A0A096NMT1_PAPAN Loading...

Sorting nexin

AlphaFold DB (A0A2K6BDN3), UniProt , Accession A0A096NMT1, Species PAPAN (Papio anubis, Olive baboon), Gene SNX33, Length 574 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.4	Very low	81.7	Confident	225 Å²	225	77.7 Å²	77.7	100%	1.108	38%	0.376	S	S	*	.				0	142.8	0	-73.2	-178.1	-78.2	0	0	106.6
2	A	57.5	Low	82.5	Confident	55 Å²	55	82.3 Å²	82.3	46%	0.455	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-72.3	133.1	172.2	0	0	0	0	0	109.6	V28 I29 F30	A2-V28 HydrophobicContact CB-CG1 3.47Å; A2-V28 VanDerWaalsContact CB-CG1 3.47Å; A2-I29 CarbonylContact C-O 3.49Å; A2-I29 WeakPolarHBondContact CA-O 3.33Å; A2-F30 HydrophobicContact CB-CD1 3.96Å; A2-F30 HydrophobicContact CB-CE1 4.21Å
3	L	78.9	Confident	82.9	Confident	50 Å²	50	79.4 Å²	79.4	26%	0.262	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	144.7	178.7	-68.3	156.5	0	0	0	109.2	V28 I29 E32	L3-V28 CarbonylContact O-C 3.5Å; L3-I29 HydrophobicContact CB-CB 4.21Å; L3-I29 PolarHBondContact N-O 3.04Å; L3-I29 PolarHBondContact O-N 3.39Å; L3-E32 HydrophobicContact CD1-CB 3.61Å; L3-E32 HydrophobicContact CD1-CG 3.51Å; L3-E32 WeakPolarHBondContact CD1-OE1 3.47Å
4	K	85.9	Confident	82.4	Confident	130 Å²	130	86.6 Å²	86.6	57%	0.565	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	120.2	168	-75.7	-157.9	160.7	-140.7	0	109.9	D26 L27 V59	K4-D26 IonicContact NZ-OD2 3.69Å; K4-D26 PolarHBondContact NZ-OD2 3.42Å; K4-L27 WeakPolarHBondContact CA-O 3.41Å; K4-V59 PolarHBondContact O-N 2.85Å
5	G	87.9	Confident	82.1	Confident	0 Å²	0	87.5 Å²	87.5	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	160.6	164.5	0	0	0	0	0	110.1	L27 E57	G5-L27 PolarHBondContact N-O 3.38Å; G5-L27 PolarHBondContact O-N 3.42Å; G5-E57 CarbonylContact C-O 3.59Å; G5-E57 VanDerWaalsContact CA-O 3.23Å; G5-E57 WeakPolarHBondContact CA-O 3.48Å
6	R	91.1	Very high	81.9	Confident	88 Å²	88	95.8 Å²	95.8	33%	0.332	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	128.7	170.4	179.8	176	57.5	128.4	-0.2	108.2	L8 D24 E25 V56 E57 V59	R6-L8 PolarHBondContact O-N 3.04Å; R6-D24 WeakPolarHBondContact CD-OD1 3.36Å; R6-D24 IonicContact CZ-OD1 3.24Å; R6-D24 IonicContact NE-OD1 2.65Å; R6-D24 IonicContact NH1-OD1 2.84Å; R6-D24 PolarHBondContact NH1-OD1 3.22Å; R6-E25 WeakPolarHBondContact CA-O 3.11Å; R6-V56 WeakPolarHBondContact O-CA 3.39Å; R6-E57 IonicContact CZ-OE2 2.88Å; R6-E57 PolarHBondContact N-O 3.32Å; R6-E57 IonicContact NE-OE2 2.77Å; R6-E57 IonicContact NH2-OE2 3.54Å; R6-E57 PolarHBondContact NH2-OE2 3.37Å; R6-E57 PolarHBondContact O-N 2.75Å; R6-V59 HydrophobicContact CB-CG2 4.13Å
7	A	90	Very high	81.9	Confident	0 Å²	0	99.2 Å²	99.2	0%	0	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	132	176	0	0	0	0	0	110.5	I21 Q22 D24 E25 L27	A7-I21 HydrophobicContact CB-CB 4.43Å; A7-I21 HydrophobicContact CB-CD1 4.05Å; A7-I21 HydrophobicContact CB-CG1 4.45Å; A7-Q22 WeakPolarHBondContact CB-O 3.41Å; A7-D24 WeakPolarHBondContact O-CA 3.17Å; A7-D24 PolarHBondContact O-N 3.08Å; A7-E25 HydrophobicContact CB-CB 4.44Å; A7-E25 PolarHBondContact N-O 3.3Å; A7-L27 HydrophobicContact CB-CD1 4.18Å
8	L	89.4	Confident	82.3	Confident	58 Å²	58	95.6 Å²	95.6	30%	0.304	46%	0.46	S	S	.	.	S	Bend	trans	-89.3	-22.5	176.8	-69.9	177	0	0	0	112.6	R6 Q23 Y55 E57	R6-L8 PolarHBondContact O-N 3.04Å; L8-Q23 WeakPolarHBondContact O-CG 3.24Å; L8-Y55 PolarHBondContact N-O 3.09Å; L8-E57 HydrophobicContact CD1-CB 4.11Å; L8-E57 HydrophobicContact CD2-CB 3.88Å; L8-E57 HydrophobicContact CG-CB 3.93Å
9	Y	85.9	Confident	82.7	Confident	133 Å²	133	91.2 Å²	91.2	52%	0.522	44%	0.439	S	S	.	.	S	Bend	trans	-147.5	157.1	-176.2	-51.9	-68.6	0	0	0	110.1	Y55	Y9-Y55 HydrophobicContact CD2-CD1 4.34Å; Y9-Y55 HydrophobicContact CD2-CG 4.46Å
10	D	90.7	Very high	83.2	Confident	85 Å²	85	88.1 Å²	88.1	46%	0.455	43%	0.427	S	S	.	.			trans	-64.2	138.3	167.9	-64.9	-37.9	0	0	0	111	Q22 Q23	D10-Q22 WeakPolarHBondContact OD1-CA 3.41Å; D10-Q22 WeakPolarHBondContact OD1-CB 3.29Å; D10-Q23 PolarHBondContact OD1-N 3.41Å
11	F	91.6	Very high	83.6	Confident	31 Å²	31	83.9 Å²	83.9	14%	0.136	41%	0.407	C	S	.	.	B	Isolated β-bridge	trans	-137.3	131.5	169.1	168.3	-97.6	0	0	0	109.6	E18 S20 I21 W38 F51 P52 Y55	F11-E18 HydrophobicContact CE1-CB 4.49Å; F11-S20 CarbonylContact O-C 3.59Å; F11-S20 VanDerWaalsContact O-CA 3.24Å; F11-S20 WeakPolarHBondContact O-CA 3.49Å; F11-I21 HydrophobicContact CB-CD1 4.4Å; F11-I21 HydrophobicContact CB-CG1 3.8Å; F11-I21 HydrophobicContact CD1-CG1 4.35Å; F11-I21 PolarHBondContact N-O 3.1Å; F11-I21 PolarHBondContact O-N 3.15Å; F11-I21 VanDerWaalsContact O-O 3.11Å; F11-W38 HydrophobicContact CE1-CZ3 4.35Å; F11-W38 HydrophobicContact CE2-CH2 4.21Å; F11-W38 HydrophobicContact CE2-CZ3 4.45Å; F11-W38 AromaticContact CZ-CH2 3.89Å; F11-W38 HydrophobicContact CZ-CH2 3.89Å; F11-W38 AromaticContact CZ-CZ3 3.83Å; F11-W38 HydrophobicContact CZ-CZ3 3.83Å; F11-F51 HydrophobicContact CD1-CB 4.41Å; F11-P52 HydrophobicContact CD2-CG 3.95Å; F11-P52 HydrophobicContact CE2-CG 3.93Å; F11-P52 HydrophobicContact CG-CG 4.39Å; F11-P52 HydrophobicContact CZ-CG 4.36Å; F11-Y55 HydrophobicContact CB-CD1 3.96Å; F11-Y55 HydrophobicContact CB-CE1 4.36Å
12	H	91.6	Very high	85.6	Confident	133 Å²	133	78.6 Å²	78.6	62%	0.616	38%	0.379	S	S	*	.			trans	-105.6	125.1	175.8	-64.6	-54.9	0	0	0	109.8
13	S	87.9	Confident	87.1	Confident	44 Å²	44	81.2 Å²	81.2	31%	0.308	38%	0.382	S	S	.	.			trans	-67.4	125.8	176.2	48.4	0	0	0	0	111.4	E18 S20	S13-E18 WeakPolarHBondContact CA-OE2 3.49Å; S13-S20 PolarHBondContact N-OG 3.34Å; S13-S20 PolarHBondContact OG-N 3.03Å; S13-S20 PolarHBondContact OG-OG 2.88Å
14	E	75.7	Confident	87.6	Confident	180 Å²	180	82.9 Å²	82.9	84%	0.841	39%	0.391	S	S	*	.			trans	-95.6	-27.5	174.8	-61.1	-169.3	166.4	0	0	111.5	E18	E14-E18 PolarHBondContact N-OE2 3.36Å
15	N	78.6	Confident	87.8	Confident	101 Å²	101	77.3 Å²	77.3	54%	0.54	37%	0.367	S	S	.	.	S	Bend	trans	-110.9	159.3	179.6	-61.2	-72.1	0	0	0	113.7	E17 E18	N15-E17 PolarHBondContact O-N 2.67Å; N15-E18 HydrophobicContact CB-CG 4.36Å; N15-E18 WeakPolarHBondContact CB-OE1 3.43Å; N15-E18 PolarHBondContact N-OE2 2.77Å; N15-E18 VanDerWaalsContact N-OE2 3.08Å; N15-E18 PolarHBondContact ND2-OE1 2.89Å; N15-E18 PolarHBondContact O-N 3.23Å
16	K	78.5	Confident	88	Confident	219 Å²	219	81.3 Å²	81.3	95%	0.952	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-5.8	-178.1	-63.9	-175.2	-179.5	179.5	0	115.3
17	E	80.8	Confident	87.9	Confident	154 Å²	154	77.2 Å²	77.2	72%	0.72	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-6.1	177.3	-61.9	-178.5	-166.8	0	0	111.7	N15 G49 L50	N15-E17 PolarHBondContact O-N 2.67Å; E17-G49 CarbonylContact O-C 3.46Å; E17-G49 VanDerWaalsContact O-CA 3.31Å; E17-G49 WeakPolarHBondContact O-CA 3.21Å; E17-L50 PolarHBondContact O-N 3.35Å
18	E	90.6	Very high	87.8	Confident	35 Å²	35	79.6 Å²	79.6	16%	0.164	39%	0.388	C	S	.	.	B	Isolated β-bridge	trans	-95.5	162.8	174.1	-66.5	156.4	-155	0	0	110.9	F11 S13 E14 N15 W38 L50	F11-E18 HydrophobicContact CE1-CB 4.49Å; S13-E18 WeakPolarHBondContact CA-OE2 3.49Å; E14-E18 PolarHBondContact N-OE2 3.36Å; N15-E18 HydrophobicContact CB-CG 4.36Å; N15-E18 WeakPolarHBondContact CB-OE1 3.43Å; N15-E18 PolarHBondContact N-OE2 2.77Å; N15-E18 VanDerWaalsContact N-OE2 3.08Å; N15-E18 PolarHBondContact ND2-OE1 2.89Å; N15-E18 PolarHBondContact O-N 3.23Å; E18-W38 HydrophobicContact CG-CZ3 4.11Å; E18-L50 CarbonylContact C-O 3.6Å; E18-L50 VanDerWaalsContact CA-O 3.24Å; E18-L50 WeakPolarHBondContact CA-O 3.44Å; E18-L50 HydrophobicContact CG-CB 4.46Å
19	I	90.1	Very high	87.7	Confident	11 Å²	11	76.8 Å²	76.8	6%	0.056	37%	0.373	C	S	.	.			trans	-128.5	142.1	166.7	53.9	175.1	0	0	0	111.3	N43 E47 L50 F51	I19-N43 HydrophobicContact CD1-CB 4.03Å; I19-E47 VanDerWaalsContact CD1-O 3.31Å; I19-E47 WeakPolarHBondContact CD1-O 3.4Å; I19-E47 HydrophobicContact CG2-CB 3.88Å; I19-L50 PolarHBondContact N-O 2.72Å; I19-F51 HydrophobicContact CD1-CD1 3.96Å; I19-F51 HydrophobicContact CD1-CE1 4.04Å; I19-F51 HydrophobicContact CG1-CD1 3.8Å; I19-F51 HydrophobicContact CG1-CE1 4.39Å
20	S	91.5	Very high	87.5	Confident	29 Å²	29	74.8 Å²	74.8	20%	0.203	37%	0.367	C	S	.	.			trans	-70.7	138.1	171.7	-62.7	0	0	0	0	110.5	F11 S13 N43 R45	F11-S20 CarbonylContact O-C 3.59Å; F11-S20 VanDerWaalsContact O-CA 3.24Å; F11-S20 WeakPolarHBondContact O-CA 3.49Å; S13-S20 PolarHBondContact N-OG 3.34Å; S13-S20 PolarHBondContact OG-N 3.03Å; S13-S20 PolarHBondContact OG-OG 2.88Å; S20-N43 PolarHBondContact O-ND2 3.44Å; S20-N43 VanDerWaalsContact O-ND2 3.13Å; S20-R45 PolarHBondContact O-NH2 2.96Å
21	I	92.4	Very high	86.6	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.005	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-130.7	142.8	176.9	58.4	171	0	0	0	108.9	A7 F11 E25 L27 N43 F51 V56	A7-I21 HydrophobicContact CB-CB 4.43Å; A7-I21 HydrophobicContact CB-CD1 4.05Å; A7-I21 HydrophobicContact CB-CG1 4.45Å; F11-I21 HydrophobicContact CB-CD1 4.4Å; F11-I21 HydrophobicContact CB-CG1 3.8Å; F11-I21 HydrophobicContact CD1-CG1 4.35Å; F11-I21 PolarHBondContact N-O 3.1Å; F11-I21 PolarHBondContact O-N 3.15Å; F11-I21 VanDerWaalsContact O-O 3.11Å; I21-E25 WeakPolarHBondContact CA-OE2 3.24Å; I21-L27 HydrophobicContact CB-CD1 4.26Å; I21-L27 HydrophobicContact CB-CD2 4.2Å; I21-L27 HydrophobicContact CD1-CD1 3.83Å; I21-L27 HydrophobicContact CG2-CD1 3.89Å; I21-L27 HydrophobicContact CG2-CD2 3.58Å; I21-L27 HydrophobicContact CG2-CG 4.41Å; I21-N43 HydrophobicContact CG2-CB 4.3Å; I21-F51 HydrophobicContact CD1-CB 4.03Å; I21-F51 HydrophobicContact CD1-CD2 4.32Å; I21-F51 HydrophobicContact CD1-CG 4.23Å; I21-F51 HydrophobicContact CG2-CD1 4.28Å; I21-F51 HydrophobicContact CG2-CG 4.49Å; I21-V56 HydrophobicContact CD1-CG2 3.7Å
22	Q	90.6	Very high	85.2	Confident	114 Å²	114	75.9 Å²	75.9	53%	0.533	38%	0.375	S	S	.	.			trans	-104.3	152.9	177.5	-65.6	-169.1	-61.6	0	0	111.9	A7 D10 D24 E25	A7-Q22 WeakPolarHBondContact CB-O 3.41Å; D10-Q22 WeakPolarHBondContact OD1-CA 3.41Å; D10-Q22 WeakPolarHBondContact OD1-CB 3.29Å; Q22-D24 PolarHBondContact O-N 3.48Å; Q22-E25 HydrophobicContact CB-CB 4.48Å; Q22-E25 PolarHBondContact N-OE2 3.3Å; Q22-E25 WeakPolarHBondContact O-CB 3.4Å; Q22-E25 PolarHBondContact O-N 2.93Å
23	Q	90.3	Very high	83.5	Confident	109 Å²	109	75.8 Å²	75.8	51%	0.509	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	137.7	176.2	178.2	171.2	-18.4	0	0	111.3	L8 D10 E25	L8-Q23 WeakPolarHBondContact O-CG 3.24Å; D10-Q23 PolarHBondContact OD1-N 3.41Å; Q23-E25 PolarHBondContact O-N 3.33Å
24	D	88.6	Confident	82.2	Confident	85 Å²	85	76.7 Å²	76.7	46%	0.455	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	10.4	-173.8	-72.5	-71.9	0	0	0	115.3	R6 A7 Q22	R6-D24 WeakPolarHBondContact CD-OD1 3.36Å; R6-D24 IonicContact CZ-OD1 3.24Å; R6-D24 IonicContact NE-OD1 2.65Å; R6-D24 IonicContact NH1-OD1 2.84Å; R6-D24 PolarHBondContact NH1-OD1 3.22Å; A7-D24 WeakPolarHBondContact O-CA 3.17Å; A7-D24 PolarHBondContact O-N 3.08Å; Q22-D24 PolarHBondContact O-N 3.48Å
25	E	90.4	Very high	81.2	Confident	14 Å²	14	74.8 Å²	74.8	7%	0.065	38%	0.378	C	S	.	.			trans	-67.8	134.4	171.1	-171	171	-171.8	0	0	111.9	R6 A7 I21 Q22 Q23 L27 N43 S44 R45	R6-E25 WeakPolarHBondContact CA-O 3.11Å; A7-E25 HydrophobicContact CB-CB 4.44Å; A7-E25 PolarHBondContact N-O 3.3Å; I21-E25 WeakPolarHBondContact CA-OE2 3.24Å; Q22-E25 HydrophobicContact CB-CB 4.48Å; Q22-E25 PolarHBondContact N-OE2 3.3Å; Q22-E25 WeakPolarHBondContact O-CB 3.4Å; Q22-E25 PolarHBondContact O-N 2.93Å; Q23-E25 PolarHBondContact O-N 3.33Å; E25-L27 HydrophobicContact CB-CD2 4.45Å; E25-L27 HydrophobicContact CG-CD2 4.06Å; E25-N43 WeakPolarHBondContact OE1-CB 3.31Å; E25-S44 VanDerWaalsContact OE1-CB 3.25Å; E25-S44 WeakPolarHBondContact OE1-CB 3.34Å; E25-S44 PolarHBondContact OE1-N 3.28Å; E25-S44 PolarHBondContact OE1-OG 3.31Å; E25-R45 IonicContact OE1-CZ 2.75Å; E25-R45 IonicContact OE1-NH1 2.67Å; E25-R45 PolarHBondContact OE1-NH1 3.22Å; E25-R45 IonicContact OE2-NH1 2.82Å; E25-R45 PolarHBondContact OE2-NH1 3.21Å
26	D	91	Very high	80.3	Confident	84 Å²	84	77.8 Å²	77.8	45%	0.449	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	116.9	177	-134.3	27.6	0	0	0	109.4	K4	K4-D26 IonicContact NZ-OD2 3.69Å; K4-D26 PolarHBondContact NZ-OD2 3.42Å
27	L	88.7	Confident	80.3	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.005	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	144.8	-174.6	-56.3	-177.7	0	0	0	112.6	K4 G5 A7 I21 E25 N43 F51 V56	K4-L27 WeakPolarHBondContact CA-O 3.41Å; G5-L27 PolarHBondContact N-O 3.38Å; G5-L27 PolarHBondContact O-N 3.42Å; A7-L27 HydrophobicContact CB-CD1 4.18Å; I21-L27 HydrophobicContact CB-CD1 4.26Å; I21-L27 HydrophobicContact CB-CD2 4.2Å; I21-L27 HydrophobicContact CD1-CD1 3.83Å; I21-L27 HydrophobicContact CG2-CD1 3.89Å; I21-L27 HydrophobicContact CG2-CD2 3.58Å; I21-L27 HydrophobicContact CG2-CG 4.41Å; E25-L27 HydrophobicContact CB-CD2 4.45Å; E25-L27 HydrophobicContact CG-CD2 4.06Å; L27-N43 HydrophobicContact CD2-CB 3.8Å; L27-F51 HydrophobicContact CB-CZ 4.45Å; L27-F51 HydrophobicContact CD1-CD2 4.36Å; L27-F51 HydrophobicContact CD1-CE1 4.45Å; L27-F51 HydrophobicContact CD1-CE2 3.96Å; L27-F51 HydrophobicContact CD1-CZ 4Å; L27-V56 HydrophobicContact CD1-CB 4.48Å; L27-V56 HydrophobicContact CD1-CG1 3.97Å; L27-V56 HydrophobicContact CD1-CG2 3.61Å
28	V	89.6	Confident	80.6	Confident	50 Å²	50	66.1 Å²	66.1	30%	0.303	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	87.9	-176.7	-179.9	0	0	0	0	108.6	A2 L3 F30 G41 Q42	A2-V28 HydrophobicContact CB-CG1 3.47Å; A2-V28 VanDerWaalsContact CB-CG1 3.47Å; L3-V28 CarbonylContact O-C 3.5Å; V28-F30 HydrophobicContact CG1-CE1 3.87Å; V28-F30 HydrophobicContact CG1-CZ 4.47Å; V28-G41 CarbonylContact O-C 3.6Å; V28-G41 WeakPolarHBondContact O-CA 3.19Å; V28-Q42 HydrophobicContact CB-CB 4.34Å; V28-Q42 PolarHBondContact N-O 3.3Å; V28-Q42 PolarHBondContact O-N 3.43Å
29	I	86.4	Confident	80.2	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	128.6	-174	-59.9	154.4	0	0	0	109.9	A2 L3 S31 L39 F51 V56 I58	A2-I29 CarbonylContact C-O 3.49Å; A2-I29 WeakPolarHBondContact CA-O 3.33Å; L3-I29 HydrophobicContact CB-CB 4.21Å; L3-I29 PolarHBondContact N-O 3.04Å; L3-I29 PolarHBondContact O-N 3.39Å; I29-S31 WeakPolarHBondContact CG2-O 3.38Å; I29-L39 HydrophobicContact CD1-CD1 4.13Å; I29-L39 HydrophobicContact CG2-CB 4.33Å; I29-L39 HydrophobicContact CG2-CD1 4.46Å; I29-L39 HydrophobicContact CG2-CD2 4.44Å; I29-F51 HydrophobicContact CG1-CE2 4.07Å; I29-F51 HydrophobicContact CG1-CZ 3.83Å; I29-V56 HydrophobicContact CD1-CG1 4.1Å; I29-I58 HydrophobicContact CD1-CD1 4.39Å; I29-I58 HydrophobicContact CD1-CG1 3.95Å
30	F	82.9	Confident	80.2	Confident	90 Å²	90	69 Å²	69	40%	0.395	36%	0.363	S	S	.	.	S	Bend	trans	-91.9	-22.5	-174.7	-61.5	-47.6	0	0	0	114.7	A2 V28 Q40 Q42 T48	A2-F30 HydrophobicContact CB-CD1 3.96Å; A2-F30 HydrophobicContact CB-CE1 4.21Å; V28-F30 HydrophobicContact CG1-CE1 3.87Å; V28-F30 HydrophobicContact CG1-CZ 4.47Å; F30-Q40 PolarHBondContact N-O 3.32Å; F30-Q42 HydrophobicContact CE1-CB 4.49Å; F30-Q42 HydrophobicContact CE2-CB 3.66Å; F30-Q42 HydrophobicContact CZ-CB 3.47Å; F30-Q42 VanDerWaalsContact CZ-CB 3.47Å; F30-Q42 HydrophobicContact CZ-CG 4.44Å; F30-T48 HydrophobicContact CD2-CG2 4.26Å; F30-T48 HydrophobicContact CE2-CG2 3.74Å
31	S	71.1	Confident	80.1	Confident	42 Å²	42	67.6 Å²	67.6	29%	0.294	35%	0.353	S	S	.	.			trans	-137.1	137.6	175.6	-179.3	0	0	0	0	111.4	I29 I33	I29-S31 WeakPolarHBondContact CG2-O 3.38Å; S31-I33 PolarHBondContact OG-N 3.19Å
32	E	61.5	Low	80.1	Confident	97 Å²	97	70.6 Å²	70.6	45%	0.453	37%	0.367	S	S	.	.	S	Bend	trans	-90.8	-3.1	174	-147.6	166	-146.5	0	0	112.5	L3 I58 R60	L3-E32 HydrophobicContact CD1-CB 3.61Å; L3-E32 HydrophobicContact CD1-CG 3.51Å; L3-E32 WeakPolarHBondContact CD1-OE1 3.47Å; E32-I58 HydrophobicContact CG-CD1 4.5Å; E32-R60 VanDerWaalsContact CD-NH2 3.34Å; E32-R60 IonicContact OE1-CZ 2.7Å; E32-R60 VanDerWaalsContact OE1-CZ 3.28Å; E32-R60 IonicContact OE1-NE 2.67Å; E32-R60 PolarHBondContact OE1-NE 3.01Å; E32-R60 IonicContact OE1-NH2 2.7Å; E32-R60 PolarHBondContact OE1-NH2 2.81Å
33	I	57.2	Low	80	Confident	131 Å²	131	65.4 Å²	65.4	67%	0.672	34%	0.343	S	S	*	.			trans	-88.8	105	175.6	-54.9	174.7	0	0	0	107.8	S31 L35	S31-I33 PolarHBondContact OG-N 3.19Å; I33-L35 PolarHBondContact O-N 2.68Å
34	S	59.6	Low	80	Confident	63 Å²	63	64.2 Å²	64.2	44%	0.441	35%	0.346	S	S	.	.			trans	-77	114.4	172.6	58.9	0	0	0	0	110.9	W38	S34-W38 VanDerWaalsContact CA-O 3.23Å; S34-W38 WeakPolarHBondContact CA-O 3.34Å; S34-W38 WeakPolarHBondContact CB-O 3.47Å
35	L	54.1	Low	79.9	Confident	140 Å²	140	65.7 Å²	65.7	73%	0.733	35%	0.346	S	S	*	.	B	Isolated β-bridge	trans	-77.7	125.5	159.4	-75.2	90	0	0	0	107.7	I33 G37 W38	I33-L35 PolarHBondContact O-N 2.68Å; L35-G37 PolarHBondContact O-N 3.47Å; L35-W38 PolarHBondContact O-N 2.83Å
36	D	61.4	Low	79.5	Confident	165 Å²	165	66.9 Å²	66.9	88%	0.882	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.9	35.8	178.6	-84.8	-0.9	0	0	0	116.3
37	G	78.3	Confident	79.3	Confident	36 Å²	36	67.3 Å²	67.3	37%	0.371	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	12.6	175.9	0	0	0	0	0	115.5	L35 A53	L35-G37 PolarHBondContact O-N 3.47Å; G37-A53 WeakPolarHBondContact O-CB 3.26Å; G37-A53 PolarHBondContact O-N 3.24Å
38	W	86.3	Confident	79.4	Confident	92 Å²	92	71.1 Å²	71.1	35%	0.348	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	149.4	173.9	-65.8	77	0	0	0	111.8	F11 E18 S34 L35 L50 P52	F11-W38 HydrophobicContact CE1-CZ3 4.35Å; F11-W38 HydrophobicContact CE2-CH2 4.21Å; F11-W38 HydrophobicContact CE2-CZ3 4.45Å; F11-W38 AromaticContact CZ-CH2 3.89Å; F11-W38 HydrophobicContact CZ-CH2 3.89Å; F11-W38 AromaticContact CZ-CZ3 3.83Å; F11-W38 HydrophobicContact CZ-CZ3 3.83Å; E18-W38 HydrophobicContact CG-CZ3 4.11Å; S34-W38 VanDerWaalsContact CA-O 3.23Å; S34-W38 WeakPolarHBondContact CA-O 3.34Å; S34-W38 WeakPolarHBondContact CB-O 3.47Å; L35-W38 PolarHBondContact O-N 2.83Å; W38-L50 HydrophobicContact CE3-CB 4.17Å; W38-P52 HydrophobicContact CE3-CG 4.2Å; W38-P52 HydrophobicContact CH2-CG 3.89Å; W38-P52 HydrophobicContact CZ2-CG 4.4Å; W38-P52 HydrophobicContact CZ3-CG 3.78Å
39	L	82.8	Confident	79.2	Confident	6 Å²	6	69 Å²	69	3%	0.031	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	147.6	171.2	-67.1	174.4	0	0	0	109.6	I29 L50 F51 A53 I58	I29-L39 HydrophobicContact CD1-CD1 4.13Å; I29-L39 HydrophobicContact CG2-CB 4.33Å; I29-L39 HydrophobicContact CG2-CD1 4.46Å; I29-L39 HydrophobicContact CG2-CD2 4.44Å; L39-L50 WeakPolarHBondContact O-CA 3.23Å; L39-F51 HydrophobicContact CB-CD2 4.16Å; L39-F51 HydrophobicContact CB-CE2 3.83Å; L39-F51 HydrophobicContact CB-CZ 4.5Å; L39-F51 HydrophobicContact CD1-CE2 4.4Å; L39-F51 PolarHBondContact N-O 3.02Å; L39-F51 PolarHBondContact O-N 2.69Å; L39-A53 HydrophobicContact CD1-CB 4.09Å; L39-A53 HydrophobicContact CD2-CB 4.45Å; L39-A53 HydrophobicContact CG-CB 3.77Å; L39-I58 HydrophobicContact CD1-CD1 4.14Å; L39-I58 HydrophobicContact CD1-CG1 4.48Å
40	Q	88.7	Confident	79.4	Confident	100 Å²	100	71.6 Å²	71.6	47%	0.467	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.4	172.1	-162.6	179.2	29.4	0	0	109.9	F30 G49 L50	F30-Q40 PolarHBondContact N-O 3.32Å; Q40-G49 WeakPolarHBondContact CA-O 3.26Å; Q40-L50 HydrophobicContact CB-CD2 3.76Å; Q40-L50 HydrophobicContact CG-CD2 3.98Å
41	G	89.9	Confident	79.7	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168	-169	-177.2	0	0	0	0	0	113.7	V28 T48 G49	V28-G41 CarbonylContact O-C 3.6Å; V28-G41 WeakPolarHBondContact O-CA 3.19Å; G41-T48 WeakPolarHBondContact O-CA 3.28Å; G41-G49 PolarHBondContact N-O 3.32Å; G41-G49 PolarHBondContact O-N 3.2Å; G41-G49 VanDerWaalsContact O-O 3.14Å
42	Q	92	Very high	80.6	Confident	63 Å²	63	66 Å²	66	29%	0.294	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	139.6	178.5	177	174	51.3	0	0	110.1	V28 F30 G46 E47	V28-Q42 HydrophobicContact CB-CB 4.34Å; V28-Q42 PolarHBondContact N-O 3.3Å; V28-Q42 PolarHBondContact O-N 3.43Å; F30-Q42 HydrophobicContact CE1-CB 4.49Å; F30-Q42 HydrophobicContact CE2-CB 3.66Å; F30-Q42 HydrophobicContact CZ-CB 3.47Å; F30-Q42 VanDerWaalsContact CZ-CB 3.47Å; F30-Q42 HydrophobicContact CZ-CG 4.44Å; Q42-G46 PolarHBondContact NE2-O 3.29Å; Q42-E47 WeakPolarHBondContact CA-O 3.46Å; Q42-E47 WeakPolarHBondContact CG-O 3.11Å
43	N	90	Very high	81.8	Confident	5 Å²	5	62.9 Å²	62.9	3%	0.027	35%	0.348	C	S	.	.			trans	-91.1	178.4	178.6	67.4	20	0	0	0	112.4	I19 S20 I21 E25 L27 R45 G46 E47	I19-N43 HydrophobicContact CD1-CB 4.03Å; S20-N43 PolarHBondContact O-ND2 3.44Å; S20-N43 VanDerWaalsContact O-ND2 3.13Å; I21-N43 HydrophobicContact CG2-CB 4.3Å; E25-N43 WeakPolarHBondContact OE1-CB 3.31Å; L27-N43 HydrophobicContact CD2-CB 3.8Å; N43-R45 PolarHBondContact ND2-NH2 2.75Å; N43-R45 PolarHBondContact O-N 2.92Å; N43-R45 VanDerWaalsContact O-N 3.13Å; N43-R45 WeakPolarHBondContact OD1-CB 3.27Å; N43-R45 PolarHBondContact OD1-N 3.48Å; N43-R45 VanDerWaalsContact OD1-N 3.14Å; N43-G46 PolarHBondContact O-N 3.27Å; N43-G46 PolarHBondContact OD1-N 2.98Å; N43-E47 PolarHBondContact N-O 2.98Å; N43-E47 PolarHBondContact ND2-OE2 3.27Å; N43-E47 PolarHBondContact OD1-N 3.09Å
44	S	88.7	Confident	83.2	Confident	84 Å²	84	60.9 Å²	60.9	59%	0.587	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-21.1	-176.5	72.6	0	0	0	0	113.5	E25 G46	E25-S44 VanDerWaalsContact OE1-CB 3.25Å; E25-S44 WeakPolarHBondContact OE1-CB 3.34Å; E25-S44 PolarHBondContact OE1-N 3.28Å; E25-S44 PolarHBondContact OE1-OG 3.31Å; S44-G46 VanDerWaalsContact C-N 3.33Å
45	R	86.8	Confident	84.6	Confident	117 Å²	117	62.2 Å²	62.2	44%	0.442	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-6.2	178.1	-55.5	-179.7	-62	-80.8	9	112.9	S20 E25 N43 E47	S20-R45 PolarHBondContact O-NH2 2.96Å; E25-R45 IonicContact OE1-CZ 2.75Å; E25-R45 IonicContact OE1-NH1 2.67Å; E25-R45 PolarHBondContact OE1-NH1 3.22Å; E25-R45 IonicContact OE2-NH1 2.82Å; E25-R45 PolarHBondContact OE2-NH1 3.21Å; N43-R45 PolarHBondContact ND2-NH2 2.75Å; N43-R45 PolarHBondContact O-N 2.92Å; N43-R45 VanDerWaalsContact O-N 3.13Å; N43-R45 WeakPolarHBondContact OD1-CB 3.27Å; N43-R45 PolarHBondContact OD1-N 3.48Å; N43-R45 VanDerWaalsContact OD1-N 3.14Å; R45-E47 HydrophobicContact CB-CG 4.27Å; R45-E47 IonicContact CZ-OE2 3.08Å; R45-E47 IonicContact NE-OE2 3.12Å; R45-E47 PolarHBondContact NE-OE2 3.34Å; R45-E47 IonicContact NH2-OE2 2.75Å; R45-E47 PolarHBondContact NH2-OE2 3Å
46	G	83.5	Confident	86.1	Confident	39 Å²	39	56 Å²	56	40%	0.402	31%	0.31	S	S	.	.	S	Bend	trans	86.4	3.1	-179.6	0	0	0	0	0	114.7	Q42 N43 S44	Q42-G46 PolarHBondContact NE2-O 3.29Å; N43-G46 PolarHBondContact O-N 3.27Å; N43-G46 PolarHBondContact OD1-N 2.98Å; S44-G46 VanDerWaalsContact C-N 3.33Å
47	E	86.3	Confident	87.4	Confident	93 Å²	93	52 Å²	52	44%	0.435	29%	0.286	S	S	.	.			trans	-73.4	139.3	176.4	-50.4	169.5	128.5	0	0	109.1	I19 Q42 N43 R45	I19-E47 VanDerWaalsContact CD1-O 3.31Å; I19-E47 WeakPolarHBondContact CD1-O 3.4Å; I19-E47 HydrophobicContact CG2-CB 3.88Å; Q42-E47 WeakPolarHBondContact CA-O 3.46Å; Q42-E47 WeakPolarHBondContact CG-O 3.11Å; N43-E47 PolarHBondContact N-O 2.98Å; N43-E47 PolarHBondContact ND2-OE2 3.27Å; N43-E47 PolarHBondContact OD1-N 3.09Å; R45-E47 HydrophobicContact CB-CG 4.27Å; R45-E47 IonicContact CZ-OE2 3.08Å; R45-E47 IonicContact NE-OE2 3.12Å; R45-E47 PolarHBondContact NE-OE2 3.34Å; R45-E47 IonicContact NH2-OE2 2.75Å; R45-E47 PolarHBondContact NH2-OE2 3Å
48	T	90.3	Very high	87.7	Confident	80 Å²	80	52 Å²	52	49%	0.491	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	132	-175.5	-66.3	0	0	0	0	111.3	F30 G41	F30-T48 HydrophobicContact CD2-CG2 4.26Å; F30-T48 HydrophobicContact CE2-CG2 3.74Å; G41-T48 WeakPolarHBondContact O-CA 3.28Å
49	G	86.2	Confident	87.3	Confident	5 Å²	5	51.3 Å²	51.3	5%	0.052	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.7	-159.3	-179.9	0	0	0	0	0	112.8	E17 Q40 G41	E17-G49 CarbonylContact O-C 3.46Å; E17-G49 VanDerWaalsContact O-CA 3.31Å; E17-G49 WeakPolarHBondContact O-CA 3.21Å; Q40-G49 WeakPolarHBondContact CA-O 3.26Å; G41-G49 PolarHBondContact N-O 3.32Å; G41-G49 PolarHBondContact O-N 3.2Å; G41-G49 VanDerWaalsContact O-O 3.14Å
50	L	90	Very high	86.6	Confident	56 Å²	56	58.8 Å²	58.8	29%	0.293	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	149	179.5	-63.9	169.6	0	0	0	112.5	E17 E18 I19 W38 L39 Q40	E17-L50 PolarHBondContact O-N 3.35Å; E18-L50 CarbonylContact C-O 3.6Å; E18-L50 VanDerWaalsContact CA-O 3.24Å; E18-L50 WeakPolarHBondContact CA-O 3.44Å; E18-L50 HydrophobicContact CG-CB 4.46Å; I19-L50 PolarHBondContact N-O 2.72Å; W38-L50 HydrophobicContact CE3-CB 4.17Å; L39-L50 WeakPolarHBondContact O-CA 3.23Å; Q40-L50 HydrophobicContact CB-CD2 3.76Å; Q40-L50 HydrophobicContact CG-CD2 3.98Å
