-CA 3.47Å; L58-G488 PolarHBondContact O-N 3.04Å; G486-G488 PolarHBondContact O-N 3.45Å; G488-C490 VanDerWaalsContact C-N 3.26Å; G488-C490 PolarHBondContact O-N 2.92Å; G488-A491 WeakPolarHBondContact O-CB 3.44Å; G488-A491 PolarHBondContact O-N 3.31Å
489	S	94.1	Very high	90.9	Very high	27 Å²	27	61 Å²	61	19%	0.189	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-67.3	-23.9	179.1	53.8	0	0	0	0	113.4	I487 A491 F492	I487-S489 WeakPolarHBondContact CG2-OG 3.08Å; I487-S489 PolarHBondContact O-N 3.23Å; S489-A491 PolarHBondContact O-N 3.34Å; S489-F492 PolarHBondContact O-N 2.91Å; S489-F492 VanDerWaalsContact O-N 3.14Å
490	C	94.2	Very high	89.1	Confident	19 Å²	19	69.2 Å²	69.2	13%	0.128	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-66.9	-18.3	177.1	71.7	0	0	0	0	113.4	L479 M482 A483 I487 G488 F492 A493	L479-C490 HydrophobicContact CD2-CB 3.94Å; M482-C490 HydrophobicContact CB-CB 3.73Å; M482-C490 HydrophobicContact CE-CB 4.09Å; M482-C490 HydrophobicContact SD-CB 4.37Å; A483-C490 VanDerWaalsContact CA-SG 3.53Å; A483-C490 PolarHBondContact N-SG 2.85Å; A483-C490 VanDerWaalsContact N-SG 3.43Å; I487-C490 PolarHBondContact O-N 3.29Å; I487-C490 PolarHBondContact O-SG 2.8Å; G488-C490 VanDerWaalsContact C-N 3.26Å; G488-C490 PolarHBondContact O-N 2.92Å; C490-F492 PolarHBondContact O-N 3.32Å; C490-A493 PolarHBondContact O-N 3.07Å; C490-A493 VanDerWaalsContact O-O 3.08Å
491	A	93.4	Very high	88.8	Confident	73 Å²	73	71.6 Å²	71.6	60%	0.603	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-69.1	-12.6	174.8	0	0	0	0	0	113.3	G488 S489	G488-A491 WeakPolarHBondContact O-CB 3.44Å; G488-A491 PolarHBondContact O-N 3.31Å; S489-A491 PolarHBondContact O-N 3.34Å
492	F	93.6	Very high	88.4	Confident	23 Å²	23	70.4 Å²	70.4	10%	0.101	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-110.9	9.9	-178.4	-63.8	-82.5	0	0	0	113.3	I59 M113 W116 R117 I120 S489 C490	I59-F492 HydrophobicContact CD1-CD2 3.81Å; I59-F492 HydrophobicContact CD1-CE2 3.66Å; I59-F492 HydrophobicContact CG1-CE2 4.45Å; M113-F492 HydrophobicContact CB-CE1 4.14Å; M113-F492 HydrophobicContact CE-CE1 4.31Å; M113-F492 HydrophobicContact CE-CZ 4.47Å; M113-F492 HydrophobicContact CG-CE1 4.43Å; M113-F492 HydrophobicContact CG-CZ 4.4Å; M113-F492 WeakPolarHBondContact O-CE1 3.48Å; W116-F492 HydrophobicContact CB-CE1 4.19Å; W116-F492 HydrophobicContact CB-CE2 4.45Å; W116-F492 HydrophobicContact CB-CZ 4.1Å; R117-F492 HydrophobicContact CB-CD1 3.81Å; R117-F492 HydrophobicContact CG-CD1 4.31Å; I120-F492 HydrophobicContact CB-CB 4.06Å; I120-F492 HydrophobicContact CG1-CB 4.09Å; I120-F492 HydrophobicContact CG2-CB 4.18Å; S489-F492 PolarHBondContact O-N 2.91Å; S489-F492 VanDerWaalsContact O-N 3.14Å; C490-F492 PolarHBondContact O-N 3.32Å
493	A	90.8	Very high	88	Confident	13 Å²	13	71.1 Å²	71.1	11%	0.107	40%	0.4	C	S	.	.			trans	-137.2	123.4	176.6	0	0	0	0	0	110.2	I124 L479 C490	I124-A493 HydrophobicContact CD1-CB 3.8Å; L479-A493 HydrophobicContact CD2-CB 4.19Å; C490-A493 PolarHBondContact O-N 3.07Å; C490-A493 VanDerWaalsContact O-O 3.08Å