51	F	88.4	Confident	84.6	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	157.2	169.8	45.9	-98	0	0	0	111.2	F11 I19 I21 L27 I29 L39 V56	F11-F51 HydrophobicContact CD1-CB 4.41Å; I19-F51 HydrophobicContact CD1-CD1 3.96Å; I19-F51 HydrophobicContact CD1-CE1 4.04Å; I19-F51 HydrophobicContact CG1-CD1 3.8Å; I19-F51 HydrophobicContact CG1-CE1 4.39Å; I21-F51 HydrophobicContact CD1-CB 4.03Å; I21-F51 HydrophobicContact CD1-CD2 4.32Å; I21-F51 HydrophobicContact CD1-CG 4.23Å; I21-F51 HydrophobicContact CG2-CD1 4.28Å; I21-F51 HydrophobicContact CG2-CG 4.49Å; L27-F51 HydrophobicContact CB-CZ 4.45Å; L27-F51 HydrophobicContact CD1-CD2 4.36Å; L27-F51 HydrophobicContact CD1-CE1 4.45Å; L27-F51 HydrophobicContact CD1-CE2 3.96Å; L27-F51 HydrophobicContact CD1-CZ 4Å; I29-F51 HydrophobicContact CG1-CE2 4.07Å; I29-F51 HydrophobicContact CG1-CZ 3.83Å; L39-F51 HydrophobicContact CB-CD2 4.16Å; L39-F51 HydrophobicContact CB-CE2 3.83Å; L39-F51 HydrophobicContact CB-CZ 4.5Å; L39-F51 HydrophobicContact CD1-CE2 4.4Å; L39-F51 PolarHBondContact N-O 3.02Å; L39-F51 PolarHBondContact O-N 2.69Å; F51-V56 HydrophobicContact CD2-CG2 3.65Å; F51-V56 HydrophobicContact CE2-CB 4.49Å; F51-V56 HydrophobicContact CE2-CG2 3.78Å
52	P	90.1	Very high	82.5	Confident	13 Å²	13	63.5 Å²	63.5	8%	0.084	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	134.7	-174.6	-21.1	33.1	0	0	0	113.1	F11 W38 S54 Y55	F11-P52 HydrophobicContact CD2-CG 3.95Å; F11-P52 HydrophobicContact CE2-CG 3.93Å; F11-P52 HydrophobicContact CG-CG 4.39Å; F11-P52 HydrophobicContact CZ-CG 4.36Å; W38-P52 HydrophobicContact CE3-CG 4.2Å; W38-P52 HydrophobicContact CH2-CG 3.89Å; W38-P52 HydrophobicContact CZ2-CG 4.4Å; W38-P52 HydrophobicContact CZ3-CG 3.78Å; P52-S54 PolarHBondContact O-N 2.89Å; P52-Y55 HydrophobicContact CB-CD2 3.83Å; P52-Y55 HydrophobicContact CB-CG 4.23Å; P52-Y55 HydrophobicContact CG-CD2 4.24Å; P52-Y55 HydrophobicContact CG-CG 4.41Å; P52-Y55 PolarHBondContact O-N 2.87Å; P52-Y55 VanDerWaalsContact O-N 3.15Å
53	A	87.3	Confident	80.5	Confident	32 Å²	32	68.5 Å²	68.5	26%	0.264	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-65.5	-26.2	180	0	0	0	0	0	113.2	G37 L39 Y55	G37-A53 WeakPolarHBondContact O-CB 3.26Å; G37-A53 PolarHBondContact O-N 3.24Å; L39-A53 HydrophobicContact CD1-CB 4.09Å; L39-A53 HydrophobicContact CD2-CB 4.45Å; L39-A53 HydrophobicContact CG-CB 3.77Å; A53-Y55 VanDerWaalsContact C-N 3.32Å
54	S	86.7	Confident	78.2	Confident	90 Å²	90	73 Å²	73	63%	0.629	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-77.1	-14.1	177.1	47.7	0	0	0	0	114	P52	P52-S54 PolarHBondContact O-N 2.89Å
55	Y	88.6	Confident	75.8	Confident	90 Å²	90	75 Å²	75	35%	0.353	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-93.4	0.2	-178.6	-83.9	-122.2	0	0	0	112.8	L8 Y9 F11 P52 A53	L8-Y55 PolarHBondContact N-O 3.09Å; Y9-Y55 HydrophobicContact CD2-CD1 4.34Å; Y9-Y55 HydrophobicContact CD2-CG 4.46Å; F11-Y55 HydrophobicContact CB-CD1 3.96Å; F11-Y55 HydrophobicContact CB-CE1 4.36Å; P52-Y55 HydrophobicContact CB-CD2 3.83Å; P52-Y55 HydrophobicContact CB-CG 4.23Å; P52-Y55 HydrophobicContact CG-CD2 4.24Å; P52-Y55 HydrophobicContact CG-CG 4.41Å; P52-Y55 PolarHBondContact O-N 2.87Å; P52-Y55 VanDerWaalsContact O-N 3.15Å; A53-Y55 VanDerWaalsContact C-N 3.32Å
56	V	86.4	Confident	73.2	Confident	10 Å²	10	76 Å²	76	6%	0.061	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	120.9	-171.2	-177.1	0	0	0	0	111.5	R6 I21 L27 I29 F51 I58	R6-V56 WeakPolarHBondContact O-CA 3.39Å; I21-V56 HydrophobicContact CD1-CG2 3.7Å; L27-V56 HydrophobicContact CD1-CB 4.48Å; L27-V56 HydrophobicContact CD1-CG1 3.97Å; L27-V56 HydrophobicContact CD1-CG2 3.61Å; I29-V56 HydrophobicContact CD1-CG1 4.1Å; F51-V56 HydrophobicContact CD2-CG2 3.65Å; F51-V56 HydrophobicContact CE2-CB 4.49Å; F51-V56 HydrophobicContact CE2-CG2 3.78Å; V56-I58 PolarHBondContact O-N 3.05Å
57	E	88	Confident	70.9	Confident	81 Å²	81	81.8 Å²	81.8	38%	0.379	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	110	168.6	-178.3	-179.5	-127.9	0	0	109.2	G5 R6 L8 V59	G5-E57 CarbonylContact C-O 3.59Å; G5-E57 VanDerWaalsContact CA-O 3.23Å; G5-E57 WeakPolarHBondContact CA-O 3.48Å; R6-E57 IonicContact CZ-OE2 2.88Å; R6-E57 PolarHBondContact N-O 3.32Å; R6-E57 IonicContact NE-OE2 2.77Å; R6-E57 IonicContact NH2-OE2 3.54Å; R6-E57 PolarHBondContact NH2-OE2 3.37Å; R6-E57 PolarHBondContact O-N 2.75Å; L8-E57 HydrophobicContact CD1-CB 4.11Å; L8-E57 HydrophobicContact CD2-CB 3.88Å; L8-E57 HydrophobicContact CG-CB 3.93Å; E57-V59 HydrophobicContact CG-CG2 4.36Å; E57-V59 PolarHBondContact O-N 3.24Å; E57-V59 VanDerWaalsContact O-N 3.15Å
58	I	83.9	Confident	68.5	Low	36 Å²	36	81.2 Å²	81.2	19%	0.185	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	105.6	168	-53	-177.8	0	0	0	107.4	I29 E32 L39 V56 R60	I29-I58 HydrophobicContact CD1-CD1 4.39Å; I29-I58 HydrophobicContact CD1-CG1 3.95Å; E32-I58 HydrophobicContact CG-CD1 4.5Å; L39-I58 HydrophobicContact CD1-CD1 4.14Å; L39-I58 HydrophobicContact CD1-CG1 4.48Å; V56-I58 PolarHBondContact O-N 3.05Å; I58-R60 VanDerWaalsContact C-N 3.32Å; I58-R60 HydrophobicContact CG2-CG 4.02Å; I58-R60 PolarHBondContact O-N 3.22Å
59	V	79.6	Confident	65.7	Low	78 Å²	78	83.6 Å²	83.6	47%	0.473	49%	0.485	S	S	.	.			trans	-74.2	83.4	-170.8	-175.3	0	0	0	0	110.4	K4 R6 E57	K4-V59 PolarHBondContact O-N 2.85Å; R6-V59 HydrophobicContact CB-CG2 4.13Å; E57-V59 HydrophobicContact CG-CG2 4.36Å; E57-V59 PolarHBondContact O-N 3.24Å; E57-V59 VanDerWaalsContact O-N 3.15Å
60	R	66.9	Low	63	Low	163 Å²	163	93.5 Å²	93.5	62%	0.615	52%	0.522	S	S	*	.			trans	-99.2	108.8	172.6	-53.3	-167.6	-164.9	111.5	-5.5	108.9	E32 I58 G62	E32-R60 VanDerWaalsContact CD-NH2 3.34Å; E32-R60 IonicContact OE1-CZ 2.7Å; E32-R60 VanDerWaalsContact OE1-CZ 3.28Å; E32-R60 IonicContact OE1-NE 2.67Å; E32-R60 PolarHBondContact OE1-NE 3.01Å; E32-R60 IonicContact OE1-NH2 2.7Å; E32-R60 PolarHBondContact OE1-NH2 2.81Å; I58-R60 VanDerWaalsContact C-N 3.32Å; I58-R60 HydrophobicContact CG2-CG 4.02Å; I58-R60 PolarHBondContact O-N 3.22Å; R60-G62 PolarHBondContact O-N 2.93Å
61	S	46.6	Very low	59.9	Low	130 Å²	130	95.7 Å²	95.7	91%	0.909	54%	0.542	S	S	*	.			trans	-63.8	98	-173.2	-52.4	0	0	0	0	113.5
62	G	46.5	Very low	57.1	Low	68 Å²	68	100.7 Å²	100.7	70%	0.701	58%	0.577	S	S	*	*			trans	-152.6	159.3	174.6	0	0	0	0	0	110.5	R60	R60-G62 PolarHBondContact O-N 2.93Å
63	I	48.8	Very low	54.3	Low	168 Å²	168	105.7 Å²	105.7	86%	0.862	61%	0.612	S	S	*	*			trans	-107.1	139.4	-165.4	-58.2	162.5	0	0	0	111.1
64	S	41.8	Very low	51.9	Low	99 Å²	99	110.2 Å²	110.2	69%	0.692	64%	0.639	S	S	*	*				155.7	166.5	125.4	56.4	0	0	0	0	116.6
65	T	38.9	Very low	49.1	Very low	128 Å²	128	111 Å²	111	79%	0.785	65%	0.65	S	S	*	*			trans	103	143.5	156.2	69.4	0	0	0	0	121
66	N	32.9	Very low	46.1	Very low	136 Å²	136	110.4 Å²	110.4	73%	0.727	67%	0.672	S	S	*	*			trans	-112.2	-179.1	167.8	-55	3.6	0	0	0	107.5
67	H	35.5	Very low	43.4	Very low	162 Å²	162	115.7 Å²	115.7	75%	0.75	71%	0.709	S	S	*	*			cis	-165.2	152	23.8	-123.5	-58.1	0	0	0	110.8
68	A	35.3	Very low	41	Very low	81 Å²	81	118.3 Å²	118.3	67%	0.669	73%	0.734	S	S	*	*			trans	62.2	143.7	143.9	0	0	0	0	0	119.7
69	D	31.7	Very low	38.3	Very low	130 Å²	130	119.8 Å²	119.8	70%	0.695	76%	0.758	S	S	*	*			cis	-164.6	-169.6	-10.6	-118.1	-71.7	0	0	0	106.6
70	Y	29.2	Very low	35.8	Very low	213 Å²	213	120.9 Å²	120.9	84%	0.835	78%	0.775	S	S	*	*			cis	-161.8	137.3	12.6	-138.2	-32.4	0	0	0	109.2
71	S	25.9	Very low	34	Very low	101 Å²	101	121.3 Å²	121.3	71%	0.706	78%	0.784	S	S	*	*			trans	-168.5	139.9	150.8	-167.8	0	0	0	0	114.8
72	S	29.4	Very low	33.1	Very low	106 Å²	106	120 Å²	120	74%	0.741	77%	0.77	S	S	*	*			trans	53.5	122.8	152.1	55.4	0	0	0	0	121.3
73	S	29.7	Very low	32.3	Very low	118 Å²	118	121.6 Å²	121.6	83%	0.825	77%	0.77	S	S	*	*			trans	-120.7	164.8	157.5	-47.6	0	0	0	0	109.4
74	P	38.6	Very low	31.3	Very low	126 Å²	126	119.5 Å²	119.5	82%	0.818	76%	0.76	S	S	*	*				-151.1	170	98.9	39.5	-23.2	0	0	0	116.9
75	A	26.8	Very low	30.7	Very low	106 Å²	106	124.1 Å²	124.1	88%	0.876	76%	0.764	S	S	*	*			trans	73.1	131.1	157.8	0	0	0	0	0	120
76	G	25.1	Very low	30.2	Very low	78 Å²	78	125.1 Å²	125.1	80%	0.804	76%	0.764	S	S	*	*			trans	130.6	101.6	163.4	0	0	0	0	0	115.4
77	S	29.5	Very low	29.8	Very low	121 Å²	121	123.6 Å²	123.6	85%	0.846	76%	0.764	S	S	*	*			trans	-142.8	145.4	165.1	-55.6	0	0	0	0	108.1
78	P	38.7	Very low	29.9	Very low	137 Å²	137	122.2 Å²	122.2	89%	0.89	77%	0.769	S	S	*	*				-141.6	171.1	79.7	37.6	-21.5	0	0	0	114.1
79	G	26.3	Very low	29.6	Very low	67 Å²	67	124 Å²	124	69%	0.691	78%	0.777	S	S	*	*			cis	162.8	161.3	-6.5	0	0	0	0	0	113
80	A	28.4	Very low	29.6	Very low	101 Å²	101	124.4 Å²	124.4	84%	0.835	78%	0.784	S	S	*	*			trans	65.4	156.9	176.9	0	0	0	0	0	116.3
81	H	27.7	Very low	29.6	Very low	172 Å²	172	118.7 Å²	118.7	80%	0.796	78%	0.781	S	S	*	*			cis	-156	141.3	13.8	-167.1	-122.3	0	0	0	112.7
82	V	29.6	Very low	29.9	Very low	103 Å²	103	121.6 Å²	121.6	62%	0.624	79%	0.788	S	S	*	*			trans	60.4	113	153.2	164.9	0	0	0	0	122.1
83	S	29.1	Very low	30.6	Very low	100 Å²	100	122.7 Å²	122.7	70%	0.699	79%	0.793	S	S	*	*				30.7	163.4	112.5	-30.4	0	0	0	0	122
84	L	27.5	Very low	30.7	Very low	125 Å²	125	121.7 Å²	121.7	65%	0.654	79%	0.792	S	S	*	*			cis	-167	176.5	17.4	-140.2	168.2	0	0	0	110.8
85	Y	28.7	Very low	30.4	Very low	196 Å²	196	127.3 Å²	127.3	77%	0.769	80%	0.796	S	S	*	*			trans	70.8	123.1	172.3	-57.9	-74.5	0	0	0	117.2
86	N	28.3	Very low	30.5	Very low	148 Å²	148	128.2 Å²	128.2	79%	0.791	80%	0.796	S	S	*	*			cis	91.8	126.6	16.3	-158.7	35.9	0	0	0	116.7
87	S	25.1	Very low	30.6	Very low	105 Å²	105	128.1 Å²	128.1	73%	0.734	80%	0.796	S	S	*	*			trans	-134.2	141.5	-178.7	-62.3	0	0	0	0	111.4
88	P	38.3	Very low	30.4	Very low	132 Å²	132	126.6 Å²	126.6	86%	0.857	80%	0.799	S	S	*	*			trans	-88.7	162.4	-176.7	35.5	-35.9	0	0	0	114.1
89	S	28.7	Very low	29.8	Very low	118 Å²	118	123.4 Å²	123.4	83%	0.825	79%	0.791	S	S	*	*			trans	-141.3	142.8	178.5	56.5	0	0	0	0	112.9
90	V	30.5	Very low	29.9	Very low	140 Å²	140	126.8 Å²	126.8	85%	0.848	80%	0.804	S	S	*	*			trans	-151.5	111.6	175.3	-176.3	0	0	0	0	105.2
91	A	30.1	Very low	29.8	Very low	92 Å²	92	125.1 Å²	125.1	76%	0.76	80%	0.797	S	S	*	*				96.1	125.3	53.4	0	0	0	0	0	113.1
92	N	32.4	Very low	29.7	Very low	163 Å²	163	126.8 Å²	126.8	87%	0.872	80%	0.802	S	S	*	*			trans	-86.1	164.9	-177.1	-77.7	-14.9	0	0	0	113.2
93	P	44.7	Very low	29.6	Very low	129 Å²	129	130.1 Å²	130.1	84%	0.838	82%	0.816	S	S	*	*			trans	-124.4	169.3	137.1	37.4	-28.4	0	0	0	112.8
94	A	31.2	Very low	29.5	Very low	96 Å²	96	130.4 Å²	130.4	79%	0.793	82%	0.817	S	S	*	*			trans	-151	154.9	-179.5	0	0	0	0	0	112.1
95	R	31.6	Very low	29.5	Very low	244 Å²	244	131.5 Å²	131.5	92%	0.921	82%	0.824	S	S	*	*			trans	-177.3	157.3	151.1	-114.7	173.1	164.5	-166.8	-7.4	117.5
96	S	29.6	Very low	29.5	Very low	125 Å²	125	130.2 Å²	130.2	87%	0.874	83%	0.825	S	S	*	*			trans	72.1	145.1	160.9	69.4	0	0	0	0	119.3
97	G	26.8	Very low	29.2	Very low	77 Å²	77	127 Å²	127	79%	0.794	83%	0.826	S	S	*	*			cis	162.7	139.2	-12.8	0	0	0	0	0	116.1
98	G	26.2	Very low	29.3	Very low	88 Å²	88	127.4 Å²	127.4	91%	0.907	83%	0.829	S	S	*	*			trans	83.6	157	173.4	0	0	0	0	0	115.7
99	G	24.9	Very low	28.9	Very low	71 Å²	71	129.6 Å²	129.6	73%	0.732	83%	0.826	S	S	*	*			cis	163.7	142.8	-9	0	0	0	0	0	113
100	S	28.2	Very low	29	Very low	137 Å²	137	133 Å²	133	96%	0.958	83%	0.829	S	S	*	*			trans	70.6	151.5	179.1	-49.7	0	0	0	0	116.7
101	G	26.3	Very low	29	Very low	67 Å²	67	133.7 Å²	133.7	69%	0.691	82%	0.823	S	S	*	*			cis	170.5	135.7	-11.2	0	0	0	0	0	113.7
102	F	26.4	Very low	28.9	Very low	207 Å²	207	137.2 Å²	137.2	91%	0.908	83%	0.829	S	S	*	*			trans	40.6	121.2	164.5	-69.8	-88	0	0	0	121.8
103	L	26.7	Very low	29	Very low	173 Å²	173	136.2 Å²	136.2	91%	0.906	82%	0.824	S	S	*	*				-163.1	159.6	104.9	-107.4	171.8	0	0	0	111.4
104	S	27.7	Very low	28.6	Very low	105 Å²	105	137.4 Å²	137.4	73%	0.734	82%	0.823	S	S	*	*			trans	-129.1	142.9	-174.1	55.9	0	0	0	0	111.5
105	N	27	Very low	28.8	Very low	148 Å²	148	139.7 Å²	139.7	79%	0.791	82%	0.822	S	S	*	*			trans	-149	162.4	149.6	-156.7	18	0	0	0	112.6
106	Q	27.9	Very low	29.3	Very low	170 Å²	170	135 Å²	135	79%	0.794	82%	0.815	S	S	*	*			trans	-61.7	158.4	169.4	-62.4	141.5	-3.3	0	0	110.6
107	G	24	Very low	30.1	Very low	79 Å²	79	139.3 Å²	139.3	81%	0.814	81%	0.812	S	S	*	*			cis	116.5	96.7	8.9	0	0	0	0	0	110.9
108	S	26.1	Very low	30.6	Very low	114 Å²	114	143.3 Å²	143.3	80%	0.797	82%	0.815	S	S	*	*			trans	-143.2	135	164.7	-165.1	0	0	0	0	108
109	F	29.4	Very low	31.1	Very low	178 Å²	178	147 Å²	147	78%	0.781	81%	0.814	S	S	*	*			trans	-79.2	136	163.3	-78.2	-117.6	0	0	0	107.7	E111	F109-E111 HydrophobicContact CD1-CG 4.49Å
110	E	30.5	Very low	31.8	Very low	190 Å²	190	154.6 Å²	154.6	89%	0.888	82%	0.821	S	S	*	*			trans	-132.5	137.4	137.1	-70.1	-168.3	151	0	0	105.2
111	E	30.5	Very low	32.1	Very low	154 Å²	154	155.6 Å²	155.6	72%	0.72	82%	0.816	S	S	*	*			trans	-92.1	116.6	-170.3	-71.4	156.4	134.4	0	0	109.3	F109 D113	F109-E111 HydrophobicContact CD1-CG 4.49Å; E111-D113 VanDerWaalsContact C-N 3.31Å; E111-D113 PolarHBondContact O-N 3.01Å
112	D	29.4	Very low	32.5	Very low	167 Å²	167	159 Å²	159	89%	0.893	82%	0.818	S	S	*	*			trans	-72.1	88.4	165.7	-90	-37.7	0	0	0	107.5	D114	D112-D114 PolarHBondContact O-N 2.78Å
113	D	33.8	Very low	32.6	Very low	142 Å²	142	152.4 Å²	152.4	76%	0.759	81%	0.808	S	S	*	*			trans	-65.1	124.4	175.7	-93.8	-36.4	0	0	0	111.4	E111 D115	E111-D113 VanDerWaalsContact C-N 3.31Å; E111-D113 PolarHBondContact O-N 3.01Å; D113-D115 VanDerWaalsContact C-N 3.31Å; D113-D115 PolarHBondContact O-N 3.44Å
114	D	37.5	Very low	32.8	Very low	153 Å²	153	149 Å²	149	82%	0.818	80%	0.798	S	S	*	*			trans	-84.3	52.7	-169.1	-110.8	-31.9	0	0	0	113.3	D112 D116	D112-D114 PolarHBondContact O-N 2.78Å; D114-D116 PolarHBondContact O-N 3.48Å
115	D	35.1	Very low	32.8	Very low	145 Å²	145	150.9 Å²	150.9	78%	0.775	81%	0.805	S	S	*	*			trans	-95.9	63.8	177.2	-81.6	-32.3	0	0	0	113.3	D113 W117	D113-D115 VanDerWaalsContact C-N 3.31Å; D113-D115 PolarHBondContact O-N 3.44Å; D115-W117 PolarHBondContact O-N 2.93Å
116	D	42.1	Very low	33	Very low	145 Å²	145	150.2 Å²	150.2	78%	0.775	81%	0.806	S	S	*	*			trans	-90.2	32.1	166.1	-159.7	38.1	0	0	0	111.4	D114	D114-D116 PolarHBondContact O-N 3.48Å
117	W	46.1	Very low	33.2	Very low	216 Å²	216	148.7 Å²	148.7	82%	0.818	81%	0.808	S	S	*	*			trans	-120	61.4	-179.1	-70.1	106.5	0	0	0	112.3	D115	D115-W117 PolarHBondContact O-N 2.93Å
118	D	36.9	Very low	33.4	Very low	161 Å²	161	154.2 Å²	154.2	86%	0.861	81%	0.813	S	S	*	*			trans	-166.7	93.2	156.4	-101.2	-20.1	0	0	0	112.2
119	D	36.2	Very low	33.5	Very low	164 Å²	164	157.7 Å²	157.7	88%	0.877	82%	0.816	S	S	*	*			trans	-151.5	35.9	159.6	-155.7	22.1	0	0	0	109.5
120	W	39.5	Very low	33.6	Very low	232 Å²	232	155.1 Å²	155.1	88%	0.879	82%	0.817	S	S	*	*			trans	-110.3	79.3	169.5	-82.9	98.6	0	0	0	108.6
121	D	35	Very low	33.4	Very low	158 Å²	158	158.2 Å²	158.2	85%	0.845	82%	0.821	S	S	*	*			trans	-131.2	89.8	172.1	-153.9	5.2	0	0	0	109.5	G123	D121-G123 PolarHBondContact O-N 2.93Å
122	D	34.1	Very low	33.4	Very low	138 Å²	138	155.8 Å²	155.8	74%	0.738	83%	0.828	S	S	*	*			trans	-76.1	74.2	-178.7	-120.3	-39.5	0	0	0	109.6	C124	D122-C124 PolarHBondContact O-N 2.95Å
123	G	28.8	Very low	33.3	Very low	69 Å²	69	151.9 Å²	151.9	71%	0.711	83%	0.826	S	S	*	*			trans	-67	37.7	-176.5	0	0	0	0	0	115.9	D121 T125	D121-G123 PolarHBondContact O-N 2.93Å; G123-T125 PolarHBondContact O-N 3.24Å
124	C	30.8	Very low	32.9	Very low	102 Å²	102	148.6 Å²	148.6	69%	0.689	83%	0.826	S	S	*	*			trans	-78.8	101.5	174	-91	0	0	0	0	110.7	D122 V126	D122-C124 PolarHBondContact O-N 2.95Å; C124-V126 PolarHBondContact O-N 3.32Å
125	T	28.2	Very low	32.5	Very low	143 Å²	143	150.2 Å²	150.2	88%	0.877	83%	0.834	S	S	*	*			trans	-64.9	99.8	176.5	56.9	0	0	0	0	111.8	G123	G123-T125 PolarHBondContact O-N 3.24Å
126	V	31.2	Very low	32.1	Very low	135 Å²	135	147 Å²	147	82%	0.818	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-94.3	126.6	167.3	-169.3	0	0	0	0	108.6	C124	C124-V126 PolarHBondContact O-N 3.32Å
127	V	33.1	Very low	31.5	Very low	137 Å²	137	146.2 Å²	146.2	83%	0.83	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-81.7	128.8	172.4	-113	0	0	0	0	109.3
128	E	27.3	Very low	30.7	Very low	196 Å²	196	143.9 Å²	143.9	92%	0.916	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-71.5	135.5	164.5	-69.9	-167.9	114.7	0	0	110.4
129	E	29.3	Very low	30.2	Very low	186 Å²	186	139.7 Å²	139.7	87%	0.869	83%	0.834	S	S	*	*			trans	-127	150.2	156.3	-88.6	-161.4	144.7	0	0	109.9
130	P	30	Very low	29.8	Very low	124 Å²	124	141.1 Å²	141.1	81%	0.805	84%	0.835	S	S	*	*			trans	-79.5	151.4	-163.4	30.8	-36.4	0	0	0	114.6
131	R	27.6	Very low	29.9	Very low	255 Å²	255	135.2 Å²	135.2	96%	0.962	83%	0.827	S	S	*	*			trans	-70.6	130.5	179.2	-66.5	174.9	171.8	173.8	-3.7	113.2
132	A	29.1	Very low	30.2	Very low	104 Å²	104	132.6 Å²	132.6	86%	0.86	82%	0.819	S	S	*	*			trans	-151.4	118.1	157.8	0	0	0	0	0	113.8
133	G	27	Very low	29.9	Very low	84 Å²	84	133 Å²	133	87%	0.866	82%	0.82	S	S	*	*			trans	19.8	108	157.2	0	0	0	0	0	123.5
134	G	25.4	Very low	29.9	Very low	73 Å²	73	137.6 Å²	137.6	75%	0.753	83%	0.828	S	S	*	*				87.8	123.3	102.8	0	0	0	0	0	122
135	L	29.6	Very low	29.8	Very low	187 Å²	187	139.3 Å²	139.3	98%	0.979	83%	0.83	S	S	*	*			trans	73.9	131.1	145.6	-60.1	168.3	0	0	0	121.3
136	G	28	Very low	29.7	Very low	79 Å²	79	137 Å²	137	81%	0.814	82%	0.819	S	S	*	*			trans	119.2	115.5	140.3	0	0	0	0	0	117.3
137	T	28.1	Very low	29.5	Very low	128 Å²	128	140.9 Å²	140.9	79%	0.785	82%	0.821	S	S	*	*			trans	-115.4	137.9	177.1	53.5	0	0	0	0	112.9
138	N	28.8	Very low	30	Very low	167 Å²	167	140.3 Å²	140.3	89%	0.893	82%	0.82	S	S	*	*			trans	47.9	132.1	150.5	-56.8	-13.8	0	0	0	120.3
139	G	27	Very low	30	Very low	73 Å²	73	133.8 Å²	133.8	75%	0.753	81%	0.805	S	S	*	*			trans	-159.1	-29.2	-179	0	0	0	0	0	122
140	H	28	Very low	29.9	Very low	193 Å²	193	129.2 Å²	129.2	89%	0.894	80%	0.799	S	S	*	*			trans	68.3	170.5	173.9	-82.8	-64.9	0	0	0	118.2
141	P	41	Very low	30.1	Very low	109 Å²	109	133.8 Å²	133.8	71%	0.708	80%	0.802	S	S	*	*			trans	-108.6	-161.4	-149.6	47.3	-40.7	0	0	0	113.1
142	P	42.3	Very low	30.8	Very low	103 Å²	103	127 Å²	127	67%	0.669	79%	0.791	S	S	*	*			cis	-147.1	-177.4	9.1	44.7	-23.6	0	0	0	120
143	L	28	Very low	30.8	Very low	147 Å²	147	127 Å²	127	77%	0.77	78%	0.784	S	S	*	*			trans	52.5	125.2	146.3	-76.4	163.1	0	0	0	121.5
144	N	28.3	Very low	30.9	Very low	164 Å²	164	131 Å²	131	88%	0.877	78%	0.78	S	S	*	*				-159.7	166.1	123.2	-127.2	-39.2	0	0	0	114.1
145	L	28.4	Very low	31.1	Very low	139 Å²	139	136.9 Å²	136.9	73%	0.728	79%	0.788	S	S	*	*			trans	-122.5	138.1	-174.7	-112	76.6	0	0	0	114.2
146	S	26.4	Very low	31.1	Very low	93 Å²	93	136.5 Å²	136.5	65%	0.65	78%	0.784	S	S	*	*			trans	65	110.8	138.2	-57.7	0	0	0	0	124.3
147	Y	26.3	Very low	31.1	Very low	217 Å²	217	136.6 Å²	136.6	85%	0.851	78%	0.776	S	S	*	*			trans	64.2	165.1	135.8	-80.4	-96	0	0	0	120.6
148	P	43.3	Very low	31.1	Very low	125 Å²	125	140.5 Å²	140.5	81%	0.812	78%	0.783	S	S	*	*			cis	-119.7	-177.5	-7.5	40.6	-26.5	0	0	0	113.9
149	G	27.2	Very low	31	Very low	60 Å²	60	143.4 Å²	143.4	62%	0.619	78%	0.781	S	S	*	*			cis	138.6	58.6	-10.4	0	0	0	0	0	117.1
150	A	28.5	Very low	31.6	Very low	89 Å²	89	144.4 Å²	144.4	74%	0.736	77%	0.774	S	S	*	*			trans	-158.6	152.9	179	0	0	0	0	0	113.4
151	Y	33.3	Very low	31.5	Very low	221 Å²	221	144.3 Å²	144.3	87%	0.867	77%	0.771	S	S	*	*			cis	-143.3	-84.7	-19.8	-112	-49.5	0	0	0	115.6
152	P	43.1	Very low	31.2	Very low	112 Å²	112	144.5 Å²	144.5	73%	0.727	77%	0.773	S	S	*	*			trans	-136.6	155.1	-142.5	40.6	-21.6	0	0	0	120.3
153	S	28.7	Very low	31.5	Very low	103 Å²	103	145.3 Å²	145.3	72%	0.72	78%	0.778	S	S	*	*			trans	64.5	150.9	151.3	-82.5	0	0	0	0	121.8
154	Q	28.9	Very low	31.6	Very low	168 Å²	168	146.6 Å²	146.6	79%	0.785	79%	0.785	S	S	*	*			cis	-179.5	138.6	-25	-115.4	179.5	19.4	0	0	106.6
155	H	30.8	Very low	31.9	Very low	197 Å²	197	147.2 Å²	147.2	91%	0.912	78%	0.783	S	S	*	*			trans	-174.5	164.7	143.2	-109.4	-77.4	0	0	0	113.2
156	M	28.8	Very low	31.8	Very low	180 Å²	180	151.5 Å²	151.5	89%	0.887	79%	0.789	S	S	*	*			trans	-86.4	169.3	-174.8	-74.3	-176.3	-175.6	0	0	113.3
157	A	27.9	Very low	31.9	Very low	80 Å²	80	154.3 Å²	154.3	66%	0.661	79%	0.792	S	S	*	*			cis	-171.3	172.3	-16.5	0	0	0	0	0	108.9
158	F	27.1	Very low	32.1	Very low	211 Å²	211	150.5 Å²	150.5	93%	0.925	79%	0.786	S	S	*	*			trans	171.3	165.2	130.3	-107.1	-88.8	0	0	0	112.9
159	R	28	Very low	31.4	Very low	227 Å²	227	150.2 Å²	150.2	86%	0.857	79%	0.787	S	S	*	*			trans	-154.3	174.8	-178.1	-131.3	-171.7	178	-172.4	1.7	106.5
160	P	39.7	Very low	31.9	Very low	94 Å²	94	155.7 Å²	155.7	61%	0.61	80%	0.801	S	S	*	*			cis	-144.1	-171	-5.5	44.1	-25.6	0	0	0	116.5
161	K	25.9	Very low	31.9	Very low	191 Å²	191	155.9 Å²	155.9	83%	0.83	80%	0.803	S	S	*	*			trans	71.6	162.5	147.4	-83.7	-174	-179.7	-174.7	0	119.9
162	P	34	Very low	31.8	Very low	113 Å²	113	150.6 Å²	150.6	73%	0.734	80%	0.798	S	S	*	*			cis	-133.4	-158.7	-29.5	41	-21.3	0	0	0	111.4
163	P	48.5	Very low	31.2	Very low	120 Å²	120	150.1 Å²	150.1	78%	0.779	80%	0.804	S	S	*	*			trans	-112.1	-177.3	-165	42.7	-32.8	0	0	0	115.5
164	L	29.8	Very low	31.7	Very low	174 Å²	174	154.5 Å²	154.5	91%	0.911	81%	0.81	S	S	*	*			trans	-154.1	140.6	160.6	-112.9	159.4	0	0	0	111.4
165	E	34.7	Very low	32.3	Very low	178 Å²	178	158 Å²	158	83%	0.832	82%	0.816	S	S	*	*			trans	-101.3	157.4	178.2	-58.1	170.7	119.4	0	0	111.6
166	R	27.7	Very low	32.9	Very low	229 Å²	229	151.6 Å²	151.6	86%	0.864	80%	0.803	S	S	*	*			trans	155.3	151.1	149	-92.4	-174.5	-179.6	-170.1	-1.1	110.5
167	Q	27.8	Very low	34.1	Very low	151 Å²	151	144.5 Å²	144.5	71%	0.706	77%	0.771	S	S	*	*			cis	-160	161.3	-18	-166.6	161.9	-14.5	0	0	107.8
168	D	30.7	Very low	35.6	Very low	138 Å²	138	143.6 Å²	143.6	74%	0.738	76%	0.757	S	S	*	*			trans	-58.6	157.9	-176	-59	-86.8	0	0	0	116.2
169	S	28.7	Very low	37.3	Very low	119 Å²	119	133.6 Å²	133.6	83%	0.832	71%	0.713	S	S	*	*			trans	-143.8	111.1	154.3	-74.2	0	0	0	0	109.1	A171	S169-A171 PolarHBondContact O-N 3.17Å
170	L	37.3	Very low	39.2	Very low	174 Å²	174	124.5 Å²	124.5	91%	0.911	69%	0.69	S	S	*	*			trans	-72.2	121	-176.1	-73	84.1	0	0	0	111
171	A	29.6	Very low	41	Very low	93 Å²	93	126.5 Å²	126.5	77%	0.769	69%	0.686	S	S	*	*			trans	-134.5	94.8	170.5	0	0	0	0	0	110.9	S169	S169-A171 PolarHBondContact O-N 3.17Å
172	S	30.6	Very low	42.7	Very low	110 Å²	110	120.4 Å²	120.4	77%	0.769	66%	0.662	S	S	*	*			trans	36.3	85.4	164.4	-161	0	0	0	0	117.1	K174	S172-K174 VanDerWaalsContact C-N 3.34Å; S172-K174 PolarHBondContact O-N 3.42Å
173	A	31	Very low	44.3	Very low	103 Å²	103	123.4 Å²	123.4	85%	0.851	67%	0.671	S	S	*	*			trans	-66.7	88.9	167.6	0	0	0	0	0	110.8	R175	A173-R175 PolarHBondContact O-N 2.99Å
174	K	38.9	Very low	45.4	Very low	194 Å²	194	121.6 Å²	121.6	84%	0.843	66%	0.655	S	S	*	*			trans	-56.8	121.4	164.2	-80	-176.5	175.3	177	0	108.3	S172 G176	S172-K174 VanDerWaalsContact C-N 3.34Å; S172-K174 PolarHBondContact O-N 3.42Å; K174-G176 PolarHBondContact O-N 2.96Å
175	R	41.7	Very low	47.1	Very low	243 Å²	243	123.1 Å²	123.1	92%	0.917	65%	0.648	S	S	*	*			trans	-56.5	111.5	169.6	-72.6	-177.5	176.7	-178.8	-2.4	108.6	A173	A173-R175 PolarHBondContact O-N 2.99Å
176	G	43	Very low	48.6	Very low	61 Å²	61	123.4 Å²	123.4	63%	0.629	65%	0.647	S	S	*	*			trans	-73.4	125.3	160.8	0	0	0	0	0	108.1	K174 V178	K174-G176 PolarHBondContact O-N 2.96Å; G176-V178 PolarHBondContact O-N 3.22Å
177	S	54.4	Low	50.9	Low	32 Å²	32	113.3 Å²	113.3	22%	0.224	61%	0.612	C	S	.	*			trans	-54.4	126.8	166.9	167	0	0	0	0	108.9	V179	S177-V179 VanDerWaalsContact C-N 3.27Å; S177-V179 CarbonylContact C-O 3.58Å; S177-V179 WeakPolarHBondContact CB-O 3.42Å; S177-V179 PolarHBondContact OG-N 3.36Å; S177-V179 PolarHBondContact OG-O 2.66Å
178	V	59.4	Low	53.2	Low	61 Å²	61	107.1 Å²	107.1	37%	0.37	59%	0.585	S	S	.	*	S	Bend	trans	-70.8	-29.7	178	-172.9	0	0	0	0	110.8	G176 M502 M508	G176-V178 PolarHBondContact O-N 3.22Å; V178-M502 HydrophobicContact CG1-SD 4.06Å; V178-M508 HydrophobicContact CB-CE 3.99Å
179	V	62.6	Low	55.6	Low	0 Å²	0	100.9 Å²	100.9	0%	0	55%	0.551	C	S	.	*	S	Bend	trans	-69	128.8	164.9	165.4	0	0	0	0	109.3	S177 L199 K495 M502 M508 I516	S177-V179 VanDerWaalsContact C-N 3.27Å; S177-V179 CarbonylContact C-O 3.58Å; S177-V179 WeakPolarHBondContact CB-O 3.42Å; S177-V179 PolarHBondContact OG-N 3.36Å; S177-V179 PolarHBondContact OG-O 2.66Å; V179-L199 HydrophobicContact CB-CD2 3.95Å; V179-L199 HydrophobicContact CG1-CD2 3.62Å; V179-K495 HydrophobicContact CG1-CD 3.48Å; V179-K495 VanDerWaalsContact CG1-CD 3.48Å; V179-M502 HydrophobicContact CG2-CE 4.19Å; V179-M508 HydrophobicContact CB-CE 4.35Å; V179-M508 HydrophobicContact CG2-CE 3.62Å; V179-M508 HydrophobicContact CG2-SD 4.26Å; V179-I516 HydrophobicContact CG2-CD1 4.12Å
180	G	67.4	Low	57.8	Low	36 Å²	36	97 Å²	97	37%	0.371	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-68.2	134	-174.9	0	0	0	0	0	111.2	K495 E498	G180-K495 PolarHBondContact O-NZ 3Å; G180-E498 PolarHBondContact N-OE1 2.87Å
181	R	76.6	Confident	59.8	Low	137 Å²	137	97.2 Å²	97.2	52%	0.517	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-73.1	150.2	170.9	-70.6	-174	-178.9	138.7	3	110.8	L183 L199 D201	R181-L183 PolarHBondContact O-N 2.82Å; R181-L199 HydrophobicContact CG-CD1 3.75Å; R181-D201 IonicContact CZ-OD1 3.24Å; R181-D201 IonicContact CZ-OD2 2.77Å; R181-D201 IonicContact NE-OD2 2.79Å; R181-D201 PolarHBondContact NE-OD2 3.02Å; R181-D201 VanDerWaalsContact NE-OD2 3.12Å; R181-D201 IonicContact NH2-OD1 3.01Å; R181-D201 PolarHBondContact NH2-OD1 3.15Å; R181-D201 IonicContact NH2-OD2 2.66Å; R181-D201 PolarHBondContact NH2-OD2 2.98Å
182	N	63.5	Low	62.1	Low	62 Å²	62	93.4 Å²	93.4	33%	0.332	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-69	121.7	177.9	-174.4	-7.2	0	0	0	110.6	N184 S187 V190 E195	N182-N184 PolarHBondContact O-N 2.64Å; N182-N184 PolarHBondContact OD1-N 2.78Å; N182-S187 PolarHBondContact ND2-OG 2.95Å; N182-V190 HydrophobicContact CB-CG2 3.81Å; N182-E195 WeakPolarHBondContact CB-OE1 3.31Å; N182-E195 PolarHBondContact N-OE1 3Å; N182-E195 PolarHBondContact N-OE2 2.86Å
183	L	67.1	Low	64.6	Low	176 Å²	176	88.9 Å²	88.9	92%	0.921	45%	0.45	S	S	*	.	S	Bend	trans	-65.1	-24.7	179.7	-60.3	176.3	0	0	0	112.6	R181 R185	R181-L183 PolarHBondContact O-N 2.82Å; L183-R185 PolarHBondContact O-N 2.97Å; L183-R185 VanDerWaalsContact O-N 3.12Å
184	N	71.7	Confident	67.1	Low	83 Å²	83	84 Å²	84	44%	0.444	41%	0.409	S	S	.	.			trans	-83.6	86.9	176.5	-173.6	-3.4	0	0	0	111.4	N182 F186 S187	N182-N184 PolarHBondContact O-N 2.64Å; N182-N184 PolarHBondContact OD1-N 2.78Å; N184-F186 PolarHBondContact O-N 3.49Å; N184-F186 VanDerWaalsContact O-N 3.12Å; N184-F186 WeakPolarHBondContact OD1-CB 3.37Å; N184-F186 PolarHBondContact OD1-N 3.16Å; N184-S187 WeakPolarHBondContact O-CB 3.28Å; N184-S187 PolarHBondContact O-N 3.03Å; N184-S187 PolarHBondContact O-OG 2.93Å; N184-S187 PolarHBondContact OD1-N 3.26Å
185	R	64.9	Low	69.4	Low	206 Å²	206	75.2 Å²	75.2	78%	0.777	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-22.9	175.3	-167.9	177.8	-178.5	-168.1	-0.6	114.1	L183 V190	L183-R185 PolarHBondContact O-N 2.97Å; L183-R185 VanDerWaalsContact O-N 3.12Å; R185-V190 HydrophobicContact CG-CG1 4.38Å
186	F	65.9	Low	71.5	Confident	183 Å²	183	65.2 Å²	65.2	80%	0.803	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-8.1	179.6	-55.8	-76.9	0	0	0	113.7	N184	N184-F186 PolarHBondContact O-N 3.49Å; N184-F186 VanDerWaalsContact O-N 3.12Å; N184-F186 WeakPolarHBondContact OD1-CB 3.37Å; N184-F186 PolarHBondContact OD1-N 3.16Å
187	S	76.3	Confident	73.7	Confident	17 Å²	17	62.8 Å²	62.8	12%	0.119	31%	0.312	C	S	.	.	S	Bend	trans	-63.8	144.4	175.3	66.4	0	0	0	0	111.6	N182 N184 F189 V190 R191	N182-S187 PolarHBondContact ND2-OG 2.95Å; N184-S187 WeakPolarHBondContact O-CB 3.28Å; N184-S187 PolarHBondContact O-N 3.03Å; N184-S187 PolarHBondContact O-OG 2.93Å; N184-S187 PolarHBondContact OD1-N 3.26Å; S187-F189 PolarHBondContact O-N 3.24Å; S187-V190 PolarHBondContact O-N 2.83Å; S187-V190 WeakPolarHBondContact OG-CG2 3.44Å; S187-R191 PolarHBondContact O-N 3.1Å
188	C	76.6	Confident	75.3	Confident	22 Å²	22	61.2 Å²	61.2	15%	0.149	30%	0.302	C	S	.	.	H	α-helix	trans	-62.9	-29.4	-177.3	-160.3	0	0	0	0	112.4	V190 R191 S192 D484 L488	C188-V190 VanDerWaalsContact C-N 3.31Å; C188-V190 PolarHBondContact O-N 2.83Å; C188-R191 PolarHBondContact O-N 2.71Å; C188-S192 WeakPolarHBondContact O-CB 3.36Å; C188-S192 PolarHBondContact O-N 3Å; C188-S192 PolarHBondContact O-OG 3.22Å; C188-D484 PolarHBondContact SG-OD2 2.81Å; C188-L488 HydrophobicContact CB-CD2 4.4Å; C188-L488 WeakPolarHBondContact O-CD2 3.2Å
189	F	79.9	Confident	76.7	Confident	6 Å²	6	59.1 Å²	59.1	3%	0.026	29%	0.288	C	S	.	.	H	α-helix	trans	-61.1	-33.8	173.3	-174.5	-121.2	0	0	0	113.9	S187 S192 V194 E195 L488 G491 K495	S187-F189 PolarHBondContact O-N 3.24Å; F189-S192 PolarHBondContact O-OG 3.01Å; F189-V194 HydrophobicContact CD2-CB 4.15Å; F189-V194 HydrophobicContact CD2-CG1 4.21Å; F189-V194 HydrophobicContact CE2-CB 4.18Å; F189-V194 HydrophobicContact CE2-CG1 3.83Å; F189-V194 PolarHBondContact O-N 3.02Å; F189-E195 HydrophobicContact CD1-CB 3.79Å; F189-E195 HydrophobicContact CD1-CG 4.26Å; F189-E195 HydrophobicContact CE1-CB 3.49Å; F189-E195 VanDerWaalsContact CE1-CB 3.49Å; F189-E195 HydrophobicContact CE1-CG 3.65Å; F189-E195 HydrophobicContact CG-CB 4.43Å; F189-E195 HydrophobicContact CZ-CB 3.89Å; F189-E195 HydrophobicContact CZ-CG 4.22Å; F189-E195 PolarHBondContact O-N 2.89Å; F189-E195 VanDerWaalsContact O-N 3.14Å; F189-L488 HydrophobicContact CB-CD2 4.45Å; F189-L488 WeakPolarHBondContact CE2-O 3.34Å; F189-G491 VanDerWaalsContact CE2-C 3.48Å; F189-K495 HydrophobicContact CE1-CG 4.11Å; F189-K495 HydrophobicContact CZ-CG 4.01Å
190	V	75.2	Confident	77.7	Confident	37 Å²	37	61 Å²	61	22%	0.224	31%	0.308	C	S	.	.	H	α-helix	trans	-84.3	-45.5	173.4	179.5	0	0	0	0	111	N182 R185 S187 C188 S192 G193	N182-V190 HydrophobicContact CB-CG2 3.81Å; R185-V190 HydrophobicContact CG-CG1 4.38Å; S187-V190 PolarHBondContact O-N 2.83Å; S187-V190 WeakPolarHBondContact OG-CG2 3.44Å; C188-V190 VanDerWaalsContact C-N 3.31Å; C188-V190 PolarHBondContact O-N 2.83Å; V190-S192 PolarHBondContact O-N 2.79Å; V190-G193 WeakPolarHBondContact O-CA 3.32Å; V190-G193 PolarHBondContact O-N 3.23Å
191	R	79.1	Confident	78.5	Confident	180 Å²	180	62.5 Å²	62.5	68%	0.679	31%	0.307	S	S	*	.	H	α-helix	trans	-63.3	-35.8	-176.6	-173.6	-178.1	65.3	-175	-4.1	113.7	S187 C188 G193 D484	S187-R191 PolarHBondContact O-N 3.1Å; C188-R191 PolarHBondContact O-N 2.71Å; R191-G193 PolarHBondContact O-N 3.49Å; R191-D484 IonicContact NH2-OD2 2.75Å
192	S	79	Confident	78.8	Confident	13 Å²	13	57.2 Å²	57.2	9%	0.091	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-13.3	172.2	58.5	0	0	0	0	113.5	C188 F189 V190 V194 G355 A356 L488	C188-S192 WeakPolarHBondContact O-CB 3.36Å; C188-S192 PolarHBondContact O-N 3Å; C188-S192 PolarHBondContact O-OG 3.22Å; F189-S192 PolarHBondContact O-OG 3.01Å; V190-S192 PolarHBondContact O-N 2.79Å; S192-V194 PolarHBondContact O-N 3.39Å; S192-V194 WeakPolarHBondContact OG-CG2 3.13Å; S192-V194 PolarHBondContact OG-N 3.49Å; S192-G355 CarbonylContact O-C 3.55Å; S192-A356 PolarHBondContact O-N 3.35Å; S192-L488 VanDerWaalsContact OG-CD2 3.27Å; S192-L488 WeakPolarHBondContact OG-CD2 3.44Å
193	G	81.7	Confident	79.5	Confident	15 Å²	15	59 Å²	59	16%	0.155	31%	0.305	C	S	.	.	S	Bend	trans	70.9	6.9	-173	0	0	0	0	0	114.7	V190 R191 E195 A196 F197 A356	V190-G193 WeakPolarHBondContact O-CA 3.32Å; V190-G193 PolarHBondContact O-N 3.23Å; R191-G193 PolarHBondContact O-N 3.49Å; G193-E195 VanDerWaalsContact C-N 3.26Å; G193-E195 PolarHBondContact O-N 3.09Å; G193-A196 WeakPolarHBondContact O-CB 3.4Å; G193-A196 PolarHBondContact O-N 2.99Å; G193-F197 PolarHBondContact O-N 3.48Å; G193-A356 VanDerWaalsContact O-CB 3.23Å; G193-A356 WeakPolarHBondContact O-CB 3.38Å
194	V	85.2	Confident	79.6	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.3	-34.5	178.7	179.5	0	0	0	0	111.4	F189 S192 A196 F197 I198 L359 L488 V523	F189-V194 HydrophobicContact CD2-CB 4.15Å; F189-V194 HydrophobicContact CD2-CG1 4.21Å; F189-V194 HydrophobicContact CE2-CB 4.18Å; F189-V194 HydrophobicContact CE2-CG1 3.83Å; F189-V194 PolarHBondContact O-N 3.02Å; S192-V194 PolarHBondContact O-N 3.39Å; S192-V194 WeakPolarHBondContact OG-CG2 3.13Å; S192-V194 PolarHBondContact OG-N 3.49Å; V194-A196 VanDerWaalsContact C-N 3.34Å; V194-A196 PolarHBondContact O-N 3.12Å; V194-F197 PolarHBondContact O-N 2.76Å; V194-I198 HydrophobicContact CG1-CG1 3.97Å; V194-I198 WeakPolarHBondContact O-CB 3.4Å; V194-I198 VanDerWaalsContact O-CG1 3.23Å; V194-I198 WeakPolarHBondContact O-CG1 3.43Å; V194-I198 PolarHBondContact O-N 3.29Å; V194-L359 HydrophobicContact CG2-CD1 4.11Å; V194-L488 HydrophobicContact CG2-CB 4.38Å; V194-L488 HydrophobicContact CG2-CD1 3.95Å; V194-V523 HydrophobicContact CG1-CG2 4.19Å
195	E	87	Confident	79.4	Confident	10 Å²	10	58 Å²	58	5%	0.047	30%	0.296	C	S	.	.	H	α-helix	trans	-57.1	-46.9	171.5	-171.4	167.7	-117.9	0	0	112	N182 F189 G193 F197 I198 L199 K495	N182-E195 WeakPolarHBondContact CB-OE1 3.31Å; N182-E195 PolarHBondContact N-OE1 3Å; N182-E195 PolarHBondContact N-OE2 2.86Å; F189-E195 HydrophobicContact CD1-CB 3.79Å; F189-E195 HydrophobicContact CD1-CG 4.26Å; F189-E195 HydrophobicContact CE1-CB 3.49Å; F189-E195 VanDerWaalsContact CE1-CB 3.49Å; F189-E195 HydrophobicContact CE1-CG 3.65Å; F189-E195 HydrophobicContact CG-CB 4.43Å; F189-E195 HydrophobicContact CZ-CB 3.89Å; F189-E195 HydrophobicContact CZ-CG 4.22Å; F189-E195 PolarHBondContact O-N 2.89Å; F189-E195 VanDerWaalsContact O-N 3.14Å; G193-E195 VanDerWaalsContact C-N 3.26Å; G193-E195 PolarHBondContact O-N 3.09Å; E195-F197 VanDerWaalsContact C-N 3.35Å; E195-F197 PolarHBondContact O-N 2.79Å; E195-I198 PolarHBondContact O-N 3.38Å; E195-L199 HydrophobicContact CG-CD1 3.96Å; E195-L199 HydrophobicContact CG-CG 4.31Å; E195-L199 WeakPolarHBondContact O-CG 3.47Å; E195-L199 PolarHBondContact O-N 2.91Å; E195-K495 VanDerWaalsContact OE1-CE 3.23Å; E195-K495 WeakPolarHBondContact OE1-CE 3.07Å; E195-K495 IonicContact OE1-NZ 3.33Å
196	A	85.8	Confident	78.9	Confident	33 Å²	33	53.4 Å²	53.4	27%	0.273	30%	0.302	S	S	.	.	H	α-helix	trans	-63.9	-38.9	178.8	0	0	0	0	0	112.1	G193 V194 G200 D201 V202	G193-A196 WeakPolarHBondContact O-CB 3.4Å; G193-A196 PolarHBondContact O-N 2.99Å; V194-A196 VanDerWaalsContact C-N 3.34Å; V194-A196 PolarHBondContact O-N 3.12Å; A196-G200 PolarHBondContact O-N 2.9Å; A196-D201 HydrophobicContact CB-CB 4.01Å; A196-D201 PolarHBondContact O-N 2.89Å; A196-V202 HydrophobicContact CB-CG2 4.25Å
197	F	88.8	Confident	78.9	Confident	9 Å²	9	53.5 Å²	53.5	4%	0.039	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-49	172.7	176.8	-99.9	0	0	0	111.3	G193 V194 E195 L199 G200 V202 A356 L359 L360 R519 V522 V523	G193-F197 PolarHBondContact O-N 3.48Å; V194-F197 PolarHBondContact O-N 2.76Å; E195-F197 VanDerWaalsContact C-N 3.35Å; E195-F197 PolarHBondContact O-N 2.79Å; F197-L199 PolarHBondContact O-N 3.49Å; F197-G200 PolarHBondContact O-N 3.38Å; F197-G200 VanDerWaalsContact O-N 3.09Å; F197-V202 HydrophobicContact CB-CG2 4.09Å; F197-A356 HydrophobicContact CB-CB 4.23Å; F197-L359 HydrophobicContact CB-CD1 4.06Å; F197-L359 HydrophobicContact CD1-CB 4.14Å; F197-L359 HydrophobicContact CD1-CD1 3.51Å; F197-L359 HydrophobicContact CD1-CG 4.49Å; F197-L359 HydrophobicContact CD2-CB 3.77Å; F197-L359 HydrophobicContact CD2-CD1 4.25Å; F197-L359 HydrophobicContact CE1-CB 3.92Å; F197-L359 HydrophobicContact CE1-CD1 3.93Å; F197-L359 HydrophobicContact CE2-CB 3.54Å; F197-L359 HydrophobicContact CG-CB 4.06Å; F197-L359 HydrophobicContact CG-CD1 3.68Å; F197-L359 HydrophobicContact CZ-CB 3.62Å; F197-L359 HydrophobicContact CZ-CD1 4.47Å; F197-L360 HydrophobicContact CD2-CD2 4.44Å; F197-L360 HydrophobicContact CE2-CD2 3.85Å; F197-L360 HydrophobicContact CE2-CG 4.15Å; F197-R519 HydrophobicContact CD1-CB 4.2Å; F197-R519 HydrophobicContact CE1-CB 3.78Å; F197-R519 HydrophobicContact CE1-CG 4.34Å; F197-R519 WeakPolarHBondContact CE1-O 3.39Å; F197-R519 HydrophobicContact CZ-CB 4.27Å; F197-R519 HydrophobicContact CZ-CG 4.34Å; F197-R519 WeakPolarHBondContact O-CD 3.3Å; F197-R519 PolarHBondContact O-NE 3.39Å; F197-V522 HydrophobicContact CE1-CB 4.17Å; F197-V522 HydrophobicContact CE1-CG1 4.37Å; F197-V522 HydrophobicContact CZ-CB 4.13Å; F197-V522 HydrophobicContact CZ-CG1 4.06Å; F197-V522 HydrophobicContact CZ-CG2 4.47Å; F197-V523 HydrophobicContact CD1-CG2 4.18Å; F197-V523 HydrophobicContact CE1-CG2 4.09Å
198	I	88.6	Confident	78.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.9	-41.7	-179	-67.5	-64.4	0	0	0	111.5	V194 E195 G200 A492 K495 I516 R519 C520 V523	V194-I198 HydrophobicContact CG1-CG1 3.97Å; V194-I198 WeakPolarHBondContact O-CB 3.4Å; V194-I198 VanDerWaalsContact O-CG1 3.23Å; V194-I198 WeakPolarHBondContact O-CG1 3.43Å; V194-I198 PolarHBondContact O-N 3.29Å; E195-I198 PolarHBondContact O-N 3.38Å; I198-G200 VanDerWaalsContact C-N 3.32Å; I198-G200 PolarHBondContact O-N 3.17Å; I198-A492 HydrophobicContact CD1-CB 3.7Å; I198-A492 HydrophobicContact CG1-CB 3.86Å; I198-K495 HydrophobicContact CG2-CB 3.81Å; I198-K495 HydrophobicContact CG2-CG 4.38Å; I198-I516 HydrophobicContact CG2-CG2 3.84Å; I198-R519 HydrophobicContact CD1-CB 4.28Å; I198-R519 VanDerWaalsContact O-CZ 3.29Å; I198-R519 PolarHBondContact O-NE 3.36Å; I198-R519 PolarHBondContact O-NH2 3Å; I198-C520 VanDerWaalsContact CD1-CA 3.48Å; I198-C520 HydrophobicContact CD1-CB 4.02Å; I198-V523 HydrophobicContact CD1-CG2 4.01Å
199	L	87.1	Confident	78.7	Confident	17 Å²	17	60 Å²	60	9%	0.089	35%	0.347	C	S	.	.	H	α-helix	trans	-72.2	-22.1	175.4	-63.7	-179.6	0	0	0	113.6	V179 R181 E195 F197 K495 I516 R519	V179-L199 HydrophobicContact CB-CD2 3.95Å; V179-L199 HydrophobicContact CG1-CD2 3.62Å; R181-L199 HydrophobicContact CG-CD1 3.75Å; E195-L199 HydrophobicContact CG-CD1 3.96Å; E195-L199 HydrophobicContact CG-CG 4.31Å; E195-L199 WeakPolarHBondContact O-CG 3.47Å; E195-L199 PolarHBondContact O-N 2.91Å; F197-L199 PolarHBondContact O-N 3.49Å; L199-K495 HydrophobicContact CD2-CD 4.49Å; L199-I516 HydrophobicContact CD2-CD1 4.41Å; L199-R519 PolarHBondContact O-NH2 2.75Å
200	G	84.3	Confident	78.9	Confident	40 Å²	40	61.6 Å²	61.6	41%	0.412	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	20.3	-175.7	0	0	0	0	0	113.7	A196 F197 I198 V202	A196-G200 PolarHBondContact O-N 2.9Å; F197-G200 PolarHBondContact O-N 3.38Å; F197-G200 VanDerWaalsContact O-N 3.09Å; I198-G200 VanDerWaalsContact C-N 3.32Å; I198-G200 PolarHBondContact O-N 3.17Å; G200-V202 PolarHBondContact O-N 3.39Å
201	D	84.9	Confident	79.6	Confident	67 Å²	67	62.9 Å²	62.9	36%	0.358	36%	0.363	S	S	.	.			trans	-74.5	-11.8	174.3	-76.3	-46.1	0	0	0	112.9	R181 A196 P203	R181-D201 IonicContact CZ-OD1 3.24Å; R181-D201 IonicContact CZ-OD2 2.77Å; R181-D201 IonicContact NE-OD2 2.79Å; R181-D201 PolarHBondContact NE-OD2 3.02Å; R181-D201 VanDerWaalsContact NE-OD2 3.12Å; R181-D201 IonicContact NH2-OD1 3.01Å; R181-D201 PolarHBondContact NH2-OD1 3.15Å; R181-D201 IonicContact NH2-OD2 2.66Å; R181-D201 PolarHBondContact NH2-OD2 2.98Å; A196-D201 HydrophobicContact CB-CB 4.01Å; A196-D201 PolarHBondContact O-N 2.89Å; D201-P203 WeakPolarHBondContact O-CD 3.32Å
202	V	82.3	Confident	80.2	Confident	26 Å²	26	54.8 Å²	54.8	16%	0.158	33%	0.332	C	S	.	.	S	Bend	trans	-74.3	122.7	177.6	179.8	0	0	0	0	110.2	A196 F197 G200 M204 A356 L360	A196-V202 HydrophobicContact CB-CG2 4.25Å; F197-V202 HydrophobicContact CB-CG2 4.09Å; G200-V202 PolarHBondContact O-N 3.39Å; V202-M204 PolarHBondContact O-N 3.35Å; V202-A356 HydrophobicContact CG2-CB 3.61Å; V202-L360 HydrophobicContact CG1-CD1 3.85Å
203	P	77.8	Confident	81	Confident	98 Å²	98	55.6 Å²	55.6	64%	0.636	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-61.2	135.1	175.5	-22.6	33.9	0	0	0	112.1	D201 M205	D201-P203 WeakPolarHBondContact O-CD 3.32Å; P203-M205 PolarHBondContact O-N 3.07Å
204	M	68.6	Low	81.7	Confident	179 Å²	179	55.2 Å²	55.2	88%	0.882	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-67.5	118	168.7	-92.2	-165.8	163.4	0	0	110.1	V202	V202-M204 PolarHBondContact O-N 3.35Å
205	M	67.4	Low	82.2	Confident	59 Å²	59	58.8 Å²	58.8	29%	0.291	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-82.4	134.8	178.1	-63.7	-163.7	143	0	0	111.2	P203 K207 E352 M353	P203-M205 PolarHBondContact O-N 3.07Å; M205-K207 PolarHBondContact O-N 3.33Å; M205-K207 VanDerWaalsContact O-N 3.09Å; M205-E352 HydrophobicContact CE-CB 3.82Å; M205-E352 VanDerWaalsContact CE-OE2 3.29Å; M205-E352 WeakPolarHBondContact CE-OE2 3.48Å; M205-E352 HydrophobicContact SD-CB 4.02Å; M205-M353 HydrophobicContact CB-SD 4.42Å; M205-M353 HydrophobicContact CG-SD 4.43Å; M205-M353 HydrophobicContact SD-SD 3.65Å; M205-M353 VanDerWaalsContact SD-SD 3.65Å
206	A	56	Low	82.5	Confident	110 Å²	110	61.7 Å²	61.7	91%	0.909	36%	0.363	S	S	*	.	S	Bend	trans	-68.2	-10.4	-171.1	0	0	0	0	0	114.8
207	K	65.8	Low	82.8	Confident	185 Å²	185	61 Å²	61	80%	0.804	36%	0.359	S	S	*	.			trans	-144.1	98.4	175.5	-69.7	-174.4	179	178.3	0	110.9	M205 A209	M205-K207 PolarHBondContact O-N 3.33Å; M205-K207 VanDerWaalsContact O-N 3.09Å; K207-A209 PolarHBondContact O-N 3.42Å
208	I	75.3	Confident	83	Confident	77 Å²	77	67 Å²	67	40%	0.395	40%	0.399	S	S	.	.			trans	-81.2	104.5	164.1	-64.4	172.7	0	0	0	106.8	E210 M353 L360 T361	I208-E210 WeakPolarHBondContact CG2-O 3.48Å; I208-M353 HydrophobicContact CG1-CE 4.26Å; I208-L360 HydrophobicContact CD1-CB 4.14Å; I208-T361 HydrophobicContact CG2-CG2 4.4Å
209	A	73.8	Confident	83.1	Confident	100 Å²	100	72.7 Å²	72.7	83%	0.826	42%	0.421	S	S	*	.			trans	-93.7	-31.1	-175.2	0	0	0	0	0	113.6	K207	K207-A209 PolarHBondContact O-N 3.42Å
210	E	83.4	Confident	83.4	Confident	38 Å²	38	72.6 Å²	72.6	18%	0.178	42%	0.424	C	S	.	.			trans	-95.5	149.4	170.9	-66.6	-177.4	-179	0	0	110.1	I208 Y212 K280 T361	I208-E210 WeakPolarHBondContact CG2-O 3.48Å; E210-Y212 HydrophobicContact CB-CE2 3.93Å; E210-Y212 WeakPolarHBondContact OE2-CE2 3.44Å; E210-Y212 PolarHBondContact OE2-OH 3.1Å; E210-K280 IonicContact OE1-NZ 2.8Å; E210-K280 PolarHBondContact OE1-NZ 2.99Å; E210-K280 VanDerWaalsContact OE2-CE 3.28Å; E210-K280 WeakPolarHBondContact OE2-CE 3.48Å; E210-K280 IonicContact OE2-NZ 2.58Å; E210-K280 PolarHBondContact OE2-NZ 2.84Å; E210-T361 HydrophobicContact CB-CG2 4.42Å
211	T	88.8	Confident	83.9	Confident	65 Å²	65	70.7 Å²	70.7	40%	0.399	40%	0.404	S	S	.	.			trans	-151.1	130	174.9	-66.9	0	0	0	0	110.1	T361 Q363	T211-T361 WeakPolarHBondContact CA-O 3.42Å; T211-Q363 VanDerWaalsContact CG2-CD 3.42Å; T211-Q363 HydrophobicContact CG2-CG 3.72Å
212	Y	93.2	Very high	84.5	Confident	9 Å²	9	69.4 Å²	69.4	4%	0.035	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	122	178.9	-50.7	-92.3	0	0	0	108.9	E210 V322 Q325 F358 T361 F362 Q363	E210-Y212 HydrophobicContact CB-CE2 3.93Å; E210-Y212 WeakPolarHBondContact OE2-CE2 3.44Å; E210-Y212 PolarHBondContact OE2-OH 3.1Å; Y212-V322 HydrophobicContact CD1-CB 4.16Å; Y212-V322 HydrophobicContact CD1-CG1 3.77Å; Y212-V322 HydrophobicContact CD1-CG2 4.18Å; Y212-V322 HydrophobicContact CE1-CB 4.43Å; Y212-V322 HydrophobicContact CE1-CG1 3.77Å; Y212-V322 HydrophobicContact CG-CG1 4.22Å; Y212-V322 HydrophobicContact CG-CG2 4.5Å; Y212-Q325 HydrophobicContact CE1-CB 4.13Å; Y212-F358 HydrophobicContact CD2-CE2 4.01Å; Y212-F358 AromaticContact CE2-CE2 3.78Å; Y212-F358 HydrophobicContact CE2-CE2 3.78Å; Y212-T361 WeakPolarHBondContact CD2-OG1 3.23Å; Y212-T361 PolarHBondContact N-O 3.22Å; Y212-F362 HydrophobicContact CD2-CD1 4.5Å; Y212-F362 HydrophobicContact CD2-CE1 4.41Å; Y212-F362 WeakPolarHBondContact O-CA 3.46Å; Y212-Q363 PolarHBondContact O-N 3.11Å
213	S	94.8	Very high	85.2	Confident	30 Å²	30	68.9 Å²	68.9	21%	0.21	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	141.5	-179.2	-44.4	0	0	0	0	111.7	K224 Q363	S213-K224 VanDerWaalsContact O-CB 3.24Å; S213-K224 WeakPolarHBondContact O-CB 3.4Å; S213-K224 PolarHBondContact O-N 2.85Å; S213-Q363 PolarHBondContact OG-OE1 3.34Å
214	I	96.6	Very high	86.1	Confident	8 Å²	8	69.5 Å²	69.5	4%	0.041	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	134.8	166.8	-63.3	168.4	0	0	0	107.4	P221 Q222 W223 Q363 I364 P365 F525 A526 A529	I214-P221 HydrophobicContact CG2-CB 3.97Å; I214-Q222 WeakPolarHBondContact CA-O 3.48Å; I214-W223 HydrophobicContact CD1-CE3 4.25Å; I214-W223 HydrophobicContact CD1-CH2 3.88Å; I214-W223 HydrophobicContact CD1-CZ3 3.59Å; I214-W223 HydrophobicContact CG1-CE3 3.59Å; I214-W223 HydrophobicContact CG1-CH2 4.15Å; I214-W223 HydrophobicContact CG1-CZ3 3.38Å; I214-Q363 PolarHBondContact N-O 2.86Å; I214-I364 HydrophobicContact CD1-CG2 4.32Å; I214-P365 HydrophobicContact CG2-CG 4.4Å; I214-P365 WeakPolarHBondContact O-CD 3.42Å; I214-P365 WeakPolarHBondContact O-CG 3.26Å; I214-F525 HydrophobicContact CD1-CB 4Å; I214-F525 HydrophobicContact CG2-CB 4.43Å; I214-A526 HydrophobicContact CD1-CB 4.12Å; I214-A529 HydrophobicContact CD1-CB 4.4Å; I214-A529 HydrophobicContact CG1-CB 4.3Å; I214-A529 HydrophobicContact CG2-CB 4.23Å
215	E	95.1	Very high	87.3	Confident	74 Å²	74	64.3 Å²	64.3	35%	0.346	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	161	-179.2	61.2	179.9	-143.3	0	0	110.7	P221 Q222 K224	E215-P221 CarbonylContact O-C 3.57Å; E215-P221 WeakPolarHBondContact O-CA 3.47Å; E215-Q222 HydrophobicContact CG-CG 3.66Å; E215-Q222 PolarHBondContact N-O 3.13Å; E215-Q222 PolarHBondContact O-N 3.28Å; E215-Q222 PolarHBondContact OE1-NE2 3.35Å; E215-K224 HydrophobicContact CG-CB 4.37Å; E215-K224 WeakPolarHBondContact OE2-CG 3.5Å
216	M	94.9	Very high	88.6	Confident	71 Å²	71	62.4 Å²	62.4	35%	0.35	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	109.1	177.2	-65.6	-58.1	-68.6	0	0	109.8	P221 P365 E367 F525	M216-P221 HydrophobicContact CE-CG 4.22Å; M216-P221 HydrophobicContact SD-CB 4.26Å; M216-P221 HydrophobicContact SD-CG 3.78Å; M216-P365 HydrophobicContact CG-CB 3.85Å; M216-P365 HydrophobicContact CG-CG 3.74Å; M216-P365 HydrophobicContact SD-CB 4.31Å; M216-P365 HydrophobicContact SD-CG 3.89Å; M216-E367 WeakPolarHBondContact CE-OE2 3.46Å; M216-E367 WeakPolarHBondContact CG-OE2 3.34Å; M216-F525 HydrophobicContact SD-CE1 4.03Å
217	G	92.2	Very high	90.3	Very high	18 Å²	18	61.2 Å²	61.2	19%	0.186	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	-179.4	175.7	0	0	0	0	0	113	R219 G220	G217-R219 PolarHBondContact O-N 2.92Å; G217-G220 PolarHBondContact N-O 3.01Å; G217-G220 PolarHBondContact O-N 2.7Å
218	P	91.9	Very high	91.6	Very high	135 Å²	135	59.5 Å²	59.5	88%	0.877	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-6.3	-178.9	28.5	-36.2	0	0	0	114.4
219	R	90.5	Very high	92.5	Very high	120 Å²	120	61 Å²	61	45%	0.453	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	18	171.9	-72.4	-172.9	-89.1	-158.4	-8.8	112.6	G217 N532 E539	G217-R219 PolarHBondContact O-N 2.92Å; R219-N532 PolarHBondContact O-ND2 3.28Å; R219-E539 IonicContact CZ-OE2 3.93Å; R219-E539 IonicContact NH1-OE1 2.76Å; R219-E539 IonicContact NH1-OE2 3.74Å; R219-E539 PolarHBondContact NH1-OE2 3.38Å; R219-E539 IonicContact NH2-OE2 2.72Å
220	G	92.8	Very high	93.5	Very high	15 Å²	15	57.3 Å²	57.3	16%	0.155	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	86	-151.4	-170.9	0	0	0	0	0	112	G217 Q222	G217-G220 PolarHBondContact N-O 3.01Å; G217-G220 PolarHBondContact O-N 2.7Å; G220-Q222 PolarHBondContact O-N 2.81Å
221	P	96.1	Very high	94.1	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.006	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	135.6	-175.6	-24.8	34.6	0	0	0	113.1	I214 E215 M216 F525 Q528 A529 N532	I214-P221 HydrophobicContact CG2-CB 3.97Å; E215-P221 CarbonylContact O-C 3.57Å; E215-P221 WeakPolarHBondContact O-CA 3.47Å; M216-P221 HydrophobicContact CE-CG 4.22Å; M216-P221 HydrophobicContact SD-CB 4.26Å; M216-P221 HydrophobicContact SD-CG 3.78Å; P221-F525 HydrophobicContact CB-CD1 3.89Å; P221-F525 HydrophobicContact CG-CD1 3.58Å; P221-F525 HydrophobicContact CG-CE1 3.86Å; P221-Q528 HydrophobicContact CB-CB 3.88Å; P221-Q528 HydrophobicContact CG-CB 3.86Å; P221-A529 WeakPolarHBondContact O-CA 3.36Å; P221-N532 PolarHBondContact O-ND2 3.22Å
222	Q	96.6	Very high	94.5	Very high	39 Å²	39	55 Å²	55	18%	0.182	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	152.8	174.9	67.2	-175.8	21.6	0	0	111.1	I214 E215 G220 K224	I214-Q222 WeakPolarHBondContact CA-O 3.48Å; E215-Q222 HydrophobicContact CG-CG 3.66Å; E215-Q222 PolarHBondContact N-O 3.13Å; E215-Q222 PolarHBondContact O-N 3.28Å; E215-Q222 PolarHBondContact OE1-NE2 3.35Å; G220-Q222 PolarHBondContact O-N 2.81Å; Q222-K224 PolarHBondContact O-N 3.44Å
223	W	97.1	Very high	94.7	Very high	15 Å²	15	56.4 Å²	56.4	6%	0.057	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	127.4	170.6	-67.7	124.2	0	0	0	109.4	I214 A225 I284 H320 P321 V322 F362 A526 A529 E530	I214-W223 HydrophobicContact CD1-CE3 4.25Å; I214-W223 HydrophobicContact CD1-CH2 3.88Å; I214-W223 HydrophobicContact CD1-CZ3 3.59Å; I214-W223 HydrophobicContact CG1-CE3 3.59Å; I214-W223 HydrophobicContact CG1-CH2 4.15Å; I214-W223 HydrophobicContact CG1-CZ3 3.38Å; W223-A225 PolarHBondContact O-N 2.75Å; W223-I284 HydrophobicContact CH2-CD1 4.05Å; W223-I284 HydrophobicContact CZ2-CD1 3.31Å; W223-H320 AromaticContact CD1-CE1 4Å; W223-H320 AromaticContact NE1-CE1 3.96Å; W223-P321 HydrophobicContact CB-CB 3.96Å; W223-P321 HydrophobicContact CB-CG 3.97Å; W223-V322 HydrophobicContact CD2-CG2 3.55Å; W223-V322 HydrophobicContact CE3-CG2 3.56Å; W223-V322 HydrophobicContact CG-CG2 4.09Å; W223-V322 HydrophobicContact CH2-CG2 4.28Å; W223-V322 HydrophobicContact CZ2-CG2 4.26Å; W223-V322 HydrophobicContact CZ3-CG2 3.91Å; W223-F362 HydrophobicContact CH2-CD1 4.41Å; W223-F362 AromaticContact CH2-CE1 3.77Å; W223-F362 HydrophobicContact CH2-CE1 3.77Å; W223-F362 AromaticContact CH2-CE2 3.98Å; W223-F362 HydrophobicContact CH2-CE2 3.98Å; W223-F362 AromaticContact CH2-CZ 3.51Å; W223-F362 HydrophobicContact CH2-CZ 3.51Å; W223-F362 HydrophobicContact CZ2-CZ 4.48Å; W223-F362 HydrophobicContact CZ3-CD1 4.24Å; W223-F362 AromaticContact CZ3-CE1 3.89Å; W223-F362 HydrophobicContact CZ3-CE1 3.89Å; W223-F362 HydrophobicContact CZ3-CZ 4.12Å; W223-A526 HydrophobicContact CH2-CB 3.79Å; W223-A526 HydrophobicContact CZ2-CB 4.19Å; W223-A529 HydrophobicContact CD2-CB 3.8Å; W223-A529 HydrophobicContact CE3-CB 4.33Å; W223-A529 HydrophobicContact CG-CB 4.01Å; W223-A529 HydrophobicContact CZ2-CB 4.15Å; W223-E530 PolarHBondContact NE1-OE2 3.37Å
224	K	96.4	Very high	94.7	Very high	112 Å²	112	55.3 Å²	55.3	49%	0.487	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-59.4	134	170.8	-179.9	174.8	-179.4	-177.9	0	109.4	S213 E215 Q222 P321	S213-K224 VanDerWaalsContact O-CB 3.24Å; S213-K224 WeakPolarHBondContact O-CB 3.4Å; S213-K224 PolarHBondContact O-N 2.85Å; E215-K224 HydrophobicContact CG-CB 4.37Å; E215-K224 WeakPolarHBondContact OE2-CG 3.5Å; Q222-K224 PolarHBondContact O-N 3.44Å; K224-P321 WeakPolarHBondContact O-CB 3.35Å
225	A	95.1	Very high	94.6	Very high	69 Å²	69	58 Å²	58	57%	0.57	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-58.3	145.4	-178.3	0	0	0	0	0	112.2	W223	W223-A225 PolarHBondContact O-N 2.75Å