494	T	88.1	Confident	87.7	Confident	50 Å²	50	71.8 Å²	71.8	31%	0.307	40%	0.395	S	S	.	.			trans	-109	167.7	166.3	78.2	0	0	0	0	108.4	E496 D497 Y498	T494-E496 WeakPolarHBondContact CB-OE2 3.32Å; T494-E496 PolarHBondContact OG1-N 3.26Å; T494-D497 WeakPolarHBondContact OG1-CB 3.21Å; T494-D497 PolarHBondContact OG1-N 3.13Å; T494-D497 PolarHBondContact OG1-OD1 3.32Å; T494-D497 PolarHBondContact OG1-OD2 3.45Å; T494-Y498 VanDerWaalsContact O-CD2 3.31Å; T494-Y498 WeakPolarHBondContact O-CD2 3.42Å; T494-Y498 WeakPolarHBondContact O-CE2 3.42Å
495	V	89.5	Confident	87.3	Confident	20 Å²	20	65.6 Å²	65.6	12%	0.121	38%	0.379	C	S	.	.	S	Bend	trans	-82	-33.2	169.1	-178.7	0	0	0	0	109.2	A475 L479 D497 Y498 L499	A475-V495 HydrophobicContact CB-CG2 3.84Å; L479-V495 HydrophobicContact CD1-CG2 3.89Å; V495-D497 PolarHBondContact O-N 3.27Å; V495-Y498 PolarHBondContact O-N 3.07Å; V495-Y498 VanDerWaalsContact O-N 3.15Å; V495-L499 HydrophobicContact CG1-CD1 4.35Å; V495-L499 WeakPolarHBondContact O-CG 3.41Å
496	E	87.2	Confident	86.9	Confident	110 Å²	110	63.7 Å²	63.7	51%	0.514	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-61.8	-36.7	-175.3	-64.3	72.2	-163.1	0	0	112.9	T494 Y498 L499	T494-E496 WeakPolarHBondContact CB-OE2 3.32Å; T494-E496 PolarHBondContact OG1-N 3.26Å; E496-Y498 PolarHBondContact O-N 3.3Å; E496-L499 PolarHBondContact O-N 3.02Å
497	D	83.7	Confident	86.6	Confident	74 Å²	74	64.4 Å²	64.4	40%	0.396	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-60	-14.1	176.6	-66.1	3.5	0	0	0	112.7	T494 V495 H500	T494-D497 WeakPolarHBondContact OG1-CB 3.21Å; T494-D497 PolarHBondContact OG1-N 3.13Å; T494-D497 PolarHBondContact OG1-OD1 3.32Å; T494-D497 PolarHBondContact OG1-OD2 3.45Å; V495-D497 PolarHBondContact O-N 3.27Å; D497-H500 PolarHBondContact O-CD2 2.7Å; D497-H500 VanDerWaalsContact O-CD2 3.28Å
498	Y	79.6	Confident	86.1	Confident	101 Å²	101	63.3 Å²	63.3	40%	0.396	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-109.5	4.4	-179.6	-59.2	-98.5	0	0	0	113.7	Q121 I124 T494 V495 E496	Q121-Y498 VanDerWaalsContact CD-OH 3.3Å; Q121-Y498 PolarHBondContact NE2-OH 3.44Å; Q121-Y498 PolarHBondContact OE1-OH 2.91Å; I124-Y498 WeakPolarHBondContact CD1-OH 3.43Å; I124-Y498 HydrophobicContact CG2-CE1 4.37Å; T494-Y498 VanDerWaalsContact O-CD2 3.31Å; T494-Y498 WeakPolarHBondContact O-CD2 3.42Å; T494-Y498 WeakPolarHBondContact O-CE2 3.42Å; V495-Y498 PolarHBondContact O-N 3.07Å; V495-Y498 VanDerWaalsContact O-N 3.15Å; E496-Y498 PolarHBondContact O-N 3.3Å
499	L	74.8	Confident	85.6	Confident	83 Å²	83	67.3 Å²	67.3	44%	0.435	36%	0.357	S	S	.	.			trans	-106.2	15.1	-175.9	-59.3	175.9	0	0	0	114.1	M472 V495 E496	M472-L499 HydrophobicContact CE-CD1 3.47Å; M472-L499 VanDerWaalsContact CE-CD1 3.47Å; M472-L499 HydrophobicContact CE-CD2 3.65Å; M472-L499 HydrophobicContact CE-CG 4.22Å; M472-L499 HydrophobicContact SD-CD2 4.19Å; V495-L499 HydrophobicContact CG1-CD1 4.35Å; V495-L499 WeakPolarHBondContact O-CG 3.41Å; E496-L499 PolarHBondContact O-N 3.02Å
500	H	58	Low	84.8	Confident	214 Å²	214	70.9 Å²	70.9	99%	0.991	37%	0.373	S	S	*	.			trans	-62.5	0	-176.3	-74.2	-52.6	0	0	0	114.6	D497	D497-H500 PolarHBondContact O-CD2 2.7Å; D497-H500 VanDerWaalsContact O-CD2 3.28Å

Retrieved 500 of 500 residues in 220.4 ms (Link to these results)

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