226	N	93.9	Very high	94.1	Very high	19 Å²	19	58.3 Å²	58.3	10%	0.102	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-58.6	126.7	173.7	176.7	-13.4	0	0	0	109.3	H228 P229 S324 Q325	N226-H228 PolarHBondContact O-N 2.69Å; N226-H228 PolarHBondContact OD1-N 3.44Å; N226-H228 PolarHBondContact OD1-O 3.31Å; N226-P229 WeakPolarHBondContact O-CD 3.39Å; N226-P229 WeakPolarHBondContact O-CG 3.24Å; N226-S324 PolarHBondContact ND2-OG 3.21Å; N226-Q325 HydrophobicContact CB-CG 4.17Å
227	P	92.1	Very high	93.8	Very high	86 Å²	86	57 Å²	57	56%	0.558	33%	0.328	S	S	*	.	S	Bend	trans	-66.3	-17.9	-179.4	28.1	-36.2	0	0	0	113.7
228	H	92.6	Very high	93.7	Very high	149 Å²	149	58.8 Å²	58.8	69%	0.69	34%	0.335	S	S	*	.	S	Bend	trans	-128.7	73	178	-56.2	-41.6	0	0	0	110.5	N226	N226-H228 PolarHBondContact O-N 2.69Å; N226-H228 PolarHBondContact OD1-N 3.44Å; N226-H228 PolarHBondContact OD1-O 3.31Å
229	P	94.6	Very high	93.6	Very high	108 Å²	108	58.8 Å²	58.8	70%	0.701	32%	0.321	S	S	*	.			trans	-61.7	141.2	178	-19.7	32.7	0	0	0	111.8	N226	N226-P229 WeakPolarHBondContact O-CD 3.39Å; N226-P229 WeakPolarHBondContact O-CG 3.24Å
230	F	95.7	Very high	93.4	Very high	22 Å²	22	55.8 Å²	55.8	10%	0.096	31%	0.312	C	S	.	.			trans	-149.5	165.9	175.9	69.2	-84	0	0	0	110.2	T257 H258 T318 S324 F329 Q330 L333	F230-T257 WeakPolarHBondContact CB-OG1 2.98Å; F230-H258 VanDerWaalsContact CB-ND1 3.34Å; F230-H258 WeakPolarHBondContact CB-ND1 3.5Å; F230-H258 AromaticContact CD1-ND1 3.84Å; F230-H258 AromaticContact CD2-CE1 3.53Å; F230-H258 AromaticContact CD2-ND1 3.52Å; F230-H258 AromaticContact CE2-CE1 3.85Å; F230-H258 AromaticContact CG-CE1 3.64Å; F230-H258 AromaticContact CG-ND1 3.27Å; F230-H258 VanDerWaalsContact CG-ND1 3.27Å; F230-H258 WeakPolarHBondContact CG-ND1 3.45Å; F230-T318 HydrophobicContact CD2-CG2 4.03Å; F230-T318 HydrophobicContact CE2-CG2 3.45Å; F230-T318 VanDerWaalsContact CE2-CG2 3.45Å; F230-T318 HydrophobicContact CZ-CG2 4.03Å; F230-S324 WeakPolarHBondContact CE1-O 3.47Å; F230-F329 HydrophobicContact CE2-CE1 4.49Å; F230-F329 HydrophobicContact CZ-CD1 4.49Å; F230-F329 AromaticContact CZ-CE1 3.99Å; F230-F329 HydrophobicContact CZ-CE1 3.99Å; F230-Q330 VanDerWaalsContact CZ-NE2 3.32Å; F230-L333 HydrophobicContact CE2-CD1 3.46Å; F230-L333 VanDerWaalsContact CE2-CD1 3.46Å; F230-L333 HydrophobicContact CZ-CD1 3.94Å
231	A	96.2	Very high	93.1	Very high	41 Å²	41	59.1 Å²	59.1	34%	0.339	33%	0.33	S	S	.	.			trans	-122	167.4	167.5	0	0	0	0	0	109.7	P256 T257	A231-P256 CarbonylContact O-C 3.58Å; A231-P256 WeakPolarHBondContact O-CA 3.34Å; A231-T257 HydrophobicContact CB-CG2 4.02Å; A231-T257 PolarHBondContact N-OG1 3.06Å; A231-T257 PolarHBondContact O-N 3.2Å; A231-T257 PolarHBondContact O-OG1 2.94Å
232	C	96.6	Very high	92.3	Very high	14 Å²	14	63.2 Å²	63.2	10%	0.095	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	125.9	172.1	-178	0	0	0	0	110.1	T255 M314 T318 L333	C232-T255 WeakPolarHBondContact CA-O 3.42Å; C232-M314 HydrophobicContact CB-CG 3.75Å; C232-M314 HydrophobicContact CB-SD 3.84Å; C232-M314 WeakPolarHBondContact O-CG 3.3Å; C232-T318 HydrophobicContact CB-CG2 4.19Å; C232-L333 HydrophobicContact CB-CD2 4.42Å
233	S	96.4	Very high	91.5	Very high	39 Å²	39	67.1 Å²	67.1	27%	0.273	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	157.6	171.4	71	0	0	0	0	111.4	E235 L254 T255	S233-E235 WeakPolarHBondContact CB-OE1 3.42Å; S233-E235 PolarHBondContact OG-OE1 3.2Å; S233-L254 WeakPolarHBondContact O-CA 3.42Å; S233-T255 PolarHBondContact N-O 2.88Å; S233-T255 VanDerWaalsContact N-O 3.1Å; S233-T255 PolarHBondContact O-N 3.26Å; S233-T255 WeakPolarHBondContact OG-CB 3.36Å; S233-T255 PolarHBondContact OG-OG1 3.33Å
234	V	96.4	Very high	90.6	Very high	6 Å²	6	77.2 Å²	77.2	4%	0.036	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	108.1	174.1	-169.8	0	0	0	0	108.2	Y252 L254 L310 I311 M314	V234-Y252 HydrophobicContact CG1-CD1 4.33Å; V234-Y252 HydrophobicContact CG1-CG 4.38Å; V234-L254 HydrophobicContact CB-CD2 4.07Å; V234-L254 HydrophobicContact CG1-CD2 3.87Å; V234-L254 HydrophobicContact CG2-CD2 3.7Å; V234-L310 HydrophobicContact CG1-CB 4.26Å; V234-I311 HydrophobicContact CB-CG1 3.77Å; V234-I311 HydrophobicContact CG2-CG1 4.28Å; V234-M314 HydrophobicContact CG2-CB 3.72Å; V234-M314 HydrophobicContact CG2-CE 4.43Å; V234-M314 HydrophobicContact CG2-CG 3.95Å
235	E	93.1	Very high	89.6	Confident	65 Å²	65	73.5 Å²	73.5	30%	0.304	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	177.2	-163.4	-73.8	169.3	-148	0	0	112	S233 K253	S233-E235 WeakPolarHBondContact CB-OE1 3.42Å; S233-E235 PolarHBondContact OG-OE1 3.2Å; E235-K253 HydrophobicContact CB-CB 4.25Å; E235-K253 HydrophobicContact CB-CD 4.02Å; E235-K253 HydrophobicContact CB-CG 4.42Å; E235-K253 PolarHBondContact N-O 3.36Å; E235-K253 PolarHBondContact O-N 2.98Å; E235-K253 WeakPolarHBondContact OE2-CE 3.46Å; E235-K253 IonicContact OE2-NZ 2.82Å; E235-K253 PolarHBondContact OE2-NZ 2.88Å
236	D	85.2	Confident	88.8	Confident	80 Å²	80	77 Å²	77	43%	0.428	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	40.3	69.1	162.6	-55	-16.6	0	0	0	114.8	T238 K253	D236-T238 PolarHBondContact O-N 3.44Å; D236-K253 HydrophobicContact CB-CB 4Å; D236-K253 HydrophobicContact CB-CD 3.89Å; D236-K253 WeakPolarHBondContact OD2-CD 3.48Å; D236-K253 WeakPolarHBondContact OD2-CE 3.16Å; D236-K253 IonicContact OD2-NZ 2.78Å; D236-K253 PolarHBondContact OD2-NZ 3.24Å
237	P	88.8	Confident	88.3	Confident	44 Å²	44	82.3 Å²	82.3	29%	0.286	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	89.4	178.9	29.7	-34.9	0	0	0	110.8	I250 S251 Y252 I303 K307	P237-I250 HydrophobicContact CB-CG2 3.96Å; P237-S251 CarbonylContact C-O 3.49Å; P237-S251 WeakPolarHBondContact CA-O 3.47Å; P237-Y252 HydrophobicContact CB-CD1 4.02Å; P237-Y252 HydrophobicContact CB-CE1 3.8Å; P237-I303 HydrophobicContact CB-CG2 3.59Å; P237-I303 HydrophobicContact CG-CG2 3.91Å; P237-K307 HydrophobicContact CG-CD 4.14Å
238	T	89.1	Confident	88.1	Confident	56 Å²	56	79.5 Å²	79.5	34%	0.344	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	133.1	-172.9	48.4	0	0	0	0	112	D236 Q240 I250 S251	D236-T238 PolarHBondContact O-N 3.44Å; T238-Q240 PolarHBondContact O-N 3.46Å; T238-I250 WeakPolarHBondContact O-CA 3.36Å; T238-S251 PolarHBondContact N-O 2.85Å; T238-S251 PolarHBondContact O-N 3.33Å; T238-S251 PolarHBondContact OG1-O 3.29Å
239	K	89.6	Confident	87.9	Confident	134 Å²	134	74.2 Å²	74.2	58%	0.583	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	108.1	172.5	-173.5	-178.1	179.1	-175.9	0	109.7	Y249 I250 F298	K239-Y249 WeakPolarHBondContact CA-O 3.4Å; K239-I250 HydrophobicContact CB-CD1 3.9Å; K239-I250 HydrophobicContact CG-CD1 4.29Å; K239-F298 HydrophobicContact CD-CD1 4.43Å; K239-F298 HydrophobicContact CD-CE1 4.42Å; K239-F298 HydrophobicContact CG-CE1 4.28Å
240	Q	86.7	Confident	87.9	Confident	58 Å²	58	70 Å²	70	27%	0.271	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	153.9	176.7	-66	-175.6	-9	0	0	111	T238 S248 Y249 S251	T238-Q240 PolarHBondContact O-N 3.46Å; Q240-S248 WeakPolarHBondContact O-CA 3.41Å; Q240-Y249 HydrophobicContact CB-CD2 4.25Å; Q240-Y249 HydrophobicContact CB-CE1 4.18Å; Q240-Y249 HydrophobicContact CB-CE2 3.65Å; Q240-Y249 HydrophobicContact CG-CE2 4.37Å; Q240-Y249 PolarHBondContact N-O 3.44Å; Q240-Y249 PolarHBondContact O-N 3.08Å; Q240-Y249 VanDerWaalsContact OE1-CE2 3.27Å; Q240-Y249 PolarHBondContact OE1-OH 3.48Å; Q240-S251 VanDerWaalsContact CD-CB 3.44Å; Q240-S251 PolarHBondContact OE1-OG 3.38Å
241	T	86.3	Confident	87.8	Confident	84 Å²	84	69 Å²	69	52%	0.515	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	150.6	177.1	54.2	0	0	0	0	111.1
242	K	79.9	Confident	87.8	Confident	88 Å²	88	67.1 Å²	67.1	38%	0.383	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	163.5	165.5	-86	175.2	-177.1	-83.2	0	109.4	G245 I246 K247 Y249	K242-G245 PolarHBondContact O-N 2.93Å; K242-I246 PolarHBondContact O-N 3.38Å; K242-K247 PolarHBondContact N-O 2.86Å; K242-K247 PolarHBondContact O-N 2.88Å; K242-K247 VanDerWaalsContact O-N 3.17Å; K242-Y249 HydrophobicContact CB-CE1 4.43Å; K242-Y249 HydrophobicContact CD-CE1 3.91Å; K242-Y249 HydrophobicContact CG-CE1 3.95Å
243	F	80.1	Confident	87.8	Confident	120 Å²	120	68.3 Å²	68.3	53%	0.526	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	52.9	59.3	-178.7	-52.6	-82.9	0	0	0	112.3	G245 I246 K247	F243-G245 PolarHBondContact O-N 3.32Å; F243-I246 HydrophobicContact CB-CB 4.24Å; F243-I246 HydrophobicContact CB-CD1 4.42Å; F243-I246 WeakPolarHBondContact O-CB 3.5Å; F243-I246 WeakPolarHBondContact O-CD1 3.48Å; F243-I246 VanDerWaalsContact O-CG1 3.26Å; F243-I246 WeakPolarHBondContact O-CG1 3.23Å; F243-I246 PolarHBondContact O-N 2.99Å; F243-K247 HydrophobicContact CD2-CB 4.23Å; F243-K247 HydrophobicContact CD2-CD 3.81Å; F243-K247 HydrophobicContact CD2-CG 4.21Å; F243-K247 HydrophobicContact CE2-CD 3.95Å
244	K	78	Confident	87.8	Confident	228 Å²	228	66.4 Å²	66.4	99%	0.991	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	51.4	22.5	178	-61.3	175	-178.5	169.4	0	115.4
245	G	74.4	Confident	87.7	Confident	34 Å²	34	68.4 Å²	68.4	35%	0.351	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	120.3	-24.4	178.7	0	0	0	0	0	114.6	K242 F243 K247	K242-G245 PolarHBondContact O-N 2.93Å; F243-G245 PolarHBondContact O-N 3.32Å; G245-K247 VanDerWaalsContact C-N 3.28Å; G245-K247 PolarHBondContact O-N 3.49Å; G245-K247 VanDerWaalsContact O-N 3.15Å
246	I	78.5	Confident	87.8	Confident	143 Å²	143	65.3 Å²	65.3	73%	0.733	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-35.4	-169.2	-60.8	166	0	0	0	112.6	K242 F243	K242-I246 PolarHBondContact O-N 3.38Å; F243-I246 HydrophobicContact CB-CB 4.24Å; F243-I246 HydrophobicContact CB-CD1 4.42Å; F243-I246 WeakPolarHBondContact O-CB 3.5Å; F243-I246 WeakPolarHBondContact O-CD1 3.48Å; F243-I246 VanDerWaalsContact O-CG1 3.26Å; F243-I246 WeakPolarHBondContact O-CG1 3.23Å; F243-I246 PolarHBondContact O-N 2.99Å
247	K	83.9	Confident	88.2	Confident	129 Å²	129	66.5 Å²	66.5	56%	0.561	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.2	100.9	-179.2	-63.8	179.8	-175.7	164.9	0	111.3	K242 F243 G245	K242-K247 PolarHBondContact N-O 2.86Å; K242-K247 PolarHBondContact O-N 2.88Å; K242-K247 VanDerWaalsContact O-N 3.17Å; F243-K247 HydrophobicContact CD2-CB 4.23Å; F243-K247 HydrophobicContact CD2-CD 3.81Å; F243-K247 HydrophobicContact CD2-CG 4.21Å; F243-K247 HydrophobicContact CE2-CD 3.95Å; G245-K247 VanDerWaalsContact C-N 3.28Å; G245-K247 PolarHBondContact O-N 3.49Å; G245-K247 VanDerWaalsContact O-N 3.15Å
248	S	87.2	Confident	88.2	Confident	27 Å²	27	68.9 Å²	68.9	19%	0.189	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	143.8	173.4	-70.5	0	0	0	0	113.2	Q240 R297	Q240-S248 WeakPolarHBondContact O-CA 3.41Å; S248-R297 PolarHBondContact O-NH1 3.15Å
249	Y	90.1	Very high	88	Confident	39 Å²	39	67.6 Å²	67.6	15%	0.153	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	161.2	173.4	60	-87.8	0	0	0	112.1	K239 Q240 K242 R266	K239-Y249 WeakPolarHBondContact CA-O 3.4Å; Q240-Y249 HydrophobicContact CB-CD2 4.25Å; Q240-Y249 HydrophobicContact CB-CE1 4.18Å; Q240-Y249 HydrophobicContact CB-CE2 3.65Å; Q240-Y249 HydrophobicContact CG-CE2 4.37Å; Q240-Y249 PolarHBondContact N-O 3.44Å; Q240-Y249 PolarHBondContact O-N 3.08Å; Q240-Y249 VanDerWaalsContact OE1-CE2 3.27Å; Q240-Y249 PolarHBondContact OE1-OH 3.48Å; K242-Y249 HydrophobicContact CB-CE1 4.43Å; K242-Y249 HydrophobicContact CD-CE1 3.91Å; K242-Y249 HydrophobicContact CG-CE1 3.95Å; Y249-R266 HydrophobicContact CD2-CB 3.54Å; Y249-R266 HydrophobicContact CD2-CG 4.23Å; Y249-R266 HydrophobicContact CE2-CB 3.93Å; Y249-R266 HydrophobicContact CE2-CG 4.43Å; Y249-R266 HydrophobicContact CG-CB 4.47Å
250	I	92.9	Very high	87.7	Confident	18 Å²	18	66.5 Å²	66.5	9%	0.092	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	132.8	169	-57.2	-56.1	0	0	0	109.4	P237 T238 K239 Y252 R266 F298 I303	P237-I250 HydrophobicContact CB-CG2 3.96Å; T238-I250 WeakPolarHBondContact O-CA 3.36Å; K239-I250 HydrophobicContact CB-CD1 3.9Å; K239-I250 HydrophobicContact CG-CD1 4.29Å; I250-Y252 HydrophobicContact CG2-CE1 4.21Å; I250-Y252 HydrophobicContact CG2-CE2 4.1Å; I250-R266 WeakPolarHBondContact O-CA 3.43Å; I250-R266 VanDerWaalsContact O-CB 3.3Å; I250-R266 WeakPolarHBondContact O-CB 3.44Å; I250-F298 HydrophobicContact CD1-CD1 3.94Å; I250-F298 HydrophobicContact CD1-CE1 4.22Å; I250-F298 HydrophobicContact CG1-CD1 4.24Å; I250-F298 HydrophobicContact CG1-CE1 4.42Å; I250-I303 HydrophobicContact CD1-CD1 3.82Å; I250-I303 HydrophobicContact CG1-CD1 3.95Å; I250-I303 HydrophobicContact CG1-CG1 4.2Å
251	S	94	Very high	87.9	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.021	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.2	173	-151.1	0	0	0	0	109.2	P237 T238 Q240	P237-S251 CarbonylContact C-O 3.49Å; P237-S251 WeakPolarHBondContact CA-O 3.47Å; T238-S251 PolarHBondContact N-O 2.85Å; T238-S251 PolarHBondContact O-N 3.33Å; T238-S251 PolarHBondContact OG1-O 3.29Å; Q240-S251 VanDerWaalsContact CD-CB 3.44Å; Q240-S251 PolarHBondContact OE1-OG 3.38Å
252	Y	96.3	Very high	88.3	Confident	1 Å²	1	64.7 Å²	64.7	0%	0.004	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	138.9	175.9	-59.5	-84.9	0	0	0	109	V234 P237 I250 Y264 R265 F270 R306 K307 L310	V234-Y252 HydrophobicContact CG1-CD1 4.33Å; V234-Y252 HydrophobicContact CG1-CG 4.38Å; P237-Y252 HydrophobicContact CB-CD1 4.02Å; P237-Y252 HydrophobicContact CB-CE1 3.8Å; I250-Y252 HydrophobicContact CG2-CE1 4.21Å; I250-Y252 HydrophobicContact CG2-CE2 4.1Å; Y252-Y264 WeakPolarHBondContact O-CA 3.47Å; Y252-R265 PolarHBondContact N-O 3.02Å; Y252-R265 PolarHBondContact O-N 3.26Å; Y252-F270 HydrophobicContact CD2-CE2 4.11Å; Y252-R306 WeakPolarHBondContact OH-CD 3.41Å; Y252-R306 WeakPolarHBondContact OH-CG 3.49Å; Y252-K307 HydrophobicContact CE1-CB 4.17Å; Y252-L310 HydrophobicContact CD1-CD1 4.45Å; Y252-L310 HydrophobicContact CD2-CD1 3.87Å; Y252-L310 HydrophobicContact CE1-CD1 4.23Å; Y252-L310 HydrophobicContact CE2-CD1 3.64Å; Y252-L310 HydrophobicContact CG-CD1 4.29Å
253	K	95.9	Very high	88.9	Confident	38 Å²	38	60.7 Å²	60.7	17%	0.165	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	130	171.6	174.3	-169.5	169	-156.1	0	108.5	E235 D236 P262 Y264	E235-K253 HydrophobicContact CB-CB 4.25Å; E235-K253 HydrophobicContact CB-CD 4.02Å; E235-K253 HydrophobicContact CB-CG 4.42Å; E235-K253 PolarHBondContact N-O 3.36Å; E235-K253 PolarHBondContact O-N 2.98Å; E235-K253 WeakPolarHBondContact OE2-CE 3.46Å; E235-K253 IonicContact OE2-NZ 2.82Å; E235-K253 PolarHBondContact OE2-NZ 2.88Å; D236-K253 HydrophobicContact CB-CB 4Å; D236-K253 HydrophobicContact CB-CD 3.89Å; D236-K253 WeakPolarHBondContact OD2-CD 3.48Å; D236-K253 WeakPolarHBondContact OD2-CE 3.16Å; D236-K253 IonicContact OD2-NZ 2.78Å; D236-K253 PolarHBondContact OD2-NZ 3.24Å; K253-P262 HydrophobicContact CG-CB 4.07Å; K253-Y264 HydrophobicContact CB-CD1 4.18Å; K253-Y264 HydrophobicContact CB-CE1 3.79Å; K253-Y264 HydrophobicContact CG-CE1 4.17Å
254	L	96.9	Very high	89.6	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128	176.7	-62.8	-176.2	0	0	0	109.6	S233 V234 P262 V263 R265 F270 M314 F332 L333	S233-L254 WeakPolarHBondContact O-CA 3.42Å; V234-L254 HydrophobicContact CB-CD2 4.07Å; V234-L254 HydrophobicContact CG1-CD2 3.87Å; V234-L254 HydrophobicContact CG2-CD2 3.7Å; L254-P262 CarbonylContact O-C 3.52Å; L254-P262 WeakPolarHBondContact O-CA 3.41Å; L254-P262 WeakPolarHBondContact O-CB 3.44Å; L254-V263 HydrophobicContact CB-CG2 3.83Å; L254-V263 HydrophobicContact CD1-CG2 4.3Å; L254-V263 PolarHBondContact N-O 2.78Å; L254-V263 PolarHBondContact O-N 2.87Å; L254-R265 HydrophobicContact CD1-CB 4.04Å; L254-R265 HydrophobicContact CD1-CG 3.61Å; L254-R265 HydrophobicContact CG-CG 4.39Å; L254-F270 HydrophobicContact CD1-CZ 4.15Å; L254-F270 HydrophobicContact CD2-CZ 4.09Å; L254-F270 HydrophobicContact CG-CZ 4.5Å; L254-M314 HydrophobicContact CD1-CE 4.07Å; L254-M314 HydrophobicContact CD2-CE 3.98Å; L254-F332 HydrophobicContact CD1-CD1 4.24Å; L254-F332 HydrophobicContact CD1-CE1 3.41Å; L254-F332 VanDerWaalsContact CD1-CE1 3.41Å; L254-F332 HydrophobicContact CD1-CZ 3.9Å; L254-L333 HydrophobicContact CD1-CD2 3.96Å
255	T	95.6	Very high	90.4	Very high	47 Å²	47	50 Å²	50	29%	0.288	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	91.9	178.8	-39.3	0	0	0	0	109.9	C232 S233	C232-T255 WeakPolarHBondContact CA-O 3.42Å; S233-T255 PolarHBondContact N-O 2.88Å; S233-T255 VanDerWaalsContact N-O 3.1Å; S233-T255 PolarHBondContact O-N 3.26Å; S233-T255 WeakPolarHBondContact OG-CB 3.36Å; S233-T255 PolarHBondContact OG-OG1 3.33Å
256	P	95.1	Very high	91.4	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.006	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	136.7	172.1	-15.2	28.3	0	0	0	110.9	A231 H258 A259 L333	A231-P256 CarbonylContact O-C 3.58Å; A231-P256 WeakPolarHBondContact O-CA 3.34Å; P256-H258 PolarHBondContact O-N 3.41Å; P256-A259 HydrophobicContact CB-CB 3.84Å; P256-A259 HydrophobicContact CG-CB 3.88Å; P256-A259 PolarHBondContact O-N 2.9Å; P256-L333 HydrophobicContact CG-CB 3.84Å; P256-L333 HydrophobicContact CG-CD1 4.47Å; P256-L333 HydrophobicContact CG-CD2 4.34Å; P256-L333 HydrophobicContact CG-CG 4.45Å
257	T	93.7	Very high	92.1	Very high	104 Å²	104	46.8 Å²	46.8	64%	0.638	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-13.9	-176.8	55.6	0	0	0	0	114.6	F230 A231	F230-T257 WeakPolarHBondContact CB-OG1 2.98Å; A231-T257 HydrophobicContact CB-CG2 4.02Å; A231-T257 PolarHBondContact N-OG1 3.06Å; A231-T257 PolarHBondContact O-N 3.2Å; A231-T257 PolarHBondContact O-OG1 2.94Å
258	H	87.6	Confident	92.6	Very high	94 Å²	94	47.3 Å²	47.3	44%	0.435	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-6	176.3	64.3	-109.5	0	0	0	113.6	F230 P256	F230-H258 VanDerWaalsContact CB-ND1 3.34Å; F230-H258 WeakPolarHBondContact CB-ND1 3.5Å; F230-H258 AromaticContact CD1-ND1 3.84Å; F230-H258 AromaticContact CD2-CE1 3.53Å; F230-H258 AromaticContact CD2-ND1 3.52Å; F230-H258 AromaticContact CE2-CE1 3.85Å; F230-H258 AromaticContact CG-CE1 3.64Å; F230-H258 AromaticContact CG-ND1 3.27Å; F230-H258 VanDerWaalsContact CG-ND1 3.27Å; F230-H258 WeakPolarHBondContact CG-ND1 3.45Å; P256-H258 PolarHBondContact O-N 3.41Å
259	A	86.4	Confident	93	Very high	29 Å²	29	47.5 Å²	47.5	24%	0.24	25%	0.254	C	S	.	.			trans	-100.3	135.3	-173	0	0	0	0	0	111.4	P256 S261	P256-A259 HydrophobicContact CB-CB 3.84Å; P256-A259 HydrophobicContact CG-CB 3.88Å; P256-A259 PolarHBondContact O-N 2.9Å; A259-S261 VanDerWaalsContact C-N 3.29Å; A259-S261 PolarHBondContact O-N 3.24Å
260	A	82.3	Confident	93.3	Very high	112 Å²	112	45.6 Å²	45.6	93%	0.926	25%	0.247	S	C	*	.	S	Bend	trans	-74.2	-15.6	-178.2	0	0	0	0	0	114.4
261	S	90.3	Very high	93.4	Very high	56 Å²	56	46 Å²	46	39%	0.392	25%	0.249	S	C	.	.	S	Bend	trans	-141.5	141.7	-177.6	-62.3	0	0	0	0	110.7	A259	A259-S261 VanDerWaalsContact C-N 3.29Å; A259-S261 PolarHBondContact O-N 3.24Å
262	P	94.3	Very high	93.6	Very high	48 Å²	48	47.3 Å²	47.3	31%	0.312	25%	0.254	S	S	.	.			trans	-73.3	147	176	31.2	-35	0	0	0	111.7	K253 L254	K253-P262 HydrophobicContact CG-CB 4.07Å; L254-P262 CarbonylContact O-C 3.52Å; L254-P262 WeakPolarHBondContact O-CA 3.41Å; L254-P262 WeakPolarHBondContact O-CB 3.44Å
263	V	94.4	Very high	93.6	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.018	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	144.5	173.6	-58.6	0	0	0	0	111.2	L254 R265 L333 L336	L254-V263 HydrophobicContact CB-CG2 3.83Å; L254-V263 HydrophobicContact CD1-CG2 4.3Å; L254-V263 PolarHBondContact N-O 2.78Å; L254-V263 PolarHBondContact O-N 2.87Å; V263-R265 HydrophobicContact CG2-CG 4.33Å; V263-L333 VanDerWaalsContact CG1-O 3.26Å; V263-L333 WeakPolarHBondContact CG1-O 3.44Å; V263-L333 VanDerWaalsContact CG2-O 3.23Å; V263-L333 WeakPolarHBondContact CG2-O 3.23Å; V263-L336 HydrophobicContact CG1-CD2 3.93Å; V263-L336 HydrophobicContact CG1-CG 4.4Å
264	Y	94.6	Very high	93.7	Very high	109 Å²	109	46.9 Å²	46.9	43%	0.427	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129	177.8	-68.5	-89.3	0	0	0	110.9	Y252 K253	Y252-Y264 WeakPolarHBondContact O-CA 3.47Å; K253-Y264 HydrophobicContact CB-CD1 4.18Å; K253-Y264 HydrophobicContact CB-CE1 3.79Å; K253-Y264 HydrophobicContact CG-CE1 4.17Å
265	R	95	Very high	93.6	Very high	16 Å²	16	50.6 Å²	50.6	6%	0.06	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	122.5	-177.5	-59.4	-63.3	179.5	-114.8	3.2	111.3	Y252 L254 V263 H269 F270 F332 C335	Y252-R265 PolarHBondContact N-O 3.02Å; Y252-R265 PolarHBondContact O-N 3.26Å; L254-R265 HydrophobicContact CD1-CB 4.04Å; L254-R265 HydrophobicContact CD1-CG 3.61Å; L254-R265 HydrophobicContact CG-CG 4.39Å; V263-R265 HydrophobicContact CG2-CG 4.33Å; R265-H269 HydrophobicContact CB-CB 4.46Å; R265-F270 HydrophobicContact CB-CD2 4.44Å; R265-F270 HydrophobicContact CB-CE2 3.82Å; R265-F270 HydrophobicContact CB-CZ 4.36Å; R265-F332 HydrophobicContact CB-CE2 4.14Å; R265-F332 HydrophobicContact CB-CZ 3.91Å; R265-F332 HydrophobicContact CG-CD2 4.45Å; R265-F332 HydrophobicContact CG-CE1 4.24Å; R265-F332 HydrophobicContact CG-CE2 3.85Å; R265-F332 HydrophobicContact CG-CZ 3.73Å; R265-F332 VanDerWaalsContact CZ-O 3.23Å; R265-F332 PolarHBondContact NE-O 2.66Å; R265-F332 PolarHBondContact NH2-O 2.67Å; R265-C335 PolarHBondContact NH1-O 3.38Å; R265-C335 PolarHBondContact NH2-O 3.03Å
266	R	94.1	Very high	93.5	Very high	79 Å²	79	50.9 Å²	50.9	30%	0.298	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	159.3	169.5	64.9	179	175.4	163.2	-0.6	111.4	Y249 I250 K268 H269	Y249-R266 HydrophobicContact CD2-CB 3.54Å; Y249-R266 HydrophobicContact CD2-CG 4.23Å; Y249-R266 HydrophobicContact CE2-CB 3.93Å; Y249-R266 HydrophobicContact CE2-CG 4.43Å; Y249-R266 HydrophobicContact CG-CB 4.47Å; I250-R266 WeakPolarHBondContact O-CA 3.43Å; I250-R266 VanDerWaalsContact O-CB 3.3Å; I250-R266 WeakPolarHBondContact O-CB 3.44Å; R266-K268 VanDerWaalsContact C-N 3.27Å; R266-K268 PolarHBondContact O-N 3.35Å; R266-K268 VanDerWaalsContact O-N 3.08Å; R266-H269 PolarHBondContact NE-CD2 2.84Å; R266-H269 PolarHBondContact NE-NE2 2.85Å; R266-H269 PolarHBondContact NH2-NE2 2.84Å; R266-H269 WeakPolarHBondContact O-CB 3.4Å; R266-H269 PolarHBondContact O-N 2.83Å
267	Y	94.2	Very high	93.5	Very high	29 Å²	29	50.9 Å²	50.9	11%	0.114	27%	0.267	C	S	.	.	H	α-helix	trans	-48.5	-40.9	-179.6	-177.2	-86	0	0	0	114.3	H269 F270 D271 P290 K292	Y267-H269 PolarHBondContact O-N 2.86Å; Y267-H269 VanDerWaalsContact O-N 3.08Å; Y267-F270 WeakPolarHBondContact O-CB 3.44Å; Y267-F270 PolarHBondContact O-N 3.08Å; Y267-D271 HydrophobicContact CD1-CB 4.44Å; Y267-D271 HydrophobicContact CE1-CB 4.05Å; Y267-D271 PolarHBondContact O-N 3.12Å; Y267-P290 HydrophobicContact CE2-CG 4.41Å; Y267-P290 VanDerWaalsContact CE2-O 3.22Å; Y267-P290 WeakPolarHBondContact CE2-O 3.49Å; Y267-P290 PolarHBondContact OH-O 3.32Å; Y267-K292 HydrophobicContact CE1-CD 4.48Å; Y267-K292 HydrophobicContact CE1-CG 3.68Å
268	K	92.9	Very high	93.5	Very high	140 Å²	140	49.4 Å²	49.4	61%	0.609	26%	0.255	S	S	*	.	H	α-helix	trans	-60.4	-20.4	177.7	-170	170.1	-177.7	179.3	0	113.6	R266 W272	R266-K268 VanDerWaalsContact C-N 3.27Å; R266-K268 PolarHBondContact O-N 3.35Å; R266-K268 VanDerWaalsContact O-N 3.08Å; K268-W272 WeakPolarHBondContact O-CB 3.44Å; K268-W272 PolarHBondContact O-N 3.35Å; K268-W272 VanDerWaalsContact O-N 3.08Å
269	H	95.8	Very high	93.6	Very high	31 Å²	31	49.7 Å²	49.7	14%	0.144	26%	0.256	C	S	.	.	H	α-helix	trans	-82.2	-34.8	176.1	-58.1	179.5	0	0	0	111.7	R265 R266 Y267 L273 F332 W341	R265-H269 HydrophobicContact CB-CB 4.46Å; R266-H269 PolarHBondContact NE-CD2 2.84Å; R266-H269 PolarHBondContact NE-NE2 2.85Å; R266-H269 PolarHBondContact NH2-NE2 2.84Å; R266-H269 WeakPolarHBondContact O-CB 3.4Å; R266-H269 PolarHBondContact O-N 2.83Å; Y267-H269 PolarHBondContact O-N 2.86Å; Y267-H269 VanDerWaalsContact O-N 3.08Å; H269-L273 PolarHBondContact O-N 3.31Å; H269-L273 VanDerWaalsContact O-N 3.11Å; H269-F332 HydrophobicContact CB-CE2 3.89Å; H269-W341 HydrophobicContact CB-CZ2 4.28Å
270	F	97.1	Very high	93.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.9	-45.6	168.8	-65	-100.7	0	0	0	110.2	Y252 L254 R265 Y267 W272 L273 Y274 L289 L310 W313 M314 F332	Y252-F270 HydrophobicContact CD2-CE2 4.11Å; L254-F270 HydrophobicContact CD1-CZ 4.15Å; L254-F270 HydrophobicContact CD2-CZ 4.09Å; L254-F270 HydrophobicContact CG-CZ 4.5Å; R265-F270 HydrophobicContact CB-CD2 4.44Å; R265-F270 HydrophobicContact CB-CE2 3.82Å; R265-F270 HydrophobicContact CB-CZ 4.36Å; Y267-F270 WeakPolarHBondContact O-CB 3.44Å; Y267-F270 PolarHBondContact O-N 3.08Å; F270-W272 VanDerWaalsContact C-N 3.33Å; F270-W272 PolarHBondContact O-N 2.96Å; F270-L273 PolarHBondContact O-N 3.4Å; F270-L273 VanDerWaalsContact O-N 3.12Å; F270-Y274 WeakPolarHBondContact O-CB 3.37Å; F270-Y274 PolarHBondContact O-N 2.83Å; F270-L289 HydrophobicContact CB-CD1 4.1Å; F270-L289 HydrophobicContact CB-CD2 4.04Å; F270-L310 HydrophobicContact CD1-CD2 3.89Å; F270-L310 HydrophobicContact CE1-CD2 4.11Å; F270-L310 HydrophobicContact CE2-CD1 4.43Å; F270-L310 HydrophobicContact CG-CD2 4.21Å; F270-L310 HydrophobicContact CZ-CD1 4.38Å; F270-W313 HydrophobicContact CD1-CE3 4.14Å; F270-W313 AromaticContact CD1-CZ3 3.88Å; F270-W313 HydrophobicContact CD1-CZ3 3.88Å; F270-W313 HydrophobicContact CE1-CE3 4.48Å; F270-W313 HydrophobicContact CE1-CZ3 4.33Å; F270-M314 HydrophobicContact CE1-CE 4.03Å; F270-F332 HydrophobicContact CD1-CE1 4.29Å; F270-F332 AromaticContact CD1-CZ 3.73Å; F270-F332 HydrophobicContact CD1-CZ 3.73Å; F270-F332 HydrophobicContact CD2-CZ 4.04Å; F270-F332 HydrophobicContact CE1-CE1 4.14Å; F270-F332 AromaticContact CE1-CZ 3.81Å; F270-F332 HydrophobicContact CE1-CZ 3.81Å; F270-F332 HydrophobicContact CE2-CZ 4.11Å; F270-F332 HydrophobicContact CG-CE2 4.46Å; F270-F332 AromaticContact CG-CZ 3.86Å; F270-F332 HydrophobicContact CG-CZ 3.86Å; F270-F332 HydrophobicContact CZ-CZ 4.01Å
271	D	95.9	Very high	94.3	Very high	26 Å²	26	43.3 Å²	43.3	14%	0.139	20%	0.202	C	C	.	.	H	α-helix	trans	-55.7	-45.2	176.2	-172.8	47.2	0	0	0	112	Y267 N275 L289 K292	Y267-D271 HydrophobicContact CD1-CB 4.44Å; Y267-D271 HydrophobicContact CE1-CB 4.05Å; Y267-D271 PolarHBondContact O-N 3.12Å; D271-N275 PolarHBondContact O-N 3.13Å; D271-N275 VanDerWaalsContact O-N 3.14Å; D271-N275 PolarHBondContact O-ND2 3.25Å; D271-L289 HydrophobicContact CB-CD1 4.43Å; D271-K292 WeakPolarHBondContact OD1-CE 3.36Å; D271-K292 IonicContact OD1-NZ 3.28Å; D271-K292 PolarHBondContact OD1-NZ 3.07Å; D271-K292 WeakPolarHBondContact OD2-CE 3.37Å; D271-K292 IonicContact OD2-NZ 2.89Å; D271-K292 PolarHBondContact OD2-NZ 3.11Å
272	W	96.6	Very high	94.2	Very high	31 Å²	31	41.7 Å²	41.7	12%	0.117	19%	0.19	C	C	.	.	H	α-helix	trans	-57.6	-52.2	171.6	168.1	77.2	0	0	0	112.4	K268 F270 Y274 N275 R276 W341 K345 A348 E349	K268-W272 WeakPolarHBondContact O-CB 3.44Å; K268-W272 PolarHBondContact O-N 3.35Å; K268-W272 VanDerWaalsContact O-N 3.08Å; F270-W272 VanDerWaalsContact C-N 3.33Å; F270-W272 PolarHBondContact O-N 2.96Å; W272-Y274 PolarHBondContact O-N 2.86Å; W272-N275 PolarHBondContact O-N 3.15Å; W272-R276 HydrophobicContact CD2-CG 4.46Å; W272-R276 HydrophobicContact CZ2-CG 3.89Å; W272-R276 PolarHBondContact O-N 3.2Å; W272-R276 VanDerWaalsContact O-N 3.13Å; W272-W341 AromaticContact CE3-CH2 3.86Å; W272-W341 HydrophobicContact CE3-CH2 3.86Å; W272-W341 HydrophobicContact CE3-CZ2 4.19Å; W272-W341 HydrophobicContact CH2-CH2 4.41Å; W272-W341 AromaticContact CZ3-CH2 3.62Å; W272-W341 HydrophobicContact CZ3-CH2 3.62Å; W272-W341 HydrophobicContact CZ3-CZ2 4.34Å; W272-W341 HydrophobicContact CZ3-CZ3 4.39Å; W272-K345 HydrophobicContact CZ2-CB 4.06Å; W272-K345 HydrophobicContact CZ2-CG 3.87Å; W272-A348 HydrophobicContact CH2-CB 4.1Å; W272-A348 HydrophobicContact CZ2-CB 4.06Å; W272-E349 PolarHBondContact NE1-OE1 3.48Å
273	L	97.3	Very high	94.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.4	-45.2	-178.4	174	60.7	0	0	0	111.2	H269 F270 N275 R276 L277 W313 Y326 F329 F332	H269-L273 PolarHBondContact O-N 3.31Å; H269-L273 VanDerWaalsContact O-N 3.11Å; F270-L273 PolarHBondContact O-N 3.4Å; F270-L273 VanDerWaalsContact O-N 3.12Å; L273-N275 VanDerWaalsContact C-N 3.31Å; L273-N275 PolarHBondContact O-N 2.97Å; L273-R276 CarbonylContact O-C 3.53Å; L273-R276 WeakPolarHBondContact O-CA 3.44Å; L273-R276 WeakPolarHBondContact O-CB 3.44Å; L273-R276 PolarHBondContact O-N 3.14Å; L273-L277 HydrophobicContact CD1-CD2 4.36Å; L273-L277 HydrophobicContact CD1-CG 4.18Å; L273-L277 HydrophobicContact CG-CD1 4.15Å; L273-L277 HydrophobicContact CG-CG 4.28Å; L273-L277 WeakPolarHBondContact O-CG 3.41Å; L273-L277 PolarHBondContact O-N 3.43Å; L273-W313 HydrophobicContact CD2-CH2 3.88Å; L273-W313 HydrophobicContact CG-CH2 4.48Å; L273-Y326 HydrophobicContact CD1-CD1 4.32Å; L273-Y326 HydrophobicContact CD1-CE1 3.94Å; L273-F329 HydrophobicContact CD2-CD2 3.7Å; L273-F329 HydrophobicContact CD2-CE2 4.42Å; L273-F332 HydrophobicContact CB-CD2 4.3Å; L273-F332 HydrophobicContact CD2-CB 3.93Å; L273-F332 HydrophobicContact CD2-CD1 3.78Å; L273-F332 HydrophobicContact CD2-CD2 3.99Å; L273-F332 HydrophobicContact CD2-CE1 4.26Å; L273-F332 HydrophobicContact CD2-CE2 4.45Å; L273-F332 HydrophobicContact CD2-CG 3.63Å
274	Y	96.8	Very high	94.1	Very high	30 Å²	30	39.5 Å²	39.5	12%	0.118	18%	0.175	C	C	.	.	H	α-helix	trans	-56.4	-42.9	176.3	178.9	-111.2	0	0	0	112.4	F270 W272 R276 L277 L278 V286 P287 H288 L289	F270-Y274 WeakPolarHBondContact O-CB 3.37Å; F270-Y274 PolarHBondContact O-N 2.83Å; W272-Y274 PolarHBondContact O-N 2.86Å; Y274-R276 PolarHBondContact O-N 2.96Å; Y274-L277 PolarHBondContact O-N 3.33Å; Y274-L278 HydrophobicContact CD1-CD1 4.09Å; Y274-L278 HydrophobicContact CE1-CD1 3.56Å; Y274-L278 HydrophobicContact CE1-CG 4.35Å; Y274-L278 HydrophobicContact CE2-CD1 4.22Å; Y274-L278 HydrophobicContact CE2-CD2 4.33Å; Y274-L278 HydrophobicContact CE2-CG 4.19Å; Y274-L278 WeakPolarHBondContact O-CG 3.47Å; Y274-L278 PolarHBondContact O-N 3.02Å; Y274-V286 HydrophobicContact CD2-CG1 3.87Å; Y274-V286 HydrophobicContact CE2-CG1 3.85Å; Y274-P287 WeakPolarHBondContact CE2-O 3.34Å; Y274-H288 PolarHBondContact OH-CD2 2.91Å; Y274-L289 HydrophobicContact CD1-CD1 4.16Å; Y274-L289 HydrophobicContact CD1-CG 4.4Å; Y274-L289 HydrophobicContact CD2-CG 4.28Å; Y274-L289 HydrophobicContact CG-CD1 3.89Å; Y274-L289 HydrophobicContact CG-CG 3.98Å
275	N	95.1	Very high	94.2	Very high	77 Å²	77	34.4 Å²	34.4	41%	0.412	16%	0.155	S	C	.	.	H	α-helix	trans	-72.3	-10.3	174.2	-73.2	-73.3	0	0	0	114.3	D271 W272 L273	D271-N275 PolarHBondContact O-N 3.13Å; D271-N275 VanDerWaalsContact O-N 3.14Å; D271-N275 PolarHBondContact O-ND2 3.25Å; W272-N275 PolarHBondContact O-N 3.15Å; L273-N275 VanDerWaalsContact C-N 3.31Å; L273-N275 PolarHBondContact O-N 2.97Å
276	R	95.1	Very high	94.3	Very high	54 Å²	54	33.7 Å²	33.7	20%	0.204	15%	0.153	C	C	.	.	H	α-helix	trans	-88.6	-40.7	165.3	-63.1	-62.5	75.2	-173	-3.9	111.7	W272 L273 Y274 H279 K280	W272-R276 HydrophobicContact CD2-CG 4.46Å; W272-R276 HydrophobicContact CZ2-CG 3.89Å; W272-R276 PolarHBondContact O-N 3.2Å; W272-R276 VanDerWaalsContact O-N 3.13Å; L273-R276 CarbonylContact O-C 3.53Å; L273-R276 WeakPolarHBondContact O-CA 3.44Å; L273-R276 WeakPolarHBondContact O-CB 3.44Å; L273-R276 PolarHBondContact O-N 3.14Å; Y274-R276 PolarHBondContact O-N 2.96Å; R276-H279 PolarHBondContact O-N 3.04Å; R276-H279 VanDerWaalsContact O-N 3.15Å; R276-K280 PolarHBondContact O-N 3.32Å
277	L	94.9	Very high	94.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.2	-50.9	175.4	-64.1	172	0	0	0	111.2	L273 Y274 H279 K280 F281 V286 W313 M317 L323 Y326	L273-L277 HydrophobicContact CD1-CD2 4.36Å; L273-L277 HydrophobicContact CD1-CG 4.18Å; L273-L277 HydrophobicContact CG-CD1 4.15Å; L273-L277 HydrophobicContact CG-CG 4.28Å; L273-L277 WeakPolarHBondContact O-CG 3.41Å; L273-L277 PolarHBondContact O-N 3.43Å; Y274-L277 PolarHBondContact O-N 3.33Å; L277-H279 PolarHBondContact O-N 3.34Å; L277-K280 PolarHBondContact O-N 3.4Å; L277-F281 HydrophobicContact CB-CD2 4.33Å; L277-F281 HydrophobicContact CD2-CD2 3.97Å; L277-F281 HydrophobicContact CD2-CE2 3.72Å; L277-F281 WeakPolarHBondContact O-CB 3.4Å; L277-F281 WeakPolarHBondContact O-CD2 3.41Å; L277-F281 PolarHBondContact O-N 3.45Å; L277-V286 HydrophobicContact CB-CG1 3.78Å; L277-V286 HydrophobicContact CB-CG2 4.14Å; L277-V286 HydrophobicContact CD1-CG1 3.96Å; L277-W313 HydrophobicContact CD1-CH2 4.45Å; L277-W313 HydrophobicContact CD1-CZ2 3.99Å; L277-M317 HydrophobicContact CD1-CE 3.42Å; L277-M317 VanDerWaalsContact CD1-CE 3.42Å; L277-M317 HydrophobicContact CD1-SD 3.69Å; L277-M317 HydrophobicContact CD2-CE 3.94Å; L277-M317 HydrophobicContact CG-CE 4.34Å; L277-L323 HydrophobicContact CD2-CD2 4.42Å; L277-Y326 HydrophobicContact CD2-CD1 3.57Å; L277-Y326 HydrophobicContact CD2-CE1 3.93Å; L277-Y326 HydrophobicContact CD2-CG 4.49Å
278	L	92.3	Very high	94.3	Very high	73 Å²	73	31.8 Å²	31.8	38%	0.382	15%	0.148	S	C	.	.	H	α-helix	trans	-61.3	-27.7	176.8	-69.4	179.3	0	0	0	113.8	Y274 V286	Y274-L278 HydrophobicContact CD1-CD1 4.09Å; Y274-L278 HydrophobicContact CE1-CD1 3.56Å; Y274-L278 HydrophobicContact CE1-CG 4.35Å; Y274-L278 HydrophobicContact CE2-CD1 4.22Å; Y274-L278 HydrophobicContact CE2-CD2 4.33Å; Y274-L278 HydrophobicContact CE2-CG 4.19Å; Y274-L278 WeakPolarHBondContact O-CG 3.47Å; Y274-L278 PolarHBondContact O-N 3.02Å; L278-V286 HydrophobicContact CD2-CB 4.04Å; L278-V286 HydrophobicContact CD2-CG1 4.49Å; L278-V286 HydrophobicContact CD2-CG2 4.33Å
279	H	89.9	Confident	94.4	Very high	100 Å²	100	26.3 Å²	26.3	46%	0.463	13%	0.125	S	C	.	.	H	α-helix	trans	-81.3	-34.9	179.3	-169.6	-99.3	0	0	0	112.1	R276 L277	R276-H279 PolarHBondContact O-N 3.04Å; R276-H279 VanDerWaalsContact O-N 3.15Å; L277-H279 PolarHBondContact O-N 3.34Å
280	K	90.6	Very high	94.3	Very high	1 Å²	1	25.4 Å²	25.4	0%	0.004	12%	0.123	C	C	.	.	H	α-helix	trans	-81.3	-48.9	178.5	-173.2	163.4	-172.7	159.4	0	112.6	E210 R276 L277 Y326 D351 M353 V354 G355 F358	E210-K280 IonicContact OE1-NZ 2.8Å; E210-K280 PolarHBondContact OE1-NZ 2.99Å; E210-K280 VanDerWaalsContact OE2-CE 3.28Å; E210-K280 WeakPolarHBondContact OE2-CE 3.48Å; E210-K280 IonicContact OE2-NZ 2.58Å; E210-K280 PolarHBondContact OE2-NZ 2.84Å; R276-K280 PolarHBondContact O-N 3.32Å; L277-K280 PolarHBondContact O-N 3.4Å; K280-Y326 HydrophobicContact CD-CD2 3.89Å; K280-Y326 HydrophobicContact CD-CE2 3.56Å; K280-D351 WeakPolarHBondContact CD-OD2 3.48Å; K280-D351 WeakPolarHBondContact CE-OD2 3.45Å; K280-D351 IonicContact NZ-OD1 3.21Å; K280-D351 IonicContact NZ-OD2 3.21Å; K280-D351 PolarHBondContact NZ-OD2 2.92Å; K280-M353 WeakPolarHBondContact CE-O 3.33Å; K280-V354 HydrophobicContact CB-CG1 4.09Å; K280-V354 HydrophobicContact CG-CG1 4.25Å; K280-G355 PolarHBondContact O-N 3.31Å; K280-F358 HydrophobicContact CG-CD2 4.37Å
281	F	92.3	Very high	93.6	Very high	6 Å²	6	31.6 Å²	31.6	3%	0.026	15%	0.152	C	C	.	.			trans	-99.9	91.5	-166	-60.7	-71.6	0	0	0	112.3	L277 I284 V286 V322 L323 Y326 F358	L277-F281 HydrophobicContact CB-CD2 4.33Å; L277-F281 HydrophobicContact CD2-CD2 3.97Å; L277-F281 HydrophobicContact CD2-CE2 3.72Å; L277-F281 WeakPolarHBondContact O-CB 3.4Å; L277-F281 WeakPolarHBondContact O-CD2 3.41Å; L277-F281 PolarHBondContact O-N 3.45Å; F281-I284 HydrophobicContact CB-CB 4Å; F281-I284 HydrophobicContact CB-CG1 3.97Å; F281-I284 HydrophobicContact CD1-CG1 3.99Å; F281-I284 HydrophobicContact CG-CG1 4.31Å; F281-V286 HydrophobicContact CB-CG2 4.32Å; F281-V322 HydrophobicContact CD1-CG1 4.02Å; F281-V322 HydrophobicContact CE1-CG1 3.54Å; F281-V322 HydrophobicContact CZ-CG1 4.35Å; F281-L323 HydrophobicContact CB-CD2 4.48Å; F281-L323 HydrophobicContact CD1-CD2 4.26Å; F281-L323 HydrophobicContact CD2-CD2 3.6Å; F281-L323 HydrophobicContact CE1-CD2 4.48Å; F281-L323 HydrophobicContact CE2-CD2 3.85Å; F281-L323 HydrophobicContact CG-CD2 3.85Å; F281-L323 HydrophobicContact CZ-CD2 4.3Å; F281-Y326 HydrophobicContact CE2-CD1 4.26Å; F281-Y326 HydrophobicContact CE2-CD2 4.36Å; F281-Y326 HydrophobicContact CE2-CG 4.04Å; F281-Y326 HydrophobicContact CZ-CD2 4.24Å; F281-Y326 HydrophobicContact CZ-CG 4.11Å; F281-F358 HydrophobicContact CD1-CD1 4.32Å; F281-F358 HydrophobicContact CD1-CD2 4.43Å; F281-F358 AromaticContact CD1-CE1 3.6Å; F281-F358 HydrophobicContact CD1-CE1 3.6Å; F281-F358 AromaticContact CD1-CE2 3.76Å; F281-F358 HydrophobicContact CD1-CE2 3.76Å; F281-F358 AromaticContact CD1-CZ 3.29Å; F281-F358 HydrophobicContact CD1-CZ 3.29Å; F281-F358 HydrophobicContact CE1-CD2 4.3Å; F281-F358 HydrophobicContact CE1-CE1 4.24Å; F281-F358 AromaticContact CE1-CE2 3.51Å; F281-F358 HydrophobicContact CE1-CE2 3.51Å; F281-F358 AromaticContact CE1-CZ 3.48Å; F281-F358 HydrophobicContact CE1-CZ 3.48Å; F281-F358 VanDerWaalsContact CE1-CZ 3.48Å
282	T	89.5	Confident	93.1	Very high	23 Å²	23	36.9 Å²	36.9	14%	0.141	17%	0.173	C	C	.	.	S	Bend	trans	-82.1	-16.6	-178	43.7	0	0	0	0	115.4	G355 L488	T282-G355 PolarHBondContact OG1-O 2.94Å; T282-L488 VanDerWaalsContact O-CD1 3.3Å; T282-L488 WeakPolarHBondContact O-CD1 3.41Å
283	V	91.6	Very high	92.3	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	19%	0.186	C	C	.	.	S	Bend	trans	-123.1	9.1	-175.7	-60.4	0	0	0	0	113.8	F358 L359 F362 I485 L488 V523 A526	V283-F358 HydrophobicContact CG2-CE1 4.39Å; V283-L359 HydrophobicContact CG1-CD2 4.21Å; V283-L359 HydrophobicContact CG2-CD2 4.04Å; V283-F362 HydrophobicContact CG2-CE2 3.84Å; V283-F362 HydrophobicContact CG2-CZ 4Å; V283-I485 HydrophobicContact CB-CG2 4.38Å; V283-L488 HydrophobicContact CG1-CD1 4.37Å; V283-V523 HydrophobicContact CG1-CG1 4.23Å; V283-A526 HydrophobicContact CG2-CB 4.02Å
284	I	95.2	Very high	91	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.021	22%	0.218	C	C	.	.	S	Bend	trans	-110.1	140	177.7	-49.3	-61.4	0	0	0	108.5	W223 F281 V286 H320 V322 L323	W223-I284 HydrophobicContact CH2-CD1 4.05Å; W223-I284 HydrophobicContact CZ2-CD1 3.31Å; F281-I284 HydrophobicContact CB-CB 4Å; F281-I284 HydrophobicContact CB-CG1 3.97Å; F281-I284 HydrophobicContact CD1-CG1 3.99Å; F281-I284 HydrophobicContact CG-CG1 4.31Å; I284-V286 PolarHBondContact O-N 2.91Å; I284-V286 VanDerWaalsContact O-N 3.09Å; I284-H320 VanDerWaalsContact CG2-NE2 3.33Å; I284-H320 WeakPolarHBondContact CG2-NE2 3.41Å; I284-V322 HydrophobicContact CD1-CG2 4.34Å; I284-L323 HydrophobicContact CG2-CD1 3.99Å; I284-L323 HydrophobicContact CG2-CD2 3.91Å; I284-L323 HydrophobicContact CG2-CG 3.96Å
285	S	96.3	Very high	89.9	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.007	25%	0.248	C	C	.	.			trans	-82.2	87	176.1	-166.4	0	0	0	0	110.5	L478 N481 E530	S285-L478 WeakPolarHBondContact O-CD2 3.34Å; S285-L478 WeakPolarHBondContact OG-CA 3.47Å; S285-L478 PolarHBondContact OG-O 3.4Å; S285-N481 WeakPolarHBondContact OG-CB 3.39Å; S285-N481 PolarHBondContact OG-ND2 2.66Å; S285-E530 WeakPolarHBondContact CB-OE1 3.26Å; S285-E530 PolarHBondContact N-OE1 2.67Å
286	V	96.2	Very high	89.2	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.006	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-66.1	125.8	178.3	-176.3	0	0	0	0	110	Y274 L277 L278 F281 I284 L323 N481	Y274-V286 HydrophobicContact CD2-CG1 3.87Å; Y274-V286 HydrophobicContact CE2-CG1 3.85Å; L277-V286 HydrophobicContact CB-CG1 3.78Å; L277-V286 HydrophobicContact CB-CG2 4.14Å; L277-V286 HydrophobicContact CD1-CG1 3.96Å; L278-V286 HydrophobicContact CD2-CB 4.04Å; L278-V286 HydrophobicContact CD2-CG1 4.49Å; L278-V286 HydrophobicContact CD2-CG2 4.33Å; F281-V286 HydrophobicContact CB-CG2 4.32Å; I284-V286 PolarHBondContact O-N 2.91Å; I284-V286 VanDerWaalsContact O-N 3.09Å; V286-L323 HydrophobicContact CG2-CD2 4.48Å; V286-N481 PolarHBondContact N-ND2 2.82Å; V286-N481 PolarHBondContact O-ND2 3.43Å
287	P	95.6	Very high	88.5	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-65.7	135.8	179.3	27	-35.5	0	0	0	111.4	Y274 W313 H316 M317 L474 L478	Y274-P287 WeakPolarHBondContact CE2-O 3.34Å; P287-W313 HydrophobicContact CG-CG 4.47Å; P287-W313 VanDerWaalsContact O-CD1 3.24Å; P287-W313 PolarHBondContact O-NE1 3.48Å; P287-H316 HydrophobicContact CB-CB 4.46Å; P287-H316 HydrophobicContact CG-CB 4.26Å; P287-M317 HydrophobicContact CG-CG 4.05Å; P287-M317 HydrophobicContact CG-SD 3.97Å; P287-L474 HydrophobicContact CB-CD1 3.67Å; P287-L478 HydrophobicContact CB-CD2 4.07Å
288	H	94.5	Very high	88	Confident	69 Å²	69	50.7 Å²	50.7	32%	0.319	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-74.1	147.4	-178	-71.9	-155	0	0	0	112	Y274 G477 S480 N481	Y274-H288 PolarHBondContact OH-CD2 2.91Å; H288-G477 PolarHBondContact NE2-O 3.27Å; H288-S480 PolarHBondContact CE1-OG 3.44Å; H288-S480 PolarHBondContact NE2-OG 3.42Å; H288-N481 PolarHBondContact NE2-OD1 3.02Å
289	L	94.9	Very high	87.8	Confident	24 Å²	24	52.7 Å²	52.7	13%	0.126	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-80.6	149.2	174.5	-71.5	176	0	0	0	112.6	F270 D271 Y274 L310 W313	F270-L289 HydrophobicContact CB-CD1 4.1Å; F270-L289 HydrophobicContact CB-CD2 4.04Å; D271-L289 HydrophobicContact CB-CD1 4.43Å; Y274-L289 HydrophobicContact CD1-CD1 4.16Å; Y274-L289 HydrophobicContact CD1-CG 4.4Å; Y274-L289 HydrophobicContact CD2-CG 4.28Å; Y274-L289 HydrophobicContact CG-CD1 3.89Å; Y274-L289 HydrophobicContact CG-CG 3.98Å; L289-L310 HydrophobicContact CD2-CD2 3.95Å; L289-W313 HydrophobicContact CD2-CD2 3.84Å; L289-W313 HydrophobicContact CD2-CG 3.99Å; L289-W313 HydrophobicContact CD2-CZ2 4.18Å
290	P	92.6	Very high	87.7	Confident	13 Å²	13	56 Å²	56	8%	0.084	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-66.2	137.1	172.4	27.3	-34.5	0	0	0	112.5	Y267 R306 R309 L310	Y267-P290 HydrophobicContact CE2-CG 4.41Å; Y267-P290 VanDerWaalsContact CE2-O 3.22Å; Y267-P290 WeakPolarHBondContact CE2-O 3.49Å; Y267-P290 PolarHBondContact OH-O 3.32Å; P290-R306 HydrophobicContact CG-CG 3.97Å; P290-R309 HydrophobicContact CB-CB 3.69Å; P290-R309 HydrophobicContact CB-CG 4.34Å; P290-R309 HydrophobicContact CG-CB 3.83Å; P290-L310 HydrophobicContact CG-CD2 3.99Å; P290-L310 HydrophobicContact CG-CG 4.02Å
291	E	82.6	Confident	87.5	Confident	130 Å²	130	61 Å²	61	61%	0.607	31%	0.312	S	S	*	.			trans	-37.8	146.5	-170.1	-70.1	154.7	-141.7	0	0	117.8	R306	E291-R306 PolarHBondContact O-NH2 2.72Å
292	K	85.1	Confident	87.4	Confident	137 Å²	137	61.7 Å²	61.7	60%	0.596	32%	0.315	S	S	*	.			trans	-80.9	114.3	167.5	-70.6	172.1	-179.1	172.2	0	109.5	Y267 D271	Y267-K292 HydrophobicContact CE1-CD 4.48Å; Y267-K292 HydrophobicContact CE1-CG 3.68Å; D271-K292 WeakPolarHBondContact OD1-CE 3.36Å; D271-K292 IonicContact OD1-NZ 3.28Å; D271-K292 PolarHBondContact OD1-NZ 3.07Å; D271-K292 WeakPolarHBondContact OD2-CE 3.37Å; D271-K292 IonicContact OD2-NZ 2.89Å; D271-K292 PolarHBondContact OD2-NZ 3.11Å
293	Q	80.3	Confident	87.5	Confident	81 Å²	81	61.7 Å²	61.7	38%	0.379	31%	0.314	S	S	.	.			trans	-115.8	135.4	173.2	-148.6	-177.4	-75.1	0	0	109.6	T295 F302	Q293-T295 WeakPolarHBondContact CG-O 3.48Å; Q293-T295 PolarHBondContact NE2-O 3.14Å; Q293-F302 HydrophobicContact CB-CD2 4.49Å; Q293-F302 HydrophobicContact CB-CE1 4.07Å; Q293-F302 HydrophobicContact CB-CE2 3.58Å; Q293-F302 HydrophobicContact CB-CZ 3.32Å; Q293-F302 HydrophobicContact CG-CE2 4.2Å; Q293-F302 HydrophobicContact CG-CZ 4.34Å; Q293-F302 VanDerWaalsContact OE1-CD2 3.24Å
294	A	70.3	Confident	87.5	Confident	81 Å²	81	64.6 Å²	64.6	67%	0.669	33%	0.327	S	S	*	.	S	Bend	trans	-95.5	-59.7	179.9	0	0	0	0	0	111.5	R297	A294-R297 WeakPolarHBondContact O-CB 3.4Å; A294-R297 VanDerWaalsContact O-CD 3.29Å; A294-R297 WeakPolarHBondContact O-CD 3.16Å; A294-R297 VanDerWaalsContact O-CG 3.28Å; A294-R297 WeakPolarHBondContact O-CG 3.3Å
295	T	74.1	Confident	87.4	Confident	124 Å²	124	68.3 Å²	68.3	76%	0.761	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	149	167.6	-44	0	0	0	0	110	Q293 R297	Q293-T295 WeakPolarHBondContact CG-O 3.48Å; Q293-T295 PolarHBondContact NE2-O 3.14Å; T295-R297 PolarHBondContact O-N 2.7Å
296	G	79.7	Confident	87.3	Confident	18 Å²	18	69.4 Å²	69.4	19%	0.186	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	6.5	178.3	0	0	0	0	0	116.2	F298 E299	G296-F298 PolarHBondContact O-N 3.4Å; G296-E299 WeakPolarHBondContact CA-OE1 3.4Å; G296-E299 WeakPolarHBondContact O-CB 3.46Å; G296-E299 WeakPolarHBondContact O-CG 3.49Å; G296-E299 PolarHBondContact O-N 2.85Å
297	R	79.7	Confident	87.3	Confident	101 Å²	101	71.4 Å²	71.4	38%	0.381	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	1.5	-174.6	72.4	-178.7	177.1	107	-3	116.6	S248 A294 T295 F302	S248-R297 PolarHBondContact O-NH1 3.15Å; A294-R297 WeakPolarHBondContact O-CB 3.4Å; A294-R297 VanDerWaalsContact O-CD 3.29Å; A294-R297 WeakPolarHBondContact O-CD 3.16Å; A294-R297 VanDerWaalsContact O-CG 3.28Å; A294-R297 WeakPolarHBondContact O-CG 3.3Å; T295-R297 PolarHBondContact O-N 2.7Å; R297-F302 HydrophobicContact CB-CE1 4.44Å
298	F	85.7	Confident	87.2	Confident	77 Å²	77	73.7 Å²	73.7	34%	0.338	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	4.6	176.1	-62.9	-62.9	0	0	0	113.2	K239 I250 G296	K239-F298 HydrophobicContact CD-CD1 4.43Å; K239-F298 HydrophobicContact CD-CE1 4.42Å; K239-F298 HydrophobicContact CG-CE1 4.28Å; I250-F298 HydrophobicContact CD1-CD1 3.94Å; I250-F298 HydrophobicContact CD1-CE1 4.22Å; I250-F298 HydrophobicContact CG1-CD1 4.24Å; I250-F298 HydrophobicContact CG1-CE1 4.42Å; G296-F298 PolarHBondContact O-N 3.4Å
299	E	88.2	Confident	87.3	Confident	115 Å²	115	72 Å²	72	54%	0.537	36%	0.355	S	S	.	.			trans	-70.1	140.6	175.4	-69.2	161.1	-164.4	0	0	110.8	G296 F302 I303	G296-E299 WeakPolarHBondContact CA-OE1 3.4Å; G296-E299 WeakPolarHBondContact O-CB 3.46Å; G296-E299 WeakPolarHBondContact O-CG 3.49Å; G296-E299 PolarHBondContact O-N 2.85Å; E299-F302 HydrophobicContact CB-CB 4.11Å; E299-F302 PolarHBondContact O-N 2.91Å; E299-I303 WeakPolarHBondContact O-CG1 3.44Å; E299-I303 PolarHBondContact O-N 2.81Å
300	E	87.7	Confident	87.4	Confident	168 Å²	168	70.9 Å²	70.9	79%	0.785	35%	0.349	S	S	*	.	H	α-helix	trans	-65	-49.4	-173.2	-171.4	175.3	178.1	0	0	112.5	F302 I303 E304	E300-F302 PolarHBondContact O-N 3.08Å; E300-I303 PolarHBondContact O-N 3.08Å; E300-I303 VanDerWaalsContact O-N 3.17Å; E300-E304 WeakPolarHBondContact O-CB 3.5Å; E300-E304 PolarHBondContact O-N 3.38Å
301	D	86.8	Confident	87.6	Confident	106 Å²	106	73.6 Å²	73.6	57%	0.567	36%	0.362	S	S	*	.	H	α-helix	trans	-57.7	-35.1	176.1	-80.9	-42.6	0	0	0	112	K305	D301-K305 WeakPolarHBondContact O-CB 3.26Å; D301-K305 PolarHBondContact O-N 2.95Å
302	F	90.3	Very high	88.3	Confident	22 Å²	22	69.3 Å²	69.3	10%	0.096	34%	0.343	C	S	.	.	H	α-helix	trans	-71.9	-45.7	176.4	177.3	-104.9	0	0	0	112.2	Q293 R297 E299 E300 E304 R306	Q293-F302 HydrophobicContact CB-CD2 4.49Å; Q293-F302 HydrophobicContact CB-CE1 4.07Å; Q293-F302 HydrophobicContact CB-CE2 3.58Å; Q293-F302 HydrophobicContact CB-CZ 3.32Å; Q293-F302 HydrophobicContact CG-CE2 4.2Å; Q293-F302 HydrophobicContact CG-CZ 4.34Å; Q293-F302 VanDerWaalsContact OE1-CD2 3.24Å; R297-F302 HydrophobicContact CB-CE1 4.44Å; E299-F302 HydrophobicContact CB-CB 4.11Å; E299-F302 PolarHBondContact O-N 2.91Å; E300-F302 PolarHBondContact O-N 3.08Å; F302-E304 VanDerWaalsContact C-N 3.31Å; F302-E304 PolarHBondContact O-N 2.84Å; F302-R306 WeakPolarHBondContact O-CB 3.48Å; F302-R306 PolarHBondContact O-N 2.87Å
303	I	91.4	Very high	88.9	Confident	23 Å²	23	62.8 Å²	62.8	12%	0.118	32%	0.315	C	S	.	.	H	α-helix	trans	-59.6	-44.3	175.7	-71.3	170	0	0	0	110.3	P237 I250 E299 E300 R306 K307	P237-I303 HydrophobicContact CB-CG2 3.59Å; P237-I303 HydrophobicContact CG-CG2 3.91Å; I250-I303 HydrophobicContact CD1-CD1 3.82Å; I250-I303 HydrophobicContact CG1-CD1 3.95Å; I250-I303 HydrophobicContact CG1-CG1 4.2Å; E299-I303 WeakPolarHBondContact O-CG1 3.44Å; E299-I303 PolarHBondContact O-N 2.81Å; E300-I303 PolarHBondContact O-N 3.08Å; E300-I303 VanDerWaalsContact O-N 3.17Å; I303-R306 PolarHBondContact O-N 2.75Å; I303-K307 WeakPolarHBondContact O-CB 3.36Å; I303-K307 PolarHBondContact O-N 2.55Å
304	E	91.3	Very high	89.7	Confident	61 Å²	61	59 Å²	59	29%	0.285	30%	0.297	S	S	.	.	H	α-helix	trans	-73	-41.9	-178	-171.8	53	-141.6	0	0	112.1	E300 F302 R306 K307 R308	E300-E304 WeakPolarHBondContact O-CB 3.5Å; E300-E304 PolarHBondContact O-N 3.38Å; F302-E304 VanDerWaalsContact C-N 3.31Å; F302-E304 PolarHBondContact O-N 2.84Å; E304-R306 VanDerWaalsContact C-N 3.3Å; E304-R306 PolarHBondContact O-N 2.79Å; E304-K307 WeakPolarHBondContact O-CB 3.42Å; E304-K307 PolarHBondContact O-N 3.38Å; E304-K307 VanDerWaalsContact O-N 3.17Å; E304-K307 IonicContact OE1-NZ 3.81Å; E304-K307 PolarHBondContact OE1-NZ 3.13Å; E304-K307 WeakPolarHBondContact OE2-CD 3.12Å; E304-K307 IonicContact OE2-NZ 3.89Å; E304-K307 PolarHBondContact OE2-NZ 2.65Å; E304-R308 WeakPolarHBondContact O-CG 3.19Å; E304-R308 PolarHBondContact O-N 2.96Å
305	K	92.5	Very high	91	Very high	82 Å²	82	58.1 Å²	58.1	36%	0.357	28%	0.281	S	S	.	.	H	α-helix	trans	-56.5	-44.5	170.4	-178.8	-174.5	175.2	-168.2	0	111.3	D301 R309	D301-K305 WeakPolarHBondContact O-CB 3.26Å; D301-K305 PolarHBondContact O-N 2.95Å; K305-R309 WeakPolarHBondContact O-CG 3.46Å; K305-R309 PolarHBondContact O-N 3Å
306	R	94.6	Very high	92.1	Very high	24 Å²	24	52.4 Å²	52.4	9%	0.091	25%	0.246	C	C	.	.	H	α-helix	trans	-64.5	-43.1	175.5	178.9	178.3	-86.5	164.4	-7.7	111.6	Y252 P290 E291 F302 I303 E304 R309 L310	Y252-R306 WeakPolarHBondContact OH-CD 3.41Å; Y252-R306 WeakPolarHBondContact OH-CG 3.49Å; P290-R306 HydrophobicContact CG-CG 3.97Å; E291-R306 PolarHBondContact O-NH2 2.72Å; F302-R306 WeakPolarHBondContact O-CB 3.48Å; F302-R306 PolarHBondContact O-N 2.87Å; I303-R306 PolarHBondContact O-N 2.75Å; E304-R306 VanDerWaalsContact C-N 3.3Å; E304-R306 PolarHBondContact O-N 2.79Å; R306-R309 PolarHBondContact O-N 3.34Å; R306-L310 HydrophobicContact CG-CD1 3.94Å; R306-L310 HydrophobicContact CG-CG 4.25Å; R306-L310 WeakPolarHBondContact O-CB 3.37Å; R306-L310 WeakPolarHBondContact O-CG 3.45Å; R306-L310 PolarHBondContact O-N 3.31Å
307	K	94.9	Very high	93	Very high	43 Å²	43	51.6 Å²	51.6	19%	0.187	24%	0.237	C	C	.	.	H	α-helix	trans	-57.6	-51.8	176.5	166	163.6	151.8	-85.9	0	111.6	P237 Y252 I303 E304 R309 L310 I311	P237-K307 HydrophobicContact CG-CD 4.14Å; Y252-K307 HydrophobicContact CE1-CB 4.17Å; I303-K307 WeakPolarHBondContact O-CB 3.36Å; I303-K307 PolarHBondContact O-N 2.55Å; E304-K307 WeakPolarHBondContact O-CB 3.42Å; E304-K307 PolarHBondContact O-N 3.38Å; E304-K307 VanDerWaalsContact O-N 3.17Å; E304-K307 IonicContact OE1-NZ 3.81Å; E304-K307 PolarHBondContact OE1-NZ 3.13Å; E304-K307 WeakPolarHBondContact OE2-CD 3.12Å; E304-K307 IonicContact OE2-NZ 3.89Å; E304-K307 PolarHBondContact OE2-NZ 2.65Å; K307-R309 VanDerWaalsContact C-N 3.32Å; K307-R309 PolarHBondContact O-N 3.41Å; K307-L310 PolarHBondContact O-N 2.92Å; K307-L310 VanDerWaalsContact O-N 3.11Å; K307-I311 HydrophobicContact CG-CD1 4.06Å; K307-I311 WeakPolarHBondContact O-CG1 3.24Å; K307-I311 PolarHBondContact O-N 3.29Å
308	R	94.8	Very high	93.8	Very high	49 Å²	49	47.1 Å²	47.1	19%	0.185	22%	0.221	C	C	.	.	H	α-helix	trans	-57.3	-42.8	177.4	-65	-170.5	-47	-95.7	-3	112.6	E304 I311 L312 D470	E304-R308 WeakPolarHBondContact O-CG 3.19Å; E304-R308 PolarHBondContact O-N 2.96Å; R308-I311 WeakPolarHBondContact O-CB 3.25Å; R308-I311 PolarHBondContact O-N 3.11Å; R308-L312 PolarHBondContact O-N 3.35Å; R308-L312 VanDerWaalsContact O-N 3.1Å; R308-D470 IonicContact CZ-OD2 3.17Å; R308-D470 IonicContact NE-OD2 3.36Å; R308-D470 PolarHBondContact NE-OD2 3.06Å; R308-D470 IonicContact NH2-OD2 3.83Å; R308-D470 PolarHBondContact NH2-OD2 3.13Å
309	R	96.6	Very high	94.3	Very high	34 Å²	34	45.8 Å²	45.8	13%	0.128	22%	0.221	C	C	.	.	H	α-helix	trans	-68	-35.4	176	-69.2	177.9	-177.9	-130.7	-21.9	113.2	P290 K305 R306 K307 L312 W313 D470 S473	P290-R309 HydrophobicContact CB-CB 3.69Å; P290-R309 HydrophobicContact CB-CG 4.34Å; P290-R309 HydrophobicContact CG-CB 3.83Å; K305-R309 WeakPolarHBondContact O-CG 3.46Å; K305-R309 PolarHBondContact O-N 3Å; R306-R309 PolarHBondContact O-N 3.34Å; K307-R309 VanDerWaalsContact C-N 3.32Å; K307-R309 PolarHBondContact O-N 3.41Å; R309-L312 PolarHBondContact O-N 2.86Å; R309-W313 VanDerWaalsContact O-CB 3.31Å; R309-W313 WeakPolarHBondContact O-CB 3.33Å; R309-W313 PolarHBondContact O-N 3.36Å; R309-D470 HydrophobicContact CG-CB 4.04Å; R309-D470 IonicContact CZ-OD1 3.2Å; R309-D470 VanDerWaalsContact CZ-OD1 3.25Å; R309-D470 IonicContact NE-OD1 2.66Å; R309-D470 PolarHBondContact NE-OD1 2.81Å; R309-D470 IonicContact NH2-OD1 3.03Å; R309-D470 PolarHBondContact NH2-OD1 3.15Å; R309-S473 PolarHBondContact NH1-OG 2.65Å
310	L	97.1	Very high	94.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-69.4	-31.1	173	-71.8	175.3	0	0	0	112.6	V234 Y252 F270 L289 P290 R306 K307 M314	V234-L310 HydrophobicContact CG1-CB 4.26Å; Y252-L310 HydrophobicContact CD1-CD1 4.45Å; Y252-L310 HydrophobicContact CD2-CD1 3.87Å; Y252-L310 HydrophobicContact CE1-CD1 4.23Å; Y252-L310 HydrophobicContact CE2-CD1 3.64Å; Y252-L310 HydrophobicContact CG-CD1 4.29Å; F270-L310 HydrophobicContact CD1-CD2 3.89Å; F270-L310 HydrophobicContact CE1-CD2 4.11Å; F270-L310 HydrophobicContact CE2-CD1 4.43Å; F270-L310 HydrophobicContact CG-CD2 4.21Å; F270-L310 HydrophobicContact CZ-CD1 4.38Å; L289-L310 HydrophobicContact CD2-CD2 3.95Å; P290-L310 HydrophobicContact CG-CD2 3.99Å; P290-L310 HydrophobicContact CG-CG 4.02Å; R306-L310 HydrophobicContact CG-CD1 3.94Å; R306-L310 HydrophobicContact CG-CG 4.25Å; R306-L310 WeakPolarHBondContact O-CB 3.37Å; R306-L310 WeakPolarHBondContact O-CG 3.45Å; R306-L310 PolarHBondContact O-N 3.31Å; K307-L310 PolarHBondContact O-N 2.92Å; K307-L310 VanDerWaalsContact O-N 3.11Å; L310-M314 VanDerWaalsContact O-CB 3.25Å; L310-M314 WeakPolarHBondContact O-CB 3.4Å; L310-M314 PolarHBondContact O-N 2.87Å
311	I	96.9	Very high	95.2	Very high	69 Å²	69	33.1 Å²	33.1	35%	0.354	16%	0.164	S	C	.	.	H	α-helix	trans	-63.6	-50.7	170.7	-66.8	164.3	0	0	0	110.1	V234 K307 R308 W313 M314 D315	V234-I311 HydrophobicContact CB-CG1 3.77Å; V234-I311 HydrophobicContact CG2-CG1 4.28Å; K307-I311 HydrophobicContact CG-CD1 4.06Å; K307-I311 WeakPolarHBondContact O-CG1 3.24Å; K307-I311 PolarHBondContact O-N 3.29Å; R308-I311 WeakPolarHBondContact O-CB 3.25Å; R308-I311 PolarHBondContact O-N 3.11Å; I311-W313 VanDerWaalsContact C-N 3.33Å; I311-W313 PolarHBondContact O-N 2.94Å; I311-M314 PolarHBondContact O-N 2.84Å; I311-D315 WeakPolarHBondContact O-CB 3.44Å; I311-D315 PolarHBondContact O-N 3.42Å
312	L	96.9	Very high	95.6	Very high	40 Å²	40	28.1 Å²	28.1	21%	0.209	14%	0.137	C	C	.	.	H	α-helix	trans	-61	-40.8	177.5	-69.4	175	0	0	0	112.5	R308 R309 H316 D470 L474	R308-L312 PolarHBondContact O-N 3.35Å; R308-L312 VanDerWaalsContact O-N 3.1Å; R309-L312 PolarHBondContact O-N 2.86Å; L312-H316 WeakPolarHBondContact O-CB 3.41Å; L312-H316 PolarHBondContact O-N 3.45Å; L312-D470 VanDerWaalsContact CD1-C 3.49Å; L312-D470 HydrophobicContact CD1-CB 3.89Å; L312-L474 HydrophobicContact CB-CD2 4.43Å
313	W	97.7	Very high	95.9	Very high	1 Å²	1	27.1 Å²	27.1	0%	0.004	13%	0.133	C	C	.	.	H	α-helix	trans	-61	-46.5	173.8	-176.2	90.2	0	0	0	111.7	F270 L273 L277 P287 L289 R309 I311 H316 M317	F270-W313 HydrophobicContact CD1-CE3 4.14Å; F270-W313 AromaticContact CD1-CZ3 3.88Å; F270-W313 HydrophobicContact CD1-CZ3 3.88Å; F270-W313 HydrophobicContact CE1-CE3 4.48Å; F270-W313 HydrophobicContact CE1-CZ3 4.33Å; L273-W313 HydrophobicContact CD2-CH2 3.88Å; L273-W313 HydrophobicContact CG-CH2 4.48Å; L277-W313 HydrophobicContact CD1-CH2 4.45Å; L277-W313 HydrophobicContact CD1-CZ2 3.99Å; P287-W313 HydrophobicContact CG-CG 4.47Å; P287-W313 VanDerWaalsContact O-CD1 3.24Å; P287-W313 PolarHBondContact O-NE1 3.48Å; L289-W313 HydrophobicContact CD2-CD2 3.84Å; L289-W313 HydrophobicContact CD2-CG 3.99Å; L289-W313 HydrophobicContact CD2-CZ2 4.18Å; R309-W313 VanDerWaalsContact O-CB 3.31Å; R309-W313 WeakPolarHBondContact O-CB 3.33Å; R309-W313 PolarHBondContact O-N 3.36Å; I311-W313 VanDerWaalsContact C-N 3.33Å; I311-W313 PolarHBondContact O-N 2.94Å; W313-H316 PolarHBondContact O-N 3.13Å; W313-M317 HydrophobicContact CD2-CG 3.93Å; W313-M317 HydrophobicContact CE3-CG 3.96Å; W313-M317 HydrophobicContact CH2-CE 4.45Å; W313-M317 HydrophobicContact CH2-CG 3.76Å; W313-M317 HydrophobicContact CH2-SD 4.34Å; W313-M317 HydrophobicContact CZ2-CG 3.74Å; W313-M317 HydrophobicContact CZ2-SD 4.02Å; W313-M317 HydrophobicContact CZ3-CG 3.88Å; W313-M317 WeakPolarHBondContact O-CB 3.39Å; W313-M317 VanDerWaalsContact O-CG 3.24Å; W313-M317 WeakPolarHBondContact O-CG 3.49Å; W313-M317 PolarHBondContact O-N 3.3Å
314	M	97.7	Very high	96.1	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.3	-46.1	179.4	-174.2	60.5	68.2	0	0	111.8	C232 V234 L254 F270 L310 I311 H316 M317 T318 F329 F332 L333	C232-M314 HydrophobicContact CB-CG 3.75Å; C232-M314 HydrophobicContact CB-SD 3.84Å; C232-M314 WeakPolarHBondContact O-CG 3.3Å; V234-M314 HydrophobicContact CG2-CB 3.72Å; V234-M314 HydrophobicContact CG2-CE 4.43Å; V234-M314 HydrophobicContact CG2-CG 3.95Å; L254-M314 HydrophobicContact CD1-CE 4.07Å; L254-M314 HydrophobicContact CD2-CE 3.98Å; F270-M314 HydrophobicContact CE1-CE 4.03Å; L310-M314 VanDerWaalsContact O-CB 3.25Å; L310-M314 WeakPolarHBondContact O-CB 3.4Å; L310-M314 PolarHBondContact O-N 2.87Å; I311-M314 PolarHBondContact O-N 2.84Å; M314-H316 VanDerWaalsContact C-N 3.33Å; M314-H316 PolarHBondContact O-N 3.36Å; M314-M317 CarbonylContact O-C 3.57Å; M314-M317 WeakPolarHBondContact O-CB 3.31Å; M314-M317 PolarHBondContact O-N 2.9Å; M314-M317 VanDerWaalsContact O-N 3.14Å; M314-T318 HydrophobicContact CG-CG2 4.42Å; M314-T318 WeakPolarHBondContact O-CG2 3.23Å; M314-T318 PolarHBondContact O-N 2.95Å; M314-T318 PolarHBondContact O-OG1 3Å; M314-T318 VanDerWaalsContact O-OG1 3.13Å; M314-T318 HydrophobicContact SD-CG2 4.1Å; M314-F329 HydrophobicContact CE-CE2 4.33Å; M314-F329 HydrophobicContact SD-CE2 3.81Å; M314-F329 HydrophobicContact SD-CZ 3.69Å; M314-F332 HydrophobicContact CE-CE1 4.15Å; M314-L333 HydrophobicContact CE-CD2 4.02Å; M314-L333 HydrophobicContact SD-CD2 4.16Å
315	D	97	Very high	96.3	Very high	64 Å²	64	26.2 Å²	26.2	34%	0.342	13%	0.128	S	C	.	.	H	α-helix	trans	-63.8	-37.3	179.4	-175.2	59.6	0	0	0	112.1	I311 T318 S319 R537	I311-D315 WeakPolarHBondContact O-CB 3.44Å; I311-D315 PolarHBondContact O-N 3.42Å; D315-T318 PolarHBondContact O-OG1 2.93Å; D315-S319 VanDerWaalsContact O-CB 3.26Å; D315-S319 WeakPolarHBondContact O-CB 3.47Å; D315-S319 PolarHBondContact O-N 3.14Å; D315-S319 PolarHBondContact O-OG 3.21Å; D315-R537 IonicContact OD2-CZ 2.69Å; D315-R537 IonicContact OD2-NH1 3.75Å; D315-R537 PolarHBondContact OD2-NH1 3.14Å; D315-R537 IonicContact OD2-NH2 3.04Å; D315-R537 PolarHBondContact OD2-NH2 2.9Å
316	H	97.1	Very high	96.3	Very high	4 Å²	4	22.5 Å²	22.5	2%	0.019	11%	0.112	C	C	.	.	H	α-helix	trans	-63.1	-49.2	170.1	-168.7	101.4	0	0	0	111.2	P287 L312 W313 M314 T318 S319 H320	P287-H316 HydrophobicContact CB-CB 4.46Å; P287-H316 HydrophobicContact CG-CB 4.26Å; L312-H316 WeakPolarHBondContact O-CB 3.41Å; L312-H316 PolarHBondContact O-N 3.45Å; W313-H316 PolarHBondContact O-N 3.13Å; M314-H316 VanDerWaalsContact C-N 3.33Å; M314-H316 PolarHBondContact O-N 3.36Å; H316-T318 VanDerWaalsContact C-N 3.34Å; H316-T318 PolarHBondContact O-N 3.29Å; H316-S319 PolarHBondContact O-N 3.32Å; H316-S319 PolarHBondContact O-OG 3.11Å; H316-H320 WeakPolarHBondContact O-CB 3.35Å; H316-H320 PolarHBondContact O-N 3.42Å
317	M	97.4	Very high	96.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.5	-37.7	178.5	-76.1	-65.5	-54.4	0	0	113.7	L277 P287 W313 M314 L323 S324 F329	L277-M317 HydrophobicContact CD1-CE 3.42Å; L277-M317 VanDerWaalsContact CD1-CE 3.42Å; L277-M317 HydrophobicContact CD1-SD 3.69Å; L277-M317 HydrophobicContact CD2-CE 3.94Å; L277-M317 HydrophobicContact CG-CE 4.34Å; P287-M317 HydrophobicContact CG-CG 4.05Å; P287-M317 HydrophobicContact CG-SD 3.97Å; W313-M317 HydrophobicContact CD2-CG 3.93Å; W313-M317 HydrophobicContact CE3-CG 3.96Å; W313-M317 HydrophobicContact CH2-CE 4.45Å; W313-M317 HydrophobicContact CH2-CG 3.76Å; W313-M317 HydrophobicContact CH2-SD 4.34Å; W313-M317 HydrophobicContact CZ2-CG 3.74Å; W313-M317 HydrophobicContact CZ2-SD 4.02Å; W313-M317 HydrophobicContact CZ3-CG 3.88Å; W313-M317 WeakPolarHBondContact O-CB 3.39Å; W313-M317 VanDerWaalsContact O-CG 3.24Å; W313-M317 WeakPolarHBondContact O-CG 3.49Å; W313-M317 PolarHBondContact O-N 3.3Å; M314-M317 CarbonylContact O-C 3.57Å; M314-M317 WeakPolarHBondContact O-CB 3.31Å; M314-M317 PolarHBondContact O-N 2.9Å; M314-M317 VanDerWaalsContact O-N 3.14Å; M317-L323 HydrophobicContact CE-CB 3.78Å; M317-L323 HydrophobicContact CE-CD1 4.46Å; M317-L323 HydrophobicContact SD-CB 4.16Å; M317-L323 HydrophobicContact SD-CD1 3.79Å; M317-S324 WeakPolarHBondContact O-CA 3.47Å; M317-S324 WeakPolarHBondContact O-CB 3.42Å; M317-S324 PolarHBondContact O-N 3.24Å; M317-F329 HydrophobicContact CB-CE1 4.07Å; M317-F329 HydrophobicContact CB-CE2 4.35Å; M317-F329 HydrophobicContact CB-CZ 3.71Å; M317-F329 HydrophobicContact CE-CD1 4.19Å; M317-F329 HydrophobicContact CE-CD2 4.38Å; M317-F329 HydrophobicContact CE-CE1 4.29Å; M317-F329 HydrophobicContact CE-CE2 4.47Å; M317-F329 HydrophobicContact CE-CG 4.22Å; M317-F329 HydrophobicContact CE-CZ 4.42Å
318	T	97	Very high	96.2	Very high	8 Å²	8	23.6 Å²	23.6	5%	0.049	12%	0.119	C	C	.	.	H	α-helix	trans	-82.2	-29.6	178.9	56.3	0	0	0	0	113.4	F230 C232 M314 D315 H316 S324 F329	F230-T318 HydrophobicContact CD2-CG2 4.03Å; F230-T318 HydrophobicContact CE2-CG2 3.45Å; F230-T318 VanDerWaalsContact CE2-CG2 3.45Å; F230-T318 HydrophobicContact CZ-CG2 4.03Å; C232-T318 HydrophobicContact CB-CG2 4.19Å; M314-T318 HydrophobicContact CG-CG2 4.42Å; M314-T318 WeakPolarHBondContact O-CG2 3.23Å; M314-T318 PolarHBondContact O-N 2.95Å; M314-T318 PolarHBondContact O-OG1 3Å; M314-T318 VanDerWaalsContact O-OG1 3.13Å; M314-T318 HydrophobicContact SD-CG2 4.1Å; D315-T318 PolarHBondContact O-OG1 2.93Å; H316-T318 VanDerWaalsContact C-N 3.34Å; H316-T318 PolarHBondContact O-N 3.29Å; T318-S324 WeakPolarHBondContact O-CB 3.29Å; T318-F329 HydrophobicContact CG2-CE1 4.07Å; T318-F329 HydrophobicContact CG2-CZ 3.83Å
319	S	96.5	Very high	96.3	Very high	48 Å²	48	21.3 Å²	21.3	34%	0.336	11%	0.11	S	C	.	.	H	α-helix	trans	-82.3	-17	176.2	59.7	0	0	0	0	114.2	D315 H316 P321 R537	D315-S319 VanDerWaalsContact O-CB 3.26Å; D315-S319 WeakPolarHBondContact O-CB 3.47Å; D315-S319 PolarHBondContact O-N 3.14Å; D315-S319 PolarHBondContact O-OG 3.21Å; H316-S319 PolarHBondContact O-N 3.32Å; H316-S319 PolarHBondContact O-OG 3.11Å; S319-P321 WeakPolarHBondContact O-CD 3.5Å; S319-R537 PolarHBondContact OG-NH1 3.35Å
320	H	97.6	Very high	96.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.116	C	C	.	.	S	Bend	trans	-75	122.2	176.5	-169.9	-55.6	0	0	0	112	W223 I284 H316 V322 L323 S324 E530 H533	W223-H320 AromaticContact CD1-CE1 4Å; W223-H320 AromaticContact NE1-CE1 3.96Å; I284-H320 VanDerWaalsContact CG2-NE2 3.33Å; I284-H320 WeakPolarHBondContact CG2-NE2 3.41Å; H316-H320 WeakPolarHBondContact O-CB 3.35Å; H316-H320 PolarHBondContact O-N 3.42Å; H320-V322 PolarHBondContact ND1-N 3.09Å; H320-V322 VanDerWaalsContact ND1-N 3.13Å; H320-V322 PolarHBondContact O-N 3.09Å; H320-L323 HydrophobicContact CB-CB 4.05Å; H320-L323 HydrophobicContact CB-CD1 4.11Å; H320-L323 HydrophobicContact CB-CG 4.21Å; H320-L323 PolarHBondContact ND1-N 2.87Å; H320-S324 VanDerWaalsContact O-CB 3.23Å; H320-S324 WeakPolarHBondContact O-CB 3.38Å; H320-S324 PolarHBondContact O-N 2.78Å; H320-S324 PolarHBondContact O-OG 2.87Å; H320-E530 IonicContact CE1-OE2 3.12Å; H320-E530 IonicContact NE2-OE1 2.71Å; H320-E530 IonicContact NE2-OE2 2.78Å; H320-E530 PolarHBondContact NE2-OE2 2.83Å; H320-H533 AromaticContact CD2-CD2 3.27Å; H320-H533 PolarHBondContact CD2-CD2 2.87Å; H320-H533 AromaticContact CD2-NE2 3.33Å; H320-H533 PolarHBondContact CD2-NE2 3.26Å; H320-H533 VanDerWaalsContact CD2-NE2 3.33Å; H320-H533 AromaticContact CG-CD2 3.98Å; H320-H533 AromaticContact CG-NE2 3.68Å; H320-H533 AromaticContact NE2-CD2 3.52Å
321	P	96.4	Very high	96.1	Very high	17 Å²	17	23.7 Å²	23.7	11%	0.11	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-41.6	-173.7	-25.6	34.8	0	0	0	115.1	W223 K224 S319 S324 Q325	W223-P321 HydrophobicContact CB-CB 3.96Å; W223-P321 HydrophobicContact CB-CG 3.97Å; K224-P321 WeakPolarHBondContact O-CB 3.35Å; S319-P321 WeakPolarHBondContact O-CD 3.5Å; P321-S324 PolarHBondContact O-OG 3.29Å; P321-Q325 PolarHBondContact O-NE2 3.43Å
322	V	95.9	Very high	96	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.012	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-61.6	174.9	-179.3	0	0	0	0	111.8	Y212 W223 F281 I284 H320 S324 Q325 F358	Y212-V322 HydrophobicContact CD1-CB 4.16Å; Y212-V322 HydrophobicContact CD1-CG1 3.77Å; Y212-V322 HydrophobicContact CD1-CG2 4.18Å; Y212-V322 HydrophobicContact CE1-CB 4.43Å; Y212-V322 HydrophobicContact CE1-CG1 3.77Å; Y212-V322 HydrophobicContact CG-CG1 4.22Å; Y212-V322 HydrophobicContact CG-CG2 4.5Å; W223-V322 HydrophobicContact CD2-CG2 3.55Å; W223-V322 HydrophobicContact CE3-CG2 3.56Å; W223-V322 HydrophobicContact CG-CG2 4.09Å; W223-V322 HydrophobicContact CH2-CG2 4.28Å; W223-V322 HydrophobicContact CZ2-CG2 4.26Å; W223-V322 HydrophobicContact CZ3-CG2 3.91Å; F281-V322 HydrophobicContact CD1-CG1 4.02Å; F281-V322 HydrophobicContact CE1-CG1 3.54Å; F281-V322 HydrophobicContact CZ-CG1 4.35Å; I284-V322 HydrophobicContact CD1-CG2 4.34Å; H320-V322 PolarHBondContact ND1-N 3.09Å; H320-V322 VanDerWaalsContact ND1-N 3.13Å; H320-V322 PolarHBondContact O-N 3.09Å; V322-S324 VanDerWaalsContact C-N 3.28Å; V322-S324 PolarHBondContact O-N 3.49Å; V322-Q325 PolarHBondContact O-N 2.96Å; V322-F358 HydrophobicContact CG1-CZ 4.19Å
323	L	96.4	Very high	95.9	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-59.7	-34.3	-171.8	-55.4	175.1	0	0	0	113.4	L277 F281 I284 V286 M317 H320 Q325 Y326 F329	L277-L323 HydrophobicContact CD2-CD2 4.42Å; F281-L323 HydrophobicContact CB-CD2 4.48Å; F281-L323 HydrophobicContact CD1-CD2 4.26Å; F281-L323 HydrophobicContact CD2-CD2 3.6Å; F281-L323 HydrophobicContact CE1-CD2 4.48Å; F281-L323 HydrophobicContact CE2-CD2 3.85Å; F281-L323 HydrophobicContact CG-CD2 3.85Å; F281-L323 HydrophobicContact CZ-CD2 4.3Å; I284-L323 HydrophobicContact CG2-CD1 3.99Å; I284-L323 HydrophobicContact CG2-CD2 3.91Å; I284-L323 HydrophobicContact CG2-CG 3.96Å; V286-L323 HydrophobicContact CG2-CD2 4.48Å; M317-L323 HydrophobicContact CE-CB 3.78Å; M317-L323 HydrophobicContact CE-CD1 4.46Å; M317-L323 HydrophobicContact SD-CB 4.16Å; M317-L323 HydrophobicContact SD-CD1 3.79Å; H320-L323 HydrophobicContact CB-CB 4.05Å; H320-L323 HydrophobicContact CB-CD1 4.11Å; H320-L323 HydrophobicContact CB-CG 4.21Å; H320-L323 PolarHBondContact ND1-N 2.87Å; L323-Q325 PolarHBondContact O-N 3.04Å; L323-Y326 PolarHBondContact O-N 3.47Å; L323-F329 WeakPolarHBondContact O-CD1 3.4Å
324	S	95.9	Very high	95.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-65.5	-21.1	177.3	60.7	0	0	0	0	114.2	N226 F230 M317 T318 H320 P321 V322 Q330	N226-S324 PolarHBondContact ND2-OG 3.21Å; F230-S324 WeakPolarHBondContact CE1-O 3.47Å; M317-S324 WeakPolarHBondContact O-CA 3.47Å; M317-S324 WeakPolarHBondContact O-CB 3.42Å; M317-S324 PolarHBondContact O-N 3.24Å; T318-S324 WeakPolarHBondContact O-CB 3.29Å; H320-S324 VanDerWaalsContact O-CB 3.23Å; H320-S324 WeakPolarHBondContact O-CB 3.38Å; H320-S324 PolarHBondContact O-N 2.78Å; H320-S324 PolarHBondContact O-OG 2.87Å; P321-S324 PolarHBondContact O-OG 3.29Å; V322-S324 VanDerWaalsContact C-N 3.28Å; V322-S324 PolarHBondContact O-N 3.49Å; S324-Q330 PolarHBondContact O-NE2 3.23Å
325	Q	94.4	Very high	95.5	Very high	66 Å²	66	21.9 Å²	21.9	31%	0.308	12%	0.12	S	C	.	.	G	3₁₀ helix	trans	-94.4	-7.1	-179.4	-69.4	179.6	88.8	0	0	114	Y212 N226 P321 V322 L323 E327	Y212-Q325 HydrophobicContact CE1-CB 4.13Å; N226-Q325 HydrophobicContact CB-CG 4.17Å; P321-Q325 PolarHBondContact O-NE2 3.43Å; V322-Q325 PolarHBondContact O-N 2.96Å; L323-Q325 PolarHBondContact O-N 3.04Å; Q325-E327 PolarHBondContact O-N 3.33Å
326	Y	94.6	Very high	95.2	Very high	4 Å²	4	24.4 Å²	24.4	2%	0.016	13%	0.133	C	C	.	.			trans	-62.5	128.4	-176.8	173	-134	0	0	0	112.9	L273 L277 K280 F281 L323 G328 F329 Q330	L273-Y326 HydrophobicContact CD1-CD1 4.32Å; L273-Y326 HydrophobicContact CD1-CE1 3.94Å; L277-Y326 HydrophobicContact CD2-CD1 3.57Å; L277-Y326 HydrophobicContact CD2-CE1 3.93Å; L277-Y326 HydrophobicContact CD2-CG 4.49Å; K280-Y326 HydrophobicContact CD-CD2 3.89Å; K280-Y326 HydrophobicContact CD-CE2 3.56Å; F281-Y326 HydrophobicContact CE2-CD1 4.26Å; F281-Y326 HydrophobicContact CE2-CD2 4.36Å; F281-Y326 HydrophobicContact CE2-CG 4.04Å; F281-Y326 HydrophobicContact CZ-CD2 4.24Å; F281-Y326 HydrophobicContact CZ-CG 4.11Å; L323-Y326 PolarHBondContact O-N 3.47Å; Y326-G328 VanDerWaalsContact C-N 3.28Å; Y326-G328 PolarHBondContact O-N 3.11Å; Y326-F329 HydrophobicContact CD1-CB 3.99Å; Y326-F329 WeakPolarHBondContact O-CB 3.14Å; Y326-F329 PolarHBondContact O-N 3.48Å; Y326-Q330 PolarHBondContact O-N 3.44Å
327	E	92.9	Very high	94.9	Very high	88 Å²	88	27.6 Å²	27.6	41%	0.411	15%	0.15	S	C	.	.	H	α-helix	trans	-54.6	-42	-179.2	-165.3	-163.6	165.1	0	0	112.3	Q325 F329 Q330 H331 R347	Q325-E327 PolarHBondContact O-N 3.33Å; E327-F329 VanDerWaalsContact C-N 3.27Å; E327-F329 PolarHBondContact O-N 2.88Å; E327-Q330 PolarHBondContact O-N 2.94Å; E327-H331 WeakPolarHBondContact O-CB 3.47Å; E327-H331 PolarHBondContact O-N 3.33Å; E327-R347 WeakPolarHBondContact OE1-CD 3.41Å; E327-R347 IonicContact OE1-CZ 3.6Å; E327-R347 IonicContact OE1-NE 3.77Å; E327-R347 IonicContact OE1-NH1 2.67Å; E327-R347 PolarHBondContact OE1-NH1 3.27Å
328	G	93.8	Very high	94.4	Very high	2 Å²	2	32.4 Å²	32.4	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-65.5	-27.3	178.8	0	0	0	0	0	113.9	Y326 F332	Y326-G328 VanDerWaalsContact C-N 3.28Å; Y326-G328 PolarHBondContact O-N 3.11Å; G328-F332 VanDerWaalsContact O-CB 3.31Å; G328-F332 WeakPolarHBondContact O-CB 3.27Å; G328-F332 PolarHBondContact O-N 3.38Å; G328-F332 VanDerWaalsContact O-N 3.1Å
329	F	96.1	Very high	94.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-79.8	-40.3	172.9	-178.4	-138.6	0	0	0	111.5	F230 L273 M314 M317 T318 L323 Y326 E327 H331 F332 L333	F230-F329 HydrophobicContact CE2-CE1 4.49Å; F230-F329 HydrophobicContact CZ-CD1 4.49Å; F230-F329 AromaticContact CZ-CE1 3.99Å; F230-F329 HydrophobicContact CZ-CE1 3.99Å; L273-F329 HydrophobicContact CD2-CD2 3.7Å; L273-F329 HydrophobicContact CD2-CE2 4.42Å; M314-F329 HydrophobicContact CE-CE2 4.33Å; M314-F329 HydrophobicContact SD-CE2 3.81Å; M314-F329 HydrophobicContact SD-CZ 3.69Å; M317-F329 HydrophobicContact CB-CE1 4.07Å; M317-F329 HydrophobicContact CB-CE2 4.35Å; M317-F329 HydrophobicContact CB-CZ 3.71Å; M317-F329 HydrophobicContact CE-CD1 4.19Å; M317-F329 HydrophobicContact CE-CD2 4.38Å; M317-F329 HydrophobicContact CE-CE1 4.29Å; M317-F329 HydrophobicContact CE-CE2 4.47Å; M317-F329 HydrophobicContact CE-CG 4.22Å; M317-F329 HydrophobicContact CE-CZ 4.42Å; T318-F329 HydrophobicContact CG2-CE1 4.07Å; T318-F329 HydrophobicContact CG2-CZ 3.83Å; L323-F329 WeakPolarHBondContact O-CD1 3.4Å; Y326-F329 HydrophobicContact CD1-CB 3.99Å; Y326-F329 WeakPolarHBondContact O-CB 3.14Å; Y326-F329 PolarHBondContact O-N 3.48Å; E327-F329 VanDerWaalsContact C-N 3.27Å; E327-F329 PolarHBondContact O-N 2.88Å; F329-H331 PolarHBondContact O-N 2.88Å; F329-F332 HydrophobicContact CD2-CD1 4.23Å; F329-F332 HydrophobicContact CE2-CD1 4.42Å; F329-F332 WeakPolarHBondContact O-CB 3.34Å; F329-F332 PolarHBondContact O-N 2.97Å; F329-F332 VanDerWaalsContact O-N 3.17Å; F329-L333 HydrophobicContact CD2-CD1 4.18Å; F329-L333 HydrophobicContact CD2-CG 4.09Å; F329-L333 HydrophobicContact CE1-CD1 4.09Å; F329-L333 HydrophobicContact CE2-CD1 3.73Å; F329-L333 HydrophobicContact CE2-CD2 4.12Å; F329-L333 HydrophobicContact CE2-CG 3.86Å; F329-L333 HydrophobicContact CZ-CD1 3.69Å; F329-L333 HydrophobicContact CZ-CG 4.34Å; F329-L333 WeakPolarHBondContact O-CG 3.49Å; F329-L333 PolarHBondContact O-N 2.7Å
330	Q	94	Very high	94	Very high	53 Å²	53	43.3 Å²	43.3	25%	0.248	22%	0.218	C	C	.	.	H	α-helix	trans	-61.2	-42.9	173.3	-67.9	-61.9	-28.9	0	0	111.7	F230 S324 Y326 E327 L333 S334	F230-Q330 VanDerWaalsContact CZ-NE2 3.32Å; S324-Q330 PolarHBondContact O-NE2 3.23Å; Y326-Q330 PolarHBondContact O-N 3.44Å; E327-Q330 PolarHBondContact O-N 2.94Å; Q330-L333 PolarHBondContact O-N 3.04Å; Q330-S334 WeakPolarHBondContact O-CB 3.42Å; Q330-S334 PolarHBondContact O-N 2.76Å; Q330-S334 PolarHBondContact O-OG 3.41Å
331	H	94.9	Very high	93.8	Very high	32 Å²	32	44.2 Å²	44.2	15%	0.148	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-42.1	171.8	-179.5	66.4	0	0	0	112.1	E327 F329 L333 S334 C335 Q340 W341 G344	E327-H331 WeakPolarHBondContact O-CB 3.47Å; E327-H331 PolarHBondContact O-N 3.33Å; F329-H331 PolarHBondContact O-N 2.88Å; H331-L333 VanDerWaalsContact C-N 3.26Å; H331-L333 PolarHBondContact O-N 2.72Å; H331-S334 PolarHBondContact O-N 3Å; H331-C335 PolarHBondContact CE1-SG 3.2Å; H331-C335 WeakPolarHBondContact O-CB 3.16Å; H331-C335 PolarHBondContact O-N 2.92Å; H331-C335 VanDerWaalsContact O-N 3.09Å; H331-Q340 PolarHBondContact CE1-O 3.32Å; H331-Q340 VanDerWaalsContact CE1-O 3.31Å; H331-W341 AromaticContact CD2-CE3 3.68Å; H331-W341 AromaticContact CD2-CZ3 3.51Å; H331-W341 AromaticContact NE2-CE3 3.3Å; H331-W341 VanDerWaalsContact NE2-CE3 3.3Å; H331-W341 AromaticContact NE2-CZ3 3.66Å; H331-W341 PolarHBondContact NE2-O 3.01Å; H331-G344 WeakPolarHBondContact NE2-CA 3.22Å
332	F	96.3	Very high	93.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-58.4	-36.2	174.2	176.4	-91.5	0	0	0	112.6	L254 R265 H269 F270 L273 M314 G328 F329 W341	L254-F332 HydrophobicContact CD1-CD1 4.24Å; L254-F332 HydrophobicContact CD1-CE1 3.41Å; L254-F332 VanDerWaalsContact CD1-CE1 3.41Å; L254-F332 HydrophobicContact CD1-CZ 3.9Å; R265-F332 HydrophobicContact CB-CE2 4.14Å; R265-F332 HydrophobicContact CB-CZ 3.91Å; R265-F332 HydrophobicContact CG-CD2 4.45Å; R265-F332 HydrophobicContact CG-CE1 4.24Å; R265-F332 HydrophobicContact CG-CE2 3.85Å; R265-F332 HydrophobicContact CG-CZ 3.73Å; R265-F332 VanDerWaalsContact CZ-O 3.23Å; R265-F332 PolarHBondContact NE-O 2.66Å; R265-F332 PolarHBondContact NH2-O 2.67Å; H269-F332 HydrophobicContact CB-CE2 3.89Å; F270-F332 HydrophobicContact CD1-CE1 4.29Å; F270-F332 AromaticContact CD1-CZ 3.73Å; F270-F332 HydrophobicContact CD1-CZ 3.73Å; F270-F332 HydrophobicContact CD2-CZ 4.04Å; F270-F332 HydrophobicContact CE1-CE1 4.14Å; F270-F332 AromaticContact CE1-CZ 3.81Å; F270-F332 HydrophobicContact CE1-CZ 3.81Å; F270-F332 HydrophobicContact CE2-CZ 4.11Å; F270-F332 HydrophobicContact CG-CE2 4.46Å; F270-F332 AromaticContact CG-CZ 3.86Å; F270-F332 HydrophobicContact CG-CZ 3.86Å; F270-F332 HydrophobicContact CZ-CZ 4.01Å; L273-F332 HydrophobicContact CB-CD2 4.3Å; L273-F332 HydrophobicContact CD2-CB 3.93Å; L273-F332 HydrophobicContact CD2-CD1 3.78Å; L273-F332 HydrophobicContact CD2-CD2 3.99Å; L273-F332 HydrophobicContact CD2-CE1 4.26Å; L273-F332 HydrophobicContact CD2-CE2 4.45Å; L273-F332 HydrophobicContact CD2-CG 3.63Å; M314-F332 HydrophobicContact CE-CE1 4.15Å; G328-F332 VanDerWaalsContact O-CB 3.31Å; G328-F332 WeakPolarHBondContact O-CB 3.27Å; G328-F332 PolarHBondContact O-N 3.38Å; G328-F332 VanDerWaalsContact O-N 3.1Å; F329-F332 HydrophobicContact CD2-CD1 4.23Å; F329-F332 HydrophobicContact CE2-CD1 4.42Å; F329-F332 WeakPolarHBondContact O-CB 3.34Å; F329-F332 PolarHBondContact O-N 2.97Å; F329-F332 VanDerWaalsContact O-N 3.17Å; F332-W341 HydrophobicContact CB-CZ3 4.49Å; F332-W341 AromaticContact CD2-CH2 3.99Å; F332-W341 HydrophobicContact CD2-CH2 3.99Å
333	L	95.1	Very high	93.5	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-88.2	-26.1	-179	-68.8	-176.3	0	0	0	115.4	F230 C232 L254 P256 V263 M314 F329 Q330 H331	F230-L333 HydrophobicContact CE2-CD1 3.46Å; F230-L333 VanDerWaalsContact CE2-CD1 3.46Å; F230-L333 HydrophobicContact CZ-CD1 3.94Å; C232-L333 HydrophobicContact CB-CD2 4.42Å; L254-L333 HydrophobicContact CD1-CD2 3.96Å; P256-L333 HydrophobicContact CG-CB 3.84Å; P256-L333 HydrophobicContact CG-CD1 4.47Å; P256-L333 HydrophobicContact CG-CD2 4.34Å; P256-L333 HydrophobicContact CG-CG 4.45Å; V263-L333 VanDerWaalsContact CG1-O 3.26Å; V263-L333 WeakPolarHBondContact CG1-O 3.44Å; V263-L333 VanDerWaalsContact CG2-O 3.23Å; V263-L333 WeakPolarHBondContact CG2-O 3.23Å; M314-L333 HydrophobicContact CE-CD2 4.02Å; M314-L333 HydrophobicContact SD-CD2 4.16Å; F329-L333 HydrophobicContact CD2-CD1 4.18Å; F329-L333 HydrophobicContact CD2-CG 4.09Å; F329-L333 HydrophobicContact CE1-CD1 4.09Å; F329-L333 HydrophobicContact CE2-CD1 3.73Å; F329-L333 HydrophobicContact CE2-CD2 4.12Å; F329-L333 HydrophobicContact CE2-CG 3.86Å; F329-L333 HydrophobicContact CZ-CD1 3.69Å; F329-L333 HydrophobicContact CZ-CG 4.34Å; F329-L333 WeakPolarHBondContact O-CG 3.49Å; F329-L333 PolarHBondContact O-N 2.7Å; Q330-L333 PolarHBondContact O-N 3.04Å; H331-L333 VanDerWaalsContact C-N 3.26Å; H331-L333 PolarHBondContact O-N 2.72Å
334	S	92.6	Very high	93.4	Very high	65 Å²	65	57.3 Å²	57.3	46%	0.455	28%	0.283	S	S	.	.	H	α-helix	trans	-106.7	-23.4	-172.5	60.5	0	0	0	0	115.5	Q330 H331 L336	Q330-S334 WeakPolarHBondContact O-CB 3.42Å; Q330-S334 PolarHBondContact O-N 2.76Å; Q330-S334 PolarHBondContact O-OG 3.41Å; H331-S334 PolarHBondContact O-N 3Å; S334-L336 PolarHBondContact O-N 2.92Å
335	C	92.9	Very high	93.3	Very high	7 Å²	7	60.6 Å²	60.6	5%	0.047	30%	0.297	C	S	.	.			trans	-72.6	112.7	-171.7	-170.6	0	0	0	0	113.1	R265 H331 D337 W341	R265-C335 PolarHBondContact NH1-O 3.38Å; R265-C335 PolarHBondContact NH2-O 3.03Å; H331-C335 PolarHBondContact CE1-SG 3.2Å; H331-C335 WeakPolarHBondContact O-CB 3.16Å; H331-C335 PolarHBondContact O-N 2.92Å; H331-C335 VanDerWaalsContact O-N 3.09Å; C335-D337 PolarHBondContact SG-O 3.18Å; C335-W341 HydrophobicContact CB-CE3 4.21Å; C335-W341 VanDerWaalsContact SG-CA 3.58Å; C335-W341 PolarHBondContact SG-N 2.77Å
336	L	90.8	Very high	93.3	Very high	117 Å²	117	65.8 Å²	65.8	61%	0.613	31%	0.314	S	S	*	.			trans	-89.3	-32.1	177.9	-68.3	164.3	0	0	0	113.6	V263 S334	V263-L336 HydrophobicContact CG1-CD2 3.93Å; V263-L336 HydrophobicContact CG1-CG 4.4Å; S334-L336 PolarHBondContact O-N 2.92Å
337	D	91.3	Very high	93.2	Very high	70 Å²	70	73 Å²	73	37%	0.374	34%	0.341	S	S	.	.			trans	-91.3	141.3	-175.6	170.4	-111.5	0	0	0	113.3	C335 K339 Q340 W341	C335-D337 PolarHBondContact SG-O 3.18Å; D337-K339 WeakPolarHBondContact OD1-CA 3.22Å; D337-K339 WeakPolarHBondContact OD1-CB 2.98Å; D337-K339 PolarHBondContact OD1-N 3.05Å; D337-Q340 HydrophobicContact CB-CB 4.17Å; D337-Q340 HydrophobicContact CB-CG 4.23Å; D337-Q340 WeakPolarHBondContact OD1-CG 3.41Å; D337-Q340 PolarHBondContact OD1-N 3.32Å; D337-W341 VanDerWaalsContact O-CB 3.24Å; D337-W341 WeakPolarHBondContact O-CB 3.32Å; D337-W341 PolarHBondContact O-N 3.32Å
338	D	88.1	Confident	93.1	Very high	102 Å²	102	69.3 Å²	69.3	55%	0.545	33%	0.326	S	S	.	.	H	α-helix	trans	-77.2	-24	-175.8	-117.2	15.5	0	0	0	112.6	K342	D338-K342 PolarHBondContact O-N 2.98Å
339	K	92	Very high	93.1	Very high	165 Å²	165	72.3 Å²	72.3	72%	0.717	34%	0.339	S	S	*	.	H	α-helix	trans	-77.6	-48.1	173.9	-61.7	-176.8	178.5	-176.8	0	110.6	D337 W341 K342 M343	D337-K339 WeakPolarHBondContact OD1-CA 3.22Å; D337-K339 WeakPolarHBondContact OD1-CB 2.98Å; D337-K339 PolarHBondContact OD1-N 3.05Å; K339-W341 PolarHBondContact O-N 3.05Å; K339-K342 PolarHBondContact O-N 3.06Å; K339-M343 WeakPolarHBondContact O-CG 3.29Å; K339-M343 PolarHBondContact O-N 3.29Å; K339-M343 VanDerWaalsContact O-N 3.1Å
340	Q	92.3	Very high	92.8	Very high	120 Å²	120	80.8 Å²	80.8	56%	0.561	38%	0.376	S	S	*	.	H	α-helix	trans	-58.3	-37.1	171.1	-69.1	-178.6	8.3	0	0	111.4	H331 D337 K342 M343 G344	H331-Q340 PolarHBondContact CE1-O 3.32Å; H331-Q340 VanDerWaalsContact CE1-O 3.31Å; D337-Q340 HydrophobicContact CB-CB 4.17Å; D337-Q340 HydrophobicContact CB-CG 4.23Å; D337-Q340 WeakPolarHBondContact OD1-CG 3.41Å; D337-Q340 PolarHBondContact OD1-N 3.32Å; Q340-K342 PolarHBondContact O-N 3.12Å; Q340-M343 PolarHBondContact O-N 2.94Å; Q340-M343 VanDerWaalsContact O-N 3.15Å; Q340-G344 PolarHBondContact O-N 2.8Å
341	W	93.3	Very high	92.5	Very high	19 Å²	19	80.1 Å²	80.1	7%	0.072	37%	0.374	C	S	.	.	H	α-helix	trans	-57	-50.5	174.9	176	-116.7	0	0	0	111.7	H269 W272 H331 F332 C335 D337 K339 M343 K345	H269-W341 HydrophobicContact CB-CZ2 4.28Å; W272-W341 AromaticContact CE3-CH2 3.86Å; W272-W341 HydrophobicContact CE3-CH2 3.86Å; W272-W341 HydrophobicContact CE3-CZ2 4.19Å; W272-W341 HydrophobicContact CH2-CH2 4.41Å; W272-W341 AromaticContact CZ3-CH2 3.62Å; W272-W341 HydrophobicContact CZ3-CH2 3.62Å; W272-W341 HydrophobicContact CZ3-CZ2 4.34Å; W272-W341 HydrophobicContact CZ3-CZ3 4.39Å; H331-W341 AromaticContact CD2-CE3 3.68Å; H331-W341 AromaticContact CD2-CZ3 3.51Å; H331-W341 AromaticContact NE2-CE3 3.3Å; H331-W341 VanDerWaalsContact NE2-CE3 3.3Å; H331-W341 AromaticContact NE2-CZ3 3.66Å; H331-W341 PolarHBondContact NE2-O 3.01Å; F332-W341 HydrophobicContact CB-CZ3 4.49Å; F332-W341 AromaticContact CD2-CH2 3.99Å; F332-W341 HydrophobicContact CD2-CH2 3.99Å; C335-W341 HydrophobicContact CB-CE3 4.21Å; C335-W341 VanDerWaalsContact SG-CA 3.58Å; C335-W341 PolarHBondContact SG-N 2.77Å; D337-W341 VanDerWaalsContact O-CB 3.24Å; D337-W341 WeakPolarHBondContact O-CB 3.32Å; D337-W341 PolarHBondContact O-N 3.32Å; K339-W341 PolarHBondContact O-N 3.05Å; W341-M343 VanDerWaalsContact C-N 3.32Å; W341-M343 PolarHBondContact O-N 3.03Å; W341-K345 VanDerWaalsContact O-CB 3.26Å; W341-K345 WeakPolarHBondContact O-CB 3.47Å; W341-K345 PolarHBondContact O-N 2.88Å
342	K	93.6	Very high	92	Very high	148 Å²	148	84.9 Å²	84.9	64%	0.643	40%	0.397	S	S	*	.	H	α-helix	trans	-58.3	-40.4	174.4	-70.6	-176.9	-179.4	-171.5	0	112.1	D338 K339 Q340 R346	D338-K342 PolarHBondContact O-N 2.98Å; K339-K342 PolarHBondContact O-N 3.06Å; Q340-K342 PolarHBondContact O-N 3.12Å; K342-R346 WeakPolarHBondContact O-CG 3.4Å; K342-R346 PolarHBondContact O-N 3.12Å; K342-R346 VanDerWaalsContact O-N 3.08Å
343	M	93.2	Very high	91.4	Very high	138 Å²	138	85.9 Å²	85.9	68%	0.68	40%	0.401	S	S	*	.	H	α-helix	trans	-68.3	-49.5	-179.6	-68.3	177.4	71.4	0	0	112.9	K339 Q340 W341 K345 R346 R347	K339-M343 WeakPolarHBondContact O-CG 3.29Å; K339-M343 PolarHBondContact O-N 3.29Å; K339-M343 VanDerWaalsContact O-N 3.1Å; Q340-M343 PolarHBondContact O-N 2.94Å; Q340-M343 VanDerWaalsContact O-N 3.15Å; W341-M343 VanDerWaalsContact C-N 3.32Å; W341-M343 PolarHBondContact O-N 3.03Å; M343-K345 VanDerWaalsContact C-N 3.34Å; M343-R346 PolarHBondContact O-N 2.88Å; M343-R347 PolarHBondContact O-N 2.7Å
344	G	93.6	Very high	90.8	Very high	8 Å²	8	87.3 Å²	87.3	8%	0.082	41%	0.41	C	S	.	.	H	α-helix	trans	-69.3	-30.9	178.3	0	0	0	0	0	113	H331 Q340 R347 A348	H331-G344 WeakPolarHBondContact NE2-CA 3.22Å; Q340-G344 PolarHBondContact O-N 2.8Å; G344-R347 WeakPolarHBondContact O-CB 3.38Å; G344-R347 PolarHBondContact O-N 3.35Å; G344-A348 PolarHBondContact O-N 3.19Å
345	K	93.6	Very high	90.2	Very high	68 Å²	68	84.8 Å²	84.8	30%	0.296	39%	0.394	S	S	.	.	H	α-helix	trans	-56	-54	166.2	168.1	174.5	-174.2	-63.7	0	110.8	W272 W341 M343 R347 A348 E349	W272-K345 HydrophobicContact CZ2-CB 4.06Å; W272-K345 HydrophobicContact CZ2-CG 3.87Å; W341-K345 VanDerWaalsContact O-CB 3.26Å; W341-K345 WeakPolarHBondContact O-CB 3.47Å; W341-K345 PolarHBondContact O-N 2.88Å; M343-K345 VanDerWaalsContact C-N 3.34Å; K345-R347 VanDerWaalsContact C-N 3.27Å; K345-R347 PolarHBondContact O-N 3.33Å; K345-A348 PolarHBondContact O-N 2.93Å; K345-E349 WeakPolarHBondContact CE-OE1 3.49Å; K345-E349 VanDerWaalsContact CG-OE2 3.31Å; K345-E349 WeakPolarHBondContact CG-OE2 3.46Å; K345-E349 IonicContact NZ-OE1 3.88Å; K345-E349 PolarHBondContact NZ-OE1 2.75Å; K345-E349 IonicContact NZ-OE2 3.42Å; K345-E349 PolarHBondContact NZ-OE2 3.35Å; K345-E349 WeakPolarHBondContact O-CB 3.38Å; K345-E349 WeakPolarHBondContact O-CG 3.36Å; K345-E349 PolarHBondContact O-N 3.47Å
346	R	93.9	Very high	89.5	Confident	176 Å²	176	85 Å²	85	66%	0.664	40%	0.397	S	S	*	.	H	α-helix	trans	-62.6	-29.6	178.4	-76.2	176.7	169.9	177.9	-3.6	113	K342 M343 K350	K342-R346 WeakPolarHBondContact O-CG 3.4Å; K342-R346 PolarHBondContact O-N 3.12Å; K342-R346 VanDerWaalsContact O-N 3.08Å; M343-R346 PolarHBondContact O-N 2.88Å; R346-K350 WeakPolarHBondContact O-CG 3.45Å; R346-K350 PolarHBondContact O-N 2.9Å
347	R	92.1	Very high	89.3	Confident	155 Å²	155	80.4 Å²	80.4	59%	0.585	38%	0.375	S	S	*	.	H	α-helix	trans	-66	-54.8	171.8	-175.6	-171.7	-64.9	172.3	0.6	111.3	E327 M343 G344 K345 E349 K350 D351	E327-R347 WeakPolarHBondContact OE1-CD 3.41Å; E327-R347 IonicContact OE1-CZ 3.6Å; E327-R347 IonicContact OE1-NE 3.77Å; E327-R347 IonicContact OE1-NH1 2.67Å; E327-R347 PolarHBondContact OE1-NH1 3.27Å; M343-R347 PolarHBondContact O-N 2.7Å; G344-R347 WeakPolarHBondContact O-CB 3.38Å; G344-R347 PolarHBondContact O-N 3.35Å; K345-R347 VanDerWaalsContact C-N 3.27Å; K345-R347 PolarHBondContact O-N 3.33Å; R347-E349 PolarHBondContact O-N 2.87Å; R347-K350 CarbonylContact O-C 3.6Å; R347-K350 PolarHBondContact O-N 2.85Å; R347-D351 PolarHBondContact O-N 3.32Å
348	A	92.4	Very high	89.2	Confident	11 Å²	11	77.1 Å²	77.1	9%	0.091	36%	0.357	C	S	.	.	H	α-helix	trans	-65.9	-17.4	179.4	0	0	0	0	0	113.7	W272 G344 K345	W272-A348 HydrophobicContact CH2-CB 4.1Å; W272-A348 HydrophobicContact CZ2-CB 4.06Å; G344-A348 PolarHBondContact O-N 3.19Å; K345-A348 PolarHBondContact O-N 2.93Å
349	E	92.6	Very high	89.2	Confident	65 Å²	65	72.3 Å²	72.3	30%	0.304	33%	0.331	S	S	.	.	H	α-helix	trans	-83.9	-20.7	171.8	-75.3	168.9	160.3	0	0	113.8	W272 K345 R347	W272-E349 PolarHBondContact NE1-OE1 3.48Å; K345-E349 WeakPolarHBondContact CE-OE1 3.49Å; K345-E349 VanDerWaalsContact CG-OE2 3.31Å; K345-E349 WeakPolarHBondContact CG-OE2 3.46Å; K345-E349 IonicContact NZ-OE1 3.88Å; K345-E349 PolarHBondContact NZ-OE1 2.75Å; K345-E349 IonicContact NZ-OE2 3.42Å; K345-E349 PolarHBondContact NZ-OE2 3.35Å; K345-E349 WeakPolarHBondContact O-CB 3.38Å; K345-E349 WeakPolarHBondContact O-CG 3.36Å; K345-E349 PolarHBondContact O-N 3.47Å; R347-E349 PolarHBondContact O-N 2.87Å
350	K	91	Very high	89.1	Confident	177 Å²	177	66.8 Å²	66.8	77%	0.77	31%	0.309	S	S	*	.	S	Bend	trans	-103.3	20	175.1	-66.6	-173.8	176.4	-164.4	0	113	R346 R347 E352	R346-K350 WeakPolarHBondContact O-CG 3.45Å; R346-K350 PolarHBondContact O-N 2.9Å; R347-K350 CarbonylContact O-C 3.6Å; R347-K350 PolarHBondContact O-N 2.85Å; K350-E352 PolarHBondContact O-N 3.46Å
351	D	86.5	Confident	89	Confident	40 Å²	40	61.1 Å²	61.1	21%	0.214	28%	0.283	C	S	.	.			trans	-69.8	116.3	176.4	-172.9	-5.2	0	0	0	110.2	K280 R347 M353 V354	K280-D351 WeakPolarHBondContact CD-OD2 3.48Å; K280-D351 WeakPolarHBondContact CE-OD2 3.45Å; K280-D351 IonicContact NZ-OD1 3.21Å; K280-D351 IonicContact NZ-OD2 3.21Å; K280-D351 PolarHBondContact NZ-OD2 2.92Å; R347-D351 PolarHBondContact O-N 3.32Å; D351-M353 WeakPolarHBondContact OD1-CB 3.22Å; D351-M353 PolarHBondContact OD1-N 3.3Å; D351-V354 HydrophobicContact CB-CG1 4.25Å; D351-V354 VanDerWaalsContact O-CG1 3.28Å; D351-V354 WeakPolarHBondContact O-CG1 3.38Å
352	E	84.8	Confident	89	Confident	132 Å²	132	61 Å²	61	62%	0.617	28%	0.283	S	S	*	.	S	Bend	trans	-84	-15.9	179.2	-55.3	-175.1	164.7	0	0	112.6	M205 K350 V354 S357	M205-E352 HydrophobicContact CE-CB 3.82Å; M205-E352 VanDerWaalsContact CE-OE2 3.29Å; M205-E352 WeakPolarHBondContact CE-OE2 3.48Å; M205-E352 HydrophobicContact SD-CB 4.02Å; K350-E352 PolarHBondContact O-N 3.46Å; E352-V354 PolarHBondContact O-N 2.98Å; E352-S357 VanDerWaalsContact O-CB 3.32Å; E352-S357 WeakPolarHBondContact O-CB 3.31Å; E352-S357 PolarHBondContact O-OG 3.46Å
353	M	83.1	Confident	88.9	Confident	20 Å²	20	59.2 Å²	59.2	10%	0.099	28%	0.277	C	S	.	.	S	Bend	trans	-86.2	49.5	-178.5	-64.5	-60	-64.3	0	0	111.5	M205 I208 K280 D351 S357 F358 L360 T361	M205-M353 HydrophobicContact CB-SD 4.42Å; M205-M353 HydrophobicContact CG-SD 4.43Å; M205-M353 HydrophobicContact SD-SD 3.65Å; M205-M353 VanDerWaalsContact SD-SD 3.65Å; I208-M353 HydrophobicContact CG1-CE 4.26Å; K280-M353 WeakPolarHBondContact CE-O 3.33Å; D351-M353 WeakPolarHBondContact OD1-CB 3.22Å; D351-M353 PolarHBondContact OD1-N 3.3Å; M353-S357 VanDerWaalsContact CE-O 3.24Å; M353-S357 WeakPolarHBondContact CE-O 3.49Å; M353-F358 WeakPolarHBondContact O-CB 3.46Å; M353-L360 HydrophobicContact CE-CB 4.35Å; M353-T361 HydrophobicContact CE-CG2 3.53Å
354	V	83.9	Confident	89	Confident	30 Å²	30	55 Å²	55	18%	0.182	26%	0.257	C	S	.	.			trans	-112.7	159.4	-176	-66.7	0	0	0	0	111.6	K280 D351 E352 A356 S357	K280-V354 HydrophobicContact CB-CG1 4.09Å; K280-V354 HydrophobicContact CG-CG1 4.25Å; D351-V354 HydrophobicContact CB-CG1 4.25Å; D351-V354 VanDerWaalsContact O-CG1 3.28Å; D351-V354 WeakPolarHBondContact O-CG1 3.38Å; E352-V354 PolarHBondContact O-N 2.98Å; V354-A356 PolarHBondContact O-N 3.2Å; V354-S357 PolarHBondContact O-N 3.45Å
355	G	80.4	Confident	88.9	Confident	12 Å²	12	55.6 Å²	55.6	12%	0.124	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	-106.4	170.7	0	0	0	0	0	114	S192 K280 T282	S192-G355 CarbonylContact O-C 3.55Å; K280-G355 PolarHBondContact O-N 3.31Å; T282-G355 PolarHBondContact OG1-O 2.94Å
356	A	78.4	Confident	88.6	Confident	13 Å²	13	59.2 Å²	59.2	11%	0.107	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-40.7	176.5	0	0	0	0	0	112.9	S192 G193 F197 V202 V354 F358 L359	S192-A356 PolarHBondContact O-N 3.35Å; G193-A356 VanDerWaalsContact O-CB 3.23Å; G193-A356 WeakPolarHBondContact O-CB 3.38Å; F197-A356 HydrophobicContact CB-CB 4.23Å; V202-A356 HydrophobicContact CG2-CB 3.61Å; V354-A356 PolarHBondContact O-N 3.2Å; A356-F358 VanDerWaalsContact C-N 3.26Å; A356-F358 PolarHBondContact O-N 3.07Å; A356-L359 WeakPolarHBondContact O-CB 3.48Å; A356-L359 PolarHBondContact O-N 3.1Å
357	S	85.8	Confident	88.3	Confident	20 Å²	20	55.9 Å²	55.9	14%	0.14	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-64.9	-33.2	-179.1	-53.6	0	0	0	0	111.4	E352 M353 V354 L359 L360	E352-S357 VanDerWaalsContact O-CB 3.32Å; E352-S357 WeakPolarHBondContact O-CB 3.31Å; E352-S357 PolarHBondContact O-OG 3.46Å; M353-S357 VanDerWaalsContact CE-O 3.24Å; M353-S357 WeakPolarHBondContact CE-O 3.49Å; V354-S357 PolarHBondContact O-N 3.45Å; S357-L359 PolarHBondContact O-N 3.43Å; S357-L360 VanDerWaalsContact O-CB 3.32Å; S357-L360 WeakPolarHBondContact O-CB 3.21Å; S357-L360 PolarHBondContact O-N 2.67Å
358	F	88.4	Confident	87.8	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-53.7	-37.4	175.3	173.5	-121.9	0	0	0	112.6	Y212 K280 F281 V283 V322 M353 A356 L360 T361 F362	Y212-F358 HydrophobicContact CD2-CE2 4.01Å; Y212-F358 AromaticContact CE2-CE2 3.78Å; Y212-F358 HydrophobicContact CE2-CE2 3.78Å; K280-F358 HydrophobicContact CG-CD2 4.37Å; F281-F358 HydrophobicContact CD1-CD1 4.32Å; F281-F358 HydrophobicContact CD1-CD2 4.43Å; F281-F358 AromaticContact CD1-CE1 3.6Å; F281-F358 HydrophobicContact CD1-CE1 3.6Å; F281-F358 AromaticContact CD1-CE2 3.76Å; F281-F358 HydrophobicContact CD1-CE2 3.76Å; F281-F358 AromaticContact CD1-CZ 3.29Å; F281-F358 HydrophobicContact CD1-CZ 3.29Å; F281-F358 HydrophobicContact CE1-CD2 4.3Å; F281-F358 HydrophobicContact CE1-CE1 4.24Å; F281-F358 AromaticContact CE1-CE2 3.51Å; F281-F358 HydrophobicContact CE1-CE2 3.51Å; F281-F358 AromaticContact CE1-CZ 3.48Å; F281-F358 HydrophobicContact CE1-CZ 3.48Å; F281-F358 VanDerWaalsContact CE1-CZ 3.48Å; V283-F358 HydrophobicContact CG2-CE1 4.39Å; V322-F358 HydrophobicContact CG1-CZ 4.19Å; M353-F358 WeakPolarHBondContact O-CB 3.46Å; A356-F358 VanDerWaalsContact C-N 3.26Å; A356-F358 PolarHBondContact O-N 3.07Å; F358-L360 PolarHBondContact O-N 2.78Å; F358-L360 VanDerWaalsContact O-N 3.16Å; F358-T361 HydrophobicContact CD2-CG2 4.46Å; F358-T361 WeakPolarHBondContact O-CB 3.19Å; F358-T361 WeakPolarHBondContact O-CG2 3.41Å; F358-T361 PolarHBondContact O-N 2.7Å; F358-T361 PolarHBondContact O-OG1 3.31Å; F358-F362 HydrophobicContact CD1-CZ 4.19Å; F358-F362 AromaticContact CE1-CE1 3.78Å; F358-F362 HydrophobicContact CE1-CE1 3.78Å; F358-F362 HydrophobicContact CE1-CE2 4.25Å; F358-F362 AromaticContact CE1-CZ 3.33Å; F358-F362 HydrophobicContact CE1-CZ 3.33Å; F358-F362 AromaticContact CE2-CE1 3.91Å; F358-F362 HydrophobicContact CE2-CE1 3.91Å; F358-F362 HydrophobicContact CE2-CZ 4.32Å; F358-F362 HydrophobicContact CZ-CD1 4.48Å; F358-F362 AromaticContact CZ-CE1 3.32Å; F358-F362 HydrophobicContact CZ-CE1 3.32Å; F358-F362 AromaticContact CZ-CZ 3.4Å; F358-F362 HydrophobicContact CZ-CZ 3.4Å; F358-F362 VanDerWaalsContact CZ-CZ 3.4Å
359	L	89.6	Confident	87.5	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-65.9	-17.3	180	-60.4	174.3	0	0	0	113.6	V194 F197 V283 A356 S357 T361 F362 V523	V194-L359 HydrophobicContact CG2-CD1 4.11Å; F197-L359 HydrophobicContact CB-CD1 4.06Å; F197-L359 HydrophobicContact CD1-CB 4.14Å; F197-L359 HydrophobicContact CD1-CD1 3.51Å; F197-L359 HydrophobicContact CD1-CG 4.49Å; F197-L359 HydrophobicContact CD2-CB 3.77Å; F197-L359 HydrophobicContact CD2-CD1 4.25Å; F197-L359 HydrophobicContact CE1-CB 3.92Å; F197-L359 HydrophobicContact CE1-CD1 3.93Å; F197-L359 HydrophobicContact CE2-CB 3.54Å; F197-L359 HydrophobicContact CG-CB 4.06Å; F197-L359 HydrophobicContact CG-CD1 3.68Å; F197-L359 HydrophobicContact CZ-CB 3.62Å; F197-L359 HydrophobicContact CZ-CD1 4.47Å; V283-L359 HydrophobicContact CG1-CD2 4.21Å; V283-L359 HydrophobicContact CG2-CD2 4.04Å; A356-L359 WeakPolarHBondContact O-CB 3.48Å; A356-L359 PolarHBondContact O-N 3.1Å; S357-L359 PolarHBondContact O-N 3.43Å; L359-T361 VanDerWaalsContact C-N 3.26Å; L359-T361 PolarHBondContact O-N 2.92Å; L359-F362 HydrophobicContact CD2-CD2 4.01Å; L359-F362 HydrophobicContact CD2-CE2 3.58Å; L359-F362 HydrophobicContact CD2-CZ 4.47Å; L359-V523 HydrophobicContact CD1-CG2 3.96Å
360	L	89.1	Confident	87.3	Confident	48 Å²	48	56.5 Å²	56.5	25%	0.251	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-73.6	-15.9	172	-62.8	168.4	0	0	0	112.9	F197 V202 I208 M353 S357 F358 F362	F197-L360 HydrophobicContact CD2-CD2 4.44Å; F197-L360 HydrophobicContact CE2-CD2 3.85Å; F197-L360 HydrophobicContact CE2-CG 4.15Å; V202-L360 HydrophobicContact CG1-CD1 3.85Å; I208-L360 HydrophobicContact CD1-CB 4.14Å; M353-L360 HydrophobicContact CE-CB 4.35Å; S357-L360 VanDerWaalsContact O-CB 3.32Å; S357-L360 WeakPolarHBondContact O-CB 3.21Å; S357-L360 PolarHBondContact O-N 2.67Å; F358-L360 PolarHBondContact O-N 2.78Å; F358-L360 VanDerWaalsContact O-N 3.16Å; L360-F362 PolarHBondContact O-N 2.9Å
361	T	90.8	Very high	87.1	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.006	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-77.8	-7.2	176.4	69	0	0	0	0	113.2	I208 E210 T211 Y212 M353 F358 L359	I208-T361 HydrophobicContact CG2-CG2 4.4Å; E210-T361 HydrophobicContact CB-CG2 4.42Å; T211-T361 WeakPolarHBondContact CA-O 3.42Å; Y212-T361 WeakPolarHBondContact CD2-OG1 3.23Å; Y212-T361 PolarHBondContact N-O 3.22Å; M353-T361 HydrophobicContact CE-CG2 3.53Å; F358-T361 HydrophobicContact CD2-CG2 4.46Å; F358-T361 WeakPolarHBondContact O-CB 3.19Å; F358-T361 WeakPolarHBondContact O-CG2 3.41Å; F358-T361 PolarHBondContact O-N 2.7Å; F358-T361 PolarHBondContact O-OG1 3.31Å; L359-T361 VanDerWaalsContact C-N 3.26Å; L359-T361 PolarHBondContact O-N 2.92Å
362	F	92.3	Very high	87.3	Confident	17 Å²	17	52.3 Å²	52.3	8%	0.075	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	121.8	-173.4	-68.3	-16.4	0	0	0	113.3	Y212 W223 V283 F358 L359 L360 V522 A526	Y212-F362 HydrophobicContact CD2-CD1 4.5Å; Y212-F362 HydrophobicContact CD2-CE1 4.41Å; Y212-F362 WeakPolarHBondContact O-CA 3.46Å; W223-F362 HydrophobicContact CH2-CD1 4.41Å; W223-F362 AromaticContact CH2-CE1 3.77Å; W223-F362 HydrophobicContact CH2-CE1 3.77Å; W223-F362 AromaticContact CH2-CE2 3.98Å; W223-F362 HydrophobicContact CH2-CE2 3.98Å; W223-F362 AromaticContact CH2-CZ 3.51Å; W223-F362 HydrophobicContact CH2-CZ 3.51Å; W223-F362 HydrophobicContact CZ2-CZ 4.48Å; W223-F362 HydrophobicContact CZ3-CD1 4.24Å; W223-F362 AromaticContact CZ3-CE1 3.89Å; W223-F362 HydrophobicContact CZ3-CE1 3.89Å; W223-F362 HydrophobicContact CZ3-CZ 4.12Å; V283-F362 HydrophobicContact CG2-CE2 3.84Å; V283-F362 HydrophobicContact CG2-CZ 4Å; F358-F362 HydrophobicContact CD1-CZ 4.19Å; F358-F362 AromaticContact CE1-CE1 3.78Å; F358-F362 HydrophobicContact CE1-CE1 3.78Å; F358-F362 HydrophobicContact CE1-CE2 4.25Å; F358-F362 AromaticContact CE1-CZ 3.33Å; F358-F362 HydrophobicContact CE1-CZ 3.33Å; F358-F362 AromaticContact CE2-CE1 3.91Å; F358-F362 HydrophobicContact CE2-CE1 3.91Å; F358-F362 HydrophobicContact CE2-CZ 4.32Å; F358-F362 HydrophobicContact CZ-CD1 4.48Å; F358-F362 AromaticContact CZ-CE1 3.32Å; F358-F362 HydrophobicContact CZ-CE1 3.32Å; F358-F362 AromaticContact CZ-CZ 3.4Å; F358-F362 HydrophobicContact CZ-CZ 3.4Å; F358-F362 VanDerWaalsContact CZ-CZ 3.4Å; L359-F362 HydrophobicContact CD2-CD2 4.01Å; L359-F362 HydrophobicContact CD2-CE2 3.58Å; L359-F362 HydrophobicContact CD2-CZ 4.47Å; L360-F362 PolarHBondContact O-N 2.9Å; F362-V522 HydrophobicContact CB-CG1 3.92Å; F362-V522 HydrophobicContact CD2-CG1 3.92Å; F362-V522 HydrophobicContact CG-CG1 4.45Å; F362-A526 HydrophobicContact CD2-CB 3.91Å; F362-A526 HydrophobicContact CE2-CB 3.47Å; F362-A526 VanDerWaalsContact CE2-CB 3.47Å; F362-A526 HydrophobicContact CZ-CB 4.28Å
363	Q	92.8	Very high	87.7	Confident	111 Å²	111	50.3 Å²	50.3	52%	0.519	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	112.4	165.6	-71.8	177.2	-12	0	0	109.4	T211 Y212 S213 I214	T211-Q363 VanDerWaalsContact CG2-CD 3.42Å; T211-Q363 HydrophobicContact CG2-CG 3.72Å; Y212-Q363 PolarHBondContact O-N 3.11Å; S213-Q363 PolarHBondContact OG-OE1 3.34Å; I214-Q363 PolarHBondContact N-O 2.86Å
364	I	93.6	Very high	88.1	Confident	50 Å²	50	49.6 Å²	49.6	26%	0.256	26%	0.262	S	S	.	.			trans	-94.5	157	177.2	58.9	167.4	0	0	0	112.6	I214 R521 V522 F525	I214-I364 HydrophobicContact CD1-CG2 4.32Å; I364-R521 HydrophobicContact CD1-CB 4.36Å; I364-V522 HydrophobicContact CD1-CG2 3.94Å; I364-V522 HydrophobicContact CG1-CG2 4.47Å; I364-V522 HydrophobicContact CG2-CB 4.49Å; I364-V522 HydrophobicContact CG2-CG1 4.42Å; I364-V522 HydrophobicContact CG2-CG2 4.34Å; I364-F525 HydrophobicContact CB-CB 4.42Å; I364-F525 HydrophobicContact CB-CD2 3.77Å; I364-F525 HydrophobicContact CB-CE2 4.29Å; I364-F525 HydrophobicContact CB-CG 4.21Å; I364-F525 HydrophobicContact CD1-CD2 3.79Å; I364-F525 HydrophobicContact CD1-CE2 4.01Å; I364-F525 HydrophobicContact CG1-CD2 4.37Å; I364-F525 HydrophobicContact CG2-CB 3.74Å; I364-F525 HydrophobicContact CG2-CD2 3.86Å; I364-F525 HydrophobicContact CG2-CG 4.05Å
365	P	92.2	Very high	88.5	Confident	20 Å²	20	49.3 Å²	49.3	13%	0.13	26%	0.259	C	S	.	.			trans	-57.5	150.7	168.2	-23.6	34.9	0	0	0	112.4	I214 M216 E367 F525	I214-P365 HydrophobicContact CG2-CG 4.4Å; I214-P365 WeakPolarHBondContact O-CD 3.42Å; I214-P365 WeakPolarHBondContact O-CG 3.26Å; M216-P365 HydrophobicContact CG-CB 3.85Å; M216-P365 HydrophobicContact CG-CG 3.74Å; M216-P365 HydrophobicContact SD-CB 4.31Å; M216-P365 HydrophobicContact SD-CG 3.89Å; P365-E367 VanDerWaalsContact C-N 3.29Å; P365-F525 HydrophobicContact CB-CE1 4.38Å; P365-F525 HydrophobicContact CB-CZ 4.39Å; P365-F525 HydrophobicContact CG-CD1 4.39Å; P365-F525 HydrophobicContact CG-CE1 4.08Å
366	T	87.4	Confident	89.3	Confident	143 Å²	143	52.8 Å²	52.8	88%	0.877	28%	0.275	S	S	*	.	S	Bend	trans	-70.1	-27.7	173	46.7	0	0	0	0	112.6	R521	T366-R521 PolarHBondContact O-NH2 2.92Å
367	E	86.5	Confident	90	Very high	106 Å²	106	57.5 Å²	57.5	50%	0.495	29%	0.29	S	S	.	.			trans	-53.3	137.2	-176.2	-171.6	168	-148.8	0	0	113.2	M216 P365 R521 F525	M216-E367 WeakPolarHBondContact CE-OE2 3.46Å; M216-E367 WeakPolarHBondContact CG-OE2 3.34Å; P365-E367 VanDerWaalsContact C-N 3.29Å; E367-R521 PolarHBondContact O-NH2 2.99Å; E367-F525 WeakPolarHBondContact O-CZ 3.42Å
368	H	82.5	Confident	90.5	Very high	127 Å²	127	56.6 Å²	56.6	59%	0.588	28%	0.283	S	S	*	.			trans	-90.5	125.3	-179.4	-159.3	87.4	0	0	0	110.2
369	Q	85.9	Confident	90.8	Very high	28 Å²	28	59.5 Å²	59.5	13%	0.131	30%	0.299	C	S	.	.			trans	-105	141.4	166.9	-61.2	-174.2	-73.3	0	0	108.4	V374 F525	Q369-V374 HydrophobicContact CB-CG2 3.92Å; Q369-F525 HydrophobicContact CG-CE1 4.34Å; Q369-F525 HydrophobicContact CG-CZ 4.29Å
370	D	88.6	Confident	91.2	Very high	90 Å²	90	64.1 Å²	64.1	48%	0.481	33%	0.327	S	S	.	.			trans	-65.5	144.9	168.6	-175.7	-90.4	0	0	0	110.5	Q372 D373 V374	D370-Q372 WeakPolarHBondContact OD1-CA 3.47Å; D370-Q372 VanDerWaalsContact OD1-CB 3.27Å; D370-Q372 WeakPolarHBondContact OD1-CB 3.45Å; D370-Q372 PolarHBondContact OD1-N 2.91Å; D370-D373 HydrophobicContact CB-CB 4.17Å; D370-D373 PolarHBondContact OD1-N 3.32Å; D370-V374 WeakPolarHBondContact O-CG2 3.34Å; D370-V374 PolarHBondContact O-N 2.86Å
371	L	87.2	Confident	91.6	Very high	38 Å²	38	62.1 Å²	62.1	20%	0.199	32%	0.317	C	S	.	.	H	α-helix	trans	-78.7	-28.1	-174.4	-65	175	0	0	0	112.9	E375 F493 V496 R517 R521	L371-E375 WeakPolarHBondContact O-CB 3.35Å; L371-E375 PolarHBondContact O-N 3.42Å; L371-F493 HydrophobicContact CB-CE1 4.36Å; L371-F493 HydrophobicContact CD2-CE1 4.22Å; L371-V496 HydrophobicContact CD1-CG1 3.9Å; L371-R517 HydrophobicContact CD1-CG 4.18Å; L371-R521 HydrophobicContact CD2-CG 4.43Å
372	Q	90.8	Very high	91.9	Very high	91 Å²	91	67 Å²	67	43%	0.425	34%	0.338	S	S	.	.	H	α-helix	trans	-71.3	-43.8	174.2	-166.1	61.9	58.9	0	0	110.1	D370 V374 E375 D376	D370-Q372 WeakPolarHBondContact OD1-CA 3.47Å; D370-Q372 VanDerWaalsContact OD1-CB 3.27Å; D370-Q372 WeakPolarHBondContact OD1-CB 3.45Å; D370-Q372 PolarHBondContact OD1-N 2.91Å; Q372-V374 PolarHBondContact O-N 3.16Å; Q372-E375 PolarHBondContact NE2-OE2 3.02Å; Q372-E375 PolarHBondContact O-N 2.8Å; Q372-D376 PolarHBondContact NE2-OD1 3.43Å; Q372-D376 WeakPolarHBondContact O-CB 3.44Å; Q372-D376 PolarHBondContact O-N 2.86Å
373	D	92.2	Very high	92.2	Very high	89 Å²	89	69.3 Å²	69.3	48%	0.476	36%	0.36	S	S	.	.	H	α-helix	trans	-52.7	-39.8	172.6	-97.5	16.8	0	0	0	112.5	D370 R377	D370-D373 HydrophobicContact CB-CB 4.17Å; D370-D373 PolarHBondContact OD1-N 3.32Å; D373-R377 WeakPolarHBondContact O-CB 3.38Å; D373-R377 VanDerWaalsContact O-CD 3.22Å; D373-R377 WeakPolarHBondContact O-CD 3.31Å; D373-R377 WeakPolarHBondContact O-CG 3.33Å; D373-R377 PolarHBondContact O-N 3.46Å; D373-R377 PolarHBondContact O-NE 3.47Å
374	V	92.7	Very high	92.5	Very high	5 Å²	5	67 Å²	67	3%	0.03	35%	0.348	C	S	.	.	H	α-helix	trans	-78.1	-35.8	178	-177.1	0	0	0	0	111.6	Q369 D370 Q372 R377 V378 F493 Q528	Q369-V374 HydrophobicContact CB-CG2 3.92Å; D370-V374 WeakPolarHBondContact O-CG2 3.34Å; D370-V374 PolarHBondContact O-N 2.86Å; Q372-V374 PolarHBondContact O-N 3.16Å; V374-R377 PolarHBondContact O-N 3.29Å; V374-V378 WeakPolarHBondContact O-CB 3.42Å; V374-V378 VanDerWaalsContact O-CG2 3.26Å; V374-V378 WeakPolarHBondContact O-CG2 3.33Å; V374-V378 PolarHBondContact O-N 2.92Å; V374-F493 HydrophobicContact CB-CZ 4.06Å; V374-F493 HydrophobicContact CG1-CZ 3.89Å; V374-Q528 HydrophobicContact CG1-CG 4.36Å
375	E	92.6	Very high	92.7	Very high	25 Å²	25	65 Å²	65	12%	0.117	34%	0.339	C	S	.	.	H	α-helix	trans	-65.3	-43.2	175.8	-167.8	173.6	-148.6	0	0	112	L371 Q372 R377 V378 D379 F493 K497	L371-E375 WeakPolarHBondContact O-CB 3.35Å; L371-E375 PolarHBondContact O-N 3.42Å; Q372-E375 PolarHBondContact NE2-OE2 3.02Å; Q372-E375 PolarHBondContact O-N 2.8Å; E375-R377 PolarHBondContact O-N 3.02Å; E375-V378 PolarHBondContact O-N 3.22Å; E375-V378 VanDerWaalsContact O-N 3.16Å; E375-D379 PolarHBondContact O-N 3.25Å; E375-F493 HydrophobicContact CB-CD2 4.09Å; E375-F493 HydrophobicContact CB-CE1 4.48Å; E375-F493 HydrophobicContact CB-CE2 3.69Å; E375-F493 HydrophobicContact CB-CZ 3.9Å; E375-F493 HydrophobicContact CG-CD2 3.88Å; E375-F493 HydrophobicContact CG-CE2 3.91Å; E375-K497 IonicContact OE1-NZ 3.57Å; E375-K497 PolarHBondContact OE1-NZ 3.5Å; E375-K497 IonicContact OE2-NZ 3.57Å; E375-K497 PolarHBondContact OE2-NZ 3.39Å
376	D	95.2	Very high	93	Very high	85 Å²	85	70.9 Å²	70.9	46%	0.455	36%	0.363	S	S	.	.	H	α-helix	trans	-65.7	-37.9	177.7	-70.6	6.8	0	0	0	111.5	Q372 T380	Q372-D376 PolarHBondContact NE2-OD1 3.43Å; Q372-D376 WeakPolarHBondContact O-CB 3.44Å; Q372-D376 PolarHBondContact O-N 2.86Å; D376-T380 VanDerWaalsContact O-CB 3.31Å; D376-T380 WeakPolarHBondContact O-CB 3.28Å; D376-T380 PolarHBondContact O-N 3.4Å; D376-T380 PolarHBondContact O-OG1 3.32Å
377	R	94.4	Very high	93.5	Very high	111 Å²	111	69.9 Å²	69.9	42%	0.419	35%	0.346	S	S	.	.	H	α-helix	trans	-63.6	-41.3	171.1	-74.3	166.6	-166.5	-141.9	1.8	111.9	D373 V374 E375 T380 F381	D373-R377 WeakPolarHBondContact O-CB 3.38Å; D373-R377 VanDerWaalsContact O-CD 3.22Å; D373-R377 WeakPolarHBondContact O-CD 3.31Å; D373-R377 WeakPolarHBondContact O-CG 3.33Å; D373-R377 PolarHBondContact O-N 3.46Å; D373-R377 PolarHBondContact O-NE 3.47Å; V374-R377 PolarHBondContact O-N 3.29Å; E375-R377 PolarHBondContact O-N 3.02Å; R377-T380 PolarHBondContact O-N 3.02Å; R377-F381 WeakPolarHBondContact O-CB 3.4Å; R377-F381 PolarHBondContact O-N 3.03Å
378	V	95.4	Very high	94	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.006	33%	0.327	C	S	.	.	H	α-helix	trans	-68	-39.9	178.9	166.8	0	0	0	0	111.4	V374 E375 F381 K382 I486 Q489 L527 M531	V374-V378 WeakPolarHBondContact O-CB 3.42Å; V374-V378 VanDerWaalsContact O-CG2 3.26Å; V374-V378 WeakPolarHBondContact O-CG2 3.33Å; V374-V378 PolarHBondContact O-N 2.92Å; E375-V378 PolarHBondContact O-N 3.22Å; E375-V378 VanDerWaalsContact O-N 3.16Å; V378-F381 PolarHBondContact O-N 3.3Å; V378-K382 WeakPolarHBondContact O-CB 3.45Å; V378-K382 PolarHBondContact O-N 3.17Å; V378-I486 HydrophobicContact CG1-CG2 3.83Å; V378-Q489 HydrophobicContact CG2-CG 4.39Å; V378-L527 HydrophobicContact CG1-CD2 4.23Å; V378-L527 HydrophobicContact CG2-CD2 3.84Å; V378-L527 HydrophobicContact CG2-CG 4.48Å; V378-M531 HydrophobicContact CG2-SD 4.41Å
379	D	96.2	Very high	94.8	Very high	61 Å²	61	62.4 Å²	62.4	33%	0.326	31%	0.313	S	S	.	.	H	α-helix	trans	-72.9	-34.4	174.1	-90.2	-32.6	0	0	0	113.1	E375 F381 K382 A383 K490	E375-D379 PolarHBondContact O-N 3.25Å; D379-F381 VanDerWaalsContact C-N 3.32Å; D379-F381 PolarHBondContact O-N 2.84Å; D379-K382 WeakPolarHBondContact O-CB 3.36Å; D379-K382 PolarHBondContact O-N 2.88Å; D379-K382 WeakPolarHBondContact OD1-CD 3.09Å; D379-A383 PolarHBondContact O-N 2.98Å; D379-K490 VanDerWaalsContact CG-CE 3.44Å; D379-K490 WeakPolarHBondContact OD1-CE 3.23Å; D379-K490 IonicContact OD1-NZ 2.75Å; D379-K490 PolarHBondContact OD1-NZ 2.97Å; D379-K490 WeakPolarHBondContact OD2-CE 3.45Å; D379-K490 IonicContact OD2-NZ 3.54Å; D379-K490 PolarHBondContact OD2-NZ 3.4Å
380	T	97.8	Very high	95.4	Very high	100 Å²	100	64.6 Å²	64.6	61%	0.613	33%	0.326	S	S	*	.	H	α-helix	trans	-58.4	-46.3	169.2	-60.6	0	0	0	0	110.7	D376 R377 A383 F384	D376-T380 VanDerWaalsContact O-CB 3.31Å; D376-T380 WeakPolarHBondContact O-CB 3.28Å; D376-T380 PolarHBondContact O-N 3.4Å; D376-T380 PolarHBondContact O-OG1 3.32Å; R377-T380 PolarHBondContact O-N 3.02Å; T380-A383 PolarHBondContact O-N 2.88Å; T380-F384 WeakPolarHBondContact O-CB 3.43Å; T380-F384 PolarHBondContact O-N 3.32Å
381	F	97.6	Very high	95.8	Very high	6 Å²	6	62.5 Å²	62.5	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-66.5	-37	176.3	-177.2	-91.1	0	0	0	112.6	R377 V378 D379 A383 F384 S385 F482 I486 M531 F534 H535	R377-F381 WeakPolarHBondContact O-CB 3.4Å; R377-F381 PolarHBondContact O-N 3.03Å; V378-F381 PolarHBondContact O-N 3.3Å; D379-F381 VanDerWaalsContact C-N 3.32Å; D379-F381 PolarHBondContact O-N 2.84Å; F381-A383 PolarHBondContact O-N 3.46Å; F381-F384 AromaticContact CD2-CD1 3.96Å; F381-F384 HydrophobicContact CD2-CD1 3.96Å; F381-F384 HydrophobicContact CD2-CE1 4.48Å; F381-F384 AromaticContact CE2-CD1 3.99Å; F381-F384 HydrophobicContact CE2-CD1 3.99Å; F381-F384 HydrophobicContact CE2-CE1 4.08Å; F381-F384 PolarHBondContact O-N 2.86Å; F381-S385 WeakPolarHBondContact O-CB 3.38Å; F381-S385 PolarHBondContact O-N 3.02Å; F381-S385 PolarHBondContact O-OG 3.43Å; F381-F482 HydrophobicContact CE1-CB 4.31Å; F381-F482 AromaticContact CE1-CD1 3.6Å; F381-F482 HydrophobicContact CE1-CD1 3.6Å; F381-F482 HydrophobicContact CE1-CD2 4.2Å; F381-F482 AromaticContact CE1-CE1 3.88Å; F381-F482 HydrophobicContact CE1-CE1 3.88Å; F381-F482 HydrophobicContact CE1-CE2 4.44Å; F381-F482 AromaticContact CE1-CG 3.78Å; F381-F482 HydrophobicContact CE1-CG 3.78Å; F381-F482 HydrophobicContact CE1-CZ 4.3Å; F381-F482 HydrophobicContact CZ-CD1 4.09Å; F381-F482 HydrophobicContact CZ-CD2 4.22Å; F381-F482 AromaticContact CZ-CE1 3.93Å; F381-F482 HydrophobicContact CZ-CE1 3.93Å; F381-F482 HydrophobicContact CZ-CE2 4.08Å; F381-F482 HydrophobicContact CZ-CG 4.24Å; F381-F482 AromaticContact CZ-CZ 3.93Å; F381-F482 HydrophobicContact CZ-CZ 3.93Å; F381-I486 HydrophobicContact CD1-CD1 3.96Å; F381-I486 HydrophobicContact CE1-CD1 4.3Å; F381-M531 HydrophobicContact CB-CE 3.52Å; F381-M531 HydrophobicContact CB-SD 3.93Å; F381-M531 HydrophobicContact CD1-CG 3.8Å; F381-M531 HydrophobicContact CD1-SD 3.98Å; F381-M531 HydrophobicContact CD2-CB 4.07Å; F381-M531 HydrophobicContact CD2-CE 3.92Å; F381-M531 HydrophobicContact CD2-CG 3.75Å; F381-M531 HydrophobicContact CD2-SD 4.25Å; F381-M531 HydrophobicContact CE1-CG 3.86Å; F381-M531 HydrophobicContact CE2-CB 4Å; F381-M531 HydrophobicContact CE2-CG 3.79Å; F381-M531 HydrophobicContact CG-CE 3.74Å; F381-M531 HydrophobicContact CG-CG 3.75Å; F381-M531 HydrophobicContact CG-SD 3.78Å; F381-M531 HydrophobicContact CZ-CB 4.42Å; F381-M531 HydrophobicContact CZ-CG 3.86Å; F381-F534 HydrophobicContact CE2-CD1 4.21Å; F381-F534 HydrophobicContact CZ-CD1 4.2Å; F381-H535 AromaticContact CD2-CE1 3.82Å; F381-H535 AromaticContact CD2-NE2 3.55Å; F381-H535 AromaticContact CE2-CE1 3.61Å; F381-H535 AromaticContact CE2-NE2 3.65Å
382	K	97.3	Very high	96.4	Very high	103 Å²	103	61 Å²	61	45%	0.448	31%	0.311	S	S	.	.	H	α-helix	trans	-61.4	-41.3	174.7	-173.3	-170	174.2	-170.5	0	112.5	V378 D379 S385 K386 I486	V378-K382 WeakPolarHBondContact O-CB 3.45Å; V378-K382 PolarHBondContact O-N 3.17Å; D379-K382 WeakPolarHBondContact O-CB 3.36Å; D379-K382 PolarHBondContact O-N 2.88Å; D379-K382 WeakPolarHBondContact OD1-CD 3.09Å; K382-S385 PolarHBondContact O-OG 3Å; K382-K386 PolarHBondContact O-N 2.92Å; K382-I486 HydrophobicContact CB-CD1 4Å; K382-I486 HydrophobicContact CB-CG2 4.32Å; K382-I486 HydrophobicContact CD-CG2 4.14Å; K382-I486 HydrophobicContact CG-CD1 4.25Å; K382-I486 HydrophobicContact CG-CG2 4.25Å
383	A	98.1	Very high	96.7	Very high	66 Å²	66	60.8 Å²	60.8	55%	0.545	31%	0.312	S	S	.	.	H	α-helix	trans	-67.1	-43.4	174.9	0	0	0	0	0	111.2	D379 T380 F381 K387	D379-A383 PolarHBondContact O-N 2.98Å; T380-A383 PolarHBondContact O-N 2.88Å; F381-A383 PolarHBondContact O-N 3.46Å; A383-K387 WeakPolarHBondContact O-CB 3.39Å; A383-K387 PolarHBondContact O-N 2.65Å; A383-K387 VanDerWaalsContact O-N 3.16Å
384	F	98.4	Very high	97	Very high	62 Å²	62	62.6 Å²	62.6	27%	0.272	32%	0.318	S	S	.	.	H	α-helix	trans	-61	-48.5	175	159.2	-94.7	0	0	0	112.7	T380 F381 K387 M388 F534 H535	T380-F384 WeakPolarHBondContact O-CB 3.43Å; T380-F384 PolarHBondContact O-N 3.32Å; F381-F384 AromaticContact CD2-CD1 3.96Å; F381-F384 HydrophobicContact CD2-CD1 3.96Å; F381-F384 HydrophobicContact CD2-CE1 4.48Å; F381-F384 AromaticContact CE2-CD1 3.99Å; F381-F384 HydrophobicContact CE2-CD1 3.99Å; F381-F384 HydrophobicContact CE2-CE1 4.08Å; F381-F384 PolarHBondContact O-N 2.86Å; F384-K387 PolarHBondContact O-N 3.3Å; F384-M388 HydrophobicContact CE1-SD 4.16Å; F384-M388 HydrophobicContact CE2-CB 4.26Å; F384-M388 HydrophobicContact CE2-SD 4.32Å; F384-M388 HydrophobicContact CZ-CB 4.09Å; F384-M388 HydrophobicContact CZ-CG 4.33Å; F384-M388 HydrophobicContact CZ-SD 3.52Å; F384-M388 VanDerWaalsContact CZ-SD 3.52Å; F384-M388 WeakPolarHBondContact O-CB 3.21Å; F384-M388 PolarHBondContact O-N 3.28Å; F384-F534 AromaticContact CE1-CE1 3.99Å; F384-F534 HydrophobicContact CE1-CE1 3.99Å; F384-F534 HydrophobicContact CZ-CE1 4.36Å; F384-H535 AromaticContact CD1-CE1 3.84Å; F384-H535 AromaticContact CE1-CE1 3.49Å; F384-H535 VanDerWaalsContact CE1-CE1 3.49Å; F384-H535 WeakPolarHBondContact CE1-CE1 3.31Å; F384-H535 AromaticContact CZ-CE1 3.96Å
385	S	97.9	Very high	97.2	Very high	9 Å²	9	65.6 Å²	65.6	6%	0.063	33%	0.333	C	S	.	.	H	α-helix	trans	-66.7	-42.7	-173.3	63.1	0	0	0	0	111.4	F381 K382 K387 M388 D389	F381-S385 WeakPolarHBondContact O-CB 3.38Å; F381-S385 PolarHBondContact O-N 3.02Å; F381-S385 PolarHBondContact O-OG 3.43Å; K382-S385 PolarHBondContact O-OG 3Å; S385-K387 PolarHBondContact O-N 3.41Å; S385-M388 PolarHBondContact O-N 3.36Å; S385-D389 PolarHBondContact O-N 3Å
386	K	97.6	Very high	97.5	Very high	143 Å²	143	65.2 Å²	65.2	62%	0.622	33%	0.334	S	S	*	.	H	α-helix	trans	-56.7	-50.3	170.2	-177.5	179.3	177.4	-178.4	0	111.4	K382 M388 D389 D390	K382-K386 PolarHBondContact O-N 2.92Å; K386-M388 VanDerWaalsContact C-N 3.27Å; K386-M388 PolarHBondContact O-N 2.92Å; K386-D389 PolarHBondContact O-N 2.75Å; K386-D389 VanDerWaalsContact O-N 3.14Å; K386-D390 PolarHBondContact O-N 2.99Å
387	K	98.4	Very high	97.6	Very high	121 Å²	121	64.7 Å²	64.7	53%	0.526	33%	0.333	S	S	.	.	H	α-helix	trans	-67.5	-29.3	-177.8	-176.4	54.3	-172.4	158.5	0	112.6	A383 F384 S385 S391	A383-K387 WeakPolarHBondContact O-CB 3.39Å; A383-K387 PolarHBondContact O-N 2.65Å; A383-K387 VanDerWaalsContact O-N 3.16Å; F384-K387 PolarHBondContact O-N 3.3Å; S385-K387 PolarHBondContact O-N 3.41Å; K387-S391 WeakPolarHBondContact O-CB 3.46Å; K387-S391 PolarHBondContact O-N 2.81Å; K387-S391 PolarHBondContact O-OG 2.91Å
388	M	98.3	Very high	97.8	Very high	20 Å²	20	63.1 Å²	63.1	10%	0.099	34%	0.336	C	S	.	.	H	α-helix	trans	-67.1	-44.7	171.2	-173.4	176.9	168.9	0	0	110.9	F384 S385 K386 S391 V392 Y475 L479 F534 R538 F542	F384-M388 HydrophobicContact CE1-SD 4.16Å; F384-M388 HydrophobicContact CE2-CB 4.26Å; F384-M388 HydrophobicContact CE2-SD 4.32Å; F384-M388 HydrophobicContact CZ-CB 4.09Å; F384-M388 HydrophobicContact CZ-CG 4.33Å; F384-M388 HydrophobicContact CZ-SD 3.52Å; F384-M388 VanDerWaalsContact CZ-SD 3.52Å; F384-M388 WeakPolarHBondContact O-CB 3.21Å; F384-M388 PolarHBondContact O-N 3.28Å; S385-M388 PolarHBondContact O-N 3.36Å; K386-M388 VanDerWaalsContact C-N 3.27Å; K386-M388 PolarHBondContact O-N 2.92Å; M388-S391 CarbonylContact O-C 3.6Å; M388-S391 PolarHBondContact O-N 3.01Å; M388-S391 VanDerWaalsContact O-N 3.13Å; M388-V392 HydrophobicContact CE-CG2 4.14Å; M388-V392 HydrophobicContact CG-CG2 4.06Å; M388-V392 WeakPolarHBondContact O-CB 3.5Å; M388-V392 VanDerWaalsContact O-CG2 3.31Å; M388-V392 WeakPolarHBondContact O-CG2 3.5Å; M388-V392 PolarHBondContact O-N 2.99Å; M388-Y475 HydrophobicContact CE-CD1 3.61Å; M388-Y475 HydrophobicContact CE-CE1 4.26Å; M388-Y475 HydrophobicContact CE-CG 4.15Å; M388-L479 HydrophobicContact CB-CD1 4.24Å; M388-L479 HydrophobicContact CB-CD2 4.31Å; M388-L479 HydrophobicContact CE-CD1 4.28Å; M388-L479 HydrophobicContact CG-CD1 3.84Å; M388-L479 HydrophobicContact CG-CD2 4.43Å; M388-L479 HydrophobicContact SD-CD1 4.17Å; M388-L479 HydrophobicContact SD-CD2 4.19Å; M388-F534 HydrophobicContact CE-CZ 4.1Å; M388-F534 HydrophobicContact SD-CE1 3.93Å; M388-F534 HydrophobicContact SD-CZ 3.83Å; M388-R538 HydrophobicContact CE-CG 4.1Å; M388-F542 HydrophobicContact CE-CE2 3.68Å; M388-F542 HydrophobicContact CE-CZ 3.73Å
389	D	97.9	Very high	97.9	Very high	56 Å²	56	63.3 Å²	63.3	30%	0.299	34%	0.337	S	S	.	.	H	α-helix	trans	-61.5	-48.8	179.2	-169.4	51.3	0	0	0	112	S385 K386 S391 V392 L393 L479	S385-D389 PolarHBondContact O-N 3Å; K386-D389 PolarHBondContact O-N 2.75Å; K386-D389 VanDerWaalsContact O-N 3.14Å; D389-S391 PolarHBondContact O-N 2.86Å; D389-S391 VanDerWaalsContact O-N 3.15Å; D389-V392 PolarHBondContact O-N 2.96Å; D389-L393 WeakPolarHBondContact O-CB 3.46Å; D389-L393 PolarHBondContact O-N 3.07Å; D389-L479 HydrophobicContact CB-CB 4.27Å; D389-L479 HydrophobicContact CB-CD1 4.08Å
390	D	98.1	Very high	97.9	Very high	74 Å²	74	63 Å²	63	40%	0.396	34%	0.34	S	S	.	.	H	α-helix	trans	-49.5	-43	172.1	-65	-35.1	0	0	0	111.5	K386 Q394	K386-D390 PolarHBondContact O-N 2.99Å; D390-Q394 WeakPolarHBondContact O-CB 3.41Å; D390-Q394 PolarHBondContact O-N 3.29Å; D390-Q394 VanDerWaalsContact O-N 3.07Å
391	S	98.4	Very high	97.9	Very high	46 Å²	46	62.5 Å²	62.5	32%	0.322	33%	0.331	S	S	.	.	H	α-helix	trans	-81.2	-33.8	-173.8	-52	0	0	0	0	112.9	K387 M388 D389 L395	K387-S391 WeakPolarHBondContact O-CB 3.46Å; K387-S391 PolarHBondContact O-N 2.81Å; K387-S391 PolarHBondContact O-OG 2.91Å; M388-S391 CarbonylContact O-C 3.6Å; M388-S391 PolarHBondContact O-N 3.01Å; M388-S391 VanDerWaalsContact O-N 3.13Å; D389-S391 PolarHBondContact O-N 2.86Å; D389-S391 VanDerWaalsContact O-N 3.15Å; S391-L395 PolarHBondContact O-N 2.8Å
392	V	98.3	Very high	97.9	Very high	6 Å²	6	64.6 Å²	64.6	4%	0.036	34%	0.342	C	S	.	.	H	α-helix	trans	-69	-42.1	173.3	168.4	0	0	0	0	109.9	M388 D389 L395 S396 L472 Q476 L479 F542	M388-V392 HydrophobicContact CE-CG2 4.14Å; M388-V392 HydrophobicContact CG-CG2 4.06Å; M388-V392 WeakPolarHBondContact O-CB 3.5Å; M388-V392 VanDerWaalsContact O-CG2 3.31Å; M388-V392 WeakPolarHBondContact O-CG2 3.5Å; M388-V392 PolarHBondContact O-N 2.99Å; D389-V392 PolarHBondContact O-N 2.96Å; V392-L395 PolarHBondContact O-N 3.4Å; V392-S396 WeakPolarHBondContact O-CB 3.45Å; V392-S396 PolarHBondContact O-N 3.21Å; V392-L472 HydrophobicContact CG1-CB 4.1Å; V392-L472 HydrophobicContact CG1-CD2 3.95Å; V392-L472 HydrophobicContact CG2-CD2 4.41Å; V392-Q476 HydrophobicContact CG1-CG 3.52Å; V392-L479 HydrophobicContact CG2-CD1 4.39Å; V392-F542 HydrophobicContact CG2-CZ 4.16Å
393	L	97.3	Very high	97.9	Very high	88 Å²	88	60.8 Å²	60.8	46%	0.461	33%	0.327	S	S	.	.	H	α-helix	trans	-61.3	-43.8	173.4	178.6	61.5	0	0	0	111.7	D389 S396 T397	D389-L393 WeakPolarHBondContact O-CB 3.46Å; D389-L393 PolarHBondContact O-N 3.07Å; L393-S396 PolarHBondContact O-N 3.42Å; L393-T397 WeakPolarHBondContact O-CB 3.16Å; L393-T397 PolarHBondContact O-N 2.83Å; L393-T397 PolarHBondContact O-OG1 3.4Å
394	Q	98.3	Very high	97.8	Very high	127 Å²	127	67 Å²	67	59%	0.593	34%	0.337	S	S	*	.	H	α-helix	trans	-59.4	-49.4	174.8	-174.9	-178.3	1.5	0	0	111.6	D390 T397 V398	D390-Q394 WeakPolarHBondContact O-CB 3.41Å; D390-Q394 PolarHBondContact O-N 3.29Å; D390-Q394 VanDerWaalsContact O-N 3.07Å; Q394-T397 WeakPolarHBondContact O-CB 3.11Å; Q394-T397 PolarHBondContact O-N 3.23Å; Q394-V398 WeakPolarHBondContact O-CG2 3.22Å; Q394-V398 PolarHBondContact O-N 2.89Å
395	L	98.3	Very high	97.7	Very high	67 Å²	67	68.8 Å²	68.8	35%	0.351	34%	0.344	S	S	.	.	H	α-helix	trans	-66.1	-39.9	-179.9	-177.8	59	0	0	0	112.2	S391 V392 T397 V398 A399 L472	S391-L395 PolarHBondContact O-N 2.8Å; V392-L395 PolarHBondContact O-N 3.4Å; L395-T397 VanDerWaalsContact C-N 3.31Å; L395-T397 PolarHBondContact O-N 3.47Å; L395-V398 PolarHBondContact O-N 2.71Å; L395-A399 VanDerWaalsContact O-CB 3.3Å; L395-A399 WeakPolarHBondContact O-CB 3.48Å; L395-A399 PolarHBondContact O-N 3.4Å; L395-L472 HydrophobicContact CB-CD1 4.3Å; L395-L472 HydrophobicContact CD2-CD1 4.06Å; L395-L472 HydrophobicContact CD2-CD2 3.97Å; L395-L472 HydrophobicContact CG-CD1 3.83Å; L395-L472 HydrophobicContact CG-CD2 4.49Å
396	S	97.9	Very high	97.6	Very high	18 Å²	18	68.6 Å²	68.6	13%	0.126	34%	0.342	C	S	.	.	H	α-helix	trans	-61.1	-39.5	175.2	-171.7	0	0	0	0	111.7	V392 L393 S400 L469	V392-S396 WeakPolarHBondContact O-CB 3.45Å; V392-S396 PolarHBondContact O-N 3.21Å; L393-S396 PolarHBondContact O-N 3.42Å; S396-S400 VanDerWaalsContact O-CB 3.27Å; S396-S400 WeakPolarHBondContact O-CB 3.44Å; S396-S400 PolarHBondContact O-N 2.8Å; S396-S400 PolarHBondContact O-OG 2.9Å; S396-L469 WeakPolarHBondContact O-CD2 3.45Å
397	T	98.2	Very high	97.4	Very high	73 Å²	73	65.1 Å²	65.1	45%	0.448	33%	0.333	S	S	.	.	H	α-helix	trans	-64.1	-51.3	174.4	-56.3	0	0	0	0	111.4	L393 Q394 L395 A399 S400 E401	L393-T397 WeakPolarHBondContact O-CB 3.16Å; L393-T397 PolarHBondContact O-N 2.83Å; L393-T397 PolarHBondContact O-OG1 3.4Å; Q394-T397 WeakPolarHBondContact O-CB 3.11Å; Q394-T397 PolarHBondContact O-N 3.23Å; L395-T397 VanDerWaalsContact C-N 3.31Å; L395-T397 PolarHBondContact O-N 3.47Å; T397-A399 PolarHBondContact O-N 3.39Å; T397-S400 PolarHBondContact O-N 3.46Å; T397-E401 PolarHBondContact O-N 3.04Å
398	V	98.4	Very high	97.2	Very high	79 Å²	79	60.7 Å²	60.7	48%	0.479	32%	0.322	S	S	.	.	H	α-helix	trans	-63.4	-41.1	-179.6	173.3	0	0	0	0	111.8	Q394 L395 E401 L402	Q394-V398 WeakPolarHBondContact O-CG2 3.22Å; Q394-V398 PolarHBondContact O-N 2.89Å; L395-V398 PolarHBondContact O-N 2.71Å; V398-E401 PolarHBondContact O-N 3.46Å; V398-L402 WeakPolarHBondContact O-CB 3.43Å; V398-L402 PolarHBondContact O-N 3.24Å
399	A	97.9	Very high	96.9	Very high	4 Å²	4	61.2 Å²	61.2	3%	0.033	33%	0.333	C	S	.	.	H	α-helix	trans	-65	-39.4	175.2	0	0	0	0	0	111.8	L395 T397 L402 V403 L465 M468 L469	L395-A399 VanDerWaalsContact O-CB 3.3Å; L395-A399 WeakPolarHBondContact O-CB 3.48Å; L395-A399 PolarHBondContact O-N 3.4Å; T397-A399 PolarHBondContact O-N 3.39Å; A399-L402 PolarHBondContact O-N 3.01Å; A399-L402 VanDerWaalsContact O-N 3.15Å; A399-V403 WeakPolarHBondContact O-CG2 3.41Å; A399-V403 PolarHBondContact O-N 3.47Å; A399-L465 HydrophobicContact CB-CD2 4.28Å; A399-M468 HydrophobicContact CB-SD 4.31Å; A399-L469 HydrophobicContact CB-CD2 3.73Å; A399-L469 HydrophobicContact CB-CG 4.03Å
400	S	96.8	Very high	96.8	Very high	54 Å²	54	62.2 Å²	62.2	38%	0.378	33%	0.334	S	S	.	.	H	α-helix	trans	-66.8	-35.9	176.1	-62.2	0	0	0	0	113.1	S396 T397 R404 L469	S396-S400 VanDerWaalsContact O-CB 3.27Å; S396-S400 WeakPolarHBondContact O-CB 3.44Å; S396-S400 PolarHBondContact O-N 2.8Å; S396-S400 PolarHBondContact O-OG 2.9Å; T397-S400 PolarHBondContact O-N 3.46Å; S400-R404 PolarHBondContact O-N 3.21Å; S400-L469 WeakPolarHBondContact OG-CD2 3.2Å
401	E	97.2	Very high	96.7	Very high	91 Å²	91	62.9 Å²	62.9	43%	0.425	33%	0.331	S	S	.	.	H	α-helix	trans	-64.5	-42.4	167.8	-77.8	-171.2	-151.9	0	0	112.1	T397 V398 V403 R404 K405	T397-E401 PolarHBondContact O-N 3.04Å; V398-E401 PolarHBondContact O-N 3.46Å; E401-V403 VanDerWaalsContact C-N 3.34Å; E401-V403 PolarHBondContact O-N 2.99Å; E401-R404 WeakPolarHBondContact O-CB 3.44Å; E401-R404 PolarHBondContact O-N 3.27Å; E401-R404 VanDerWaalsContact O-N 3.09Å; E401-K405 WeakPolarHBondContact O-CG 3.27Å; E401-K405 PolarHBondContact O-N 2.93Å; E401-K405 IonicContact OE2-NZ 3.85Å; E401-K405 PolarHBondContact OE2-NZ 3.07Å
402	L	97	Very high	96.6	Very high	49 Å²	49	66.8 Å²	66.8	26%	0.257	34%	0.343	S	S	.	.	H	α-helix	trans	-66.2	-37.4	-176.9	-171.2	57.2	0	0	0	111.5	V398 A399 R404 K405 H406 F410 L465	V398-L402 WeakPolarHBondContact O-CB 3.43Å; V398-L402 PolarHBondContact O-N 3.24Å; A399-L402 PolarHBondContact O-N 3.01Å; A399-L402 VanDerWaalsContact O-N 3.15Å; L402-R404 VanDerWaalsContact C-N 3.35Å; L402-R404 PolarHBondContact O-N 3.34Å; L402-K405 PolarHBondContact O-N 3.04Å; L402-H406 PolarHBondContact O-N 3.42Å; L402-H406 PolarHBondContact O-ND1 2.78Å; L402-F410 HydrophobicContact CD1-CE2 4.23Å; L402-L465 HydrophobicContact CB-CD1 4.23Å; L402-L465 HydrophobicContact CD2-CD1 4.17Å; L402-L465 HydrophobicContact CD2-CD2 4.1Å; L402-L465 HydrophobicContact CG-CD1 3.93Å
403	V	96.8	Very high	96.5	Very high	24 Å²	24	71.5 Å²	71.5	15%	0.145	36%	0.364	C	S	.	.	H	α-helix	trans	-53	-51	166.9	168.6	0	0	0	0	110.8	A399 E401 K405 H406 V407 P461 L465 F466 L469	A399-V403 WeakPolarHBondContact O-CG2 3.41Å; A399-V403 PolarHBondContact O-N 3.47Å; E401-V403 VanDerWaalsContact C-N 3.34Å; E401-V403 PolarHBondContact O-N 2.99Å; V403-K405 VanDerWaalsContact C-N 3.33Å; V403-K405 PolarHBondContact O-N 3.49Å; V403-H406 WeakPolarHBondContact O-CB 3.47Å; V403-H406 PolarHBondContact O-N 3.2Å; V403-V407 WeakPolarHBondContact O-CG2 3.45Å; V403-V407 PolarHBondContact O-N 3.01Å; V403-P461 HydrophobicContact CG1-CB 4.48Å; V403-P461 HydrophobicContact CG2-CB 4.17Å; V403-L465 HydrophobicContact CG2-CB 3.84Å; V403-L465 HydrophobicContact CG2-CD1 4.07Å; V403-F466 HydrophobicContact CG1-CE1 3.8Å; V403-F466 HydrophobicContact CG2-CD1 4.18Å; V403-F466 HydrophobicContact CG2-CE1 4Å; V403-L469 HydrophobicContact CG2-CD1 3.86Å
404	R	95.9	Very high	96.6	Very high	196 Å²	196	69.9 Å²	69.9	74%	0.74	35%	0.353	S	S	*	.	H	α-helix	trans	-64.1	-38.1	-178.5	-162.3	-173.8	-56.9	-161.4	3	112	S400 E401 L402 G408	S400-R404 PolarHBondContact O-N 3.21Å; E401-R404 WeakPolarHBondContact O-CB 3.44Å; E401-R404 PolarHBondContact O-N 3.27Å; E401-R404 VanDerWaalsContact O-N 3.09Å; L402-R404 VanDerWaalsContact C-N 3.35Å; L402-R404 PolarHBondContact O-N 3.34Å; R404-G408 PolarHBondContact O-N 3.16Å
405	K	96.6	Very high	96.4	Very high	100 Å²	100	66.4 Å²	66.4	44%	0.435	34%	0.337	S	S	.	.	I	π-helix	trans	-66.1	-38.3	175.3	-73.3	161	176.3	161.8	0	111.7	E401 L402 V403 G409 F410	E401-K405 WeakPolarHBondContact O-CG 3.27Å; E401-K405 PolarHBondContact O-N 2.93Å; E401-K405 IonicContact OE2-NZ 3.85Å; E401-K405 PolarHBondContact OE2-NZ 3.07Å; L402-K405 PolarHBondContact O-N 3.04Å; V403-K405 VanDerWaalsContact C-N 3.33Å; V403-K405 PolarHBondContact O-N 3.49Å; K405-G409 CarbonylContact O-C 3.52Å; K405-G409 VanDerWaalsContact O-CA 3.3Å; K405-G409 WeakPolarHBondContact O-CA 3.26Å; K405-G409 PolarHBondContact O-N 2.85Å; K405-F410 HydrophobicContact CB-CE2 4.26Å; K405-F410 HydrophobicContact CB-CZ 4.21Å; K405-F410 PolarHBondContact O-N 2.92Å
406	H	95.6	Very high	96.4	Very high	4 Å²	4	69.1 Å²	69.1	2%	0.019	35%	0.346	C	S	.	.	I	π-helix	trans	-65.2	-59	174.2	-83	77.1	0	0	0	112.9	L402 V403 G408 F410 F457 P461	L402-H406 PolarHBondContact O-N 3.42Å; L402-H406 PolarHBondContact O-ND1 2.78Å; V403-H406 WeakPolarHBondContact O-CB 3.47Å; V403-H406 PolarHBondContact O-N 3.2Å; H406-G408 VanDerWaalsContact C-N 3.33Å; H406-G408 PolarHBondContact O-N 3.01Å; H406-F410 HydrophobicContact CB-CD2 4.47Å; H406-F410 AromaticContact CE1-CE2 3.8Å; H406-F410 AromaticContact CG-CD2 3.96Å; H406-F410 AromaticContact ND1-CD2 3.95Å; H406-F410 AromaticContact ND1-CE2 3.75Å; H406-F457 WeakPolarHBondContact CB-O 3.46Å; H406-F457 AromaticContact CD2-CD1 3.75Å; H406-F457 PolarHBondContact CD2-O 2.95Å; H406-F457 VanDerWaalsContact CD2-O 3.32Å; H406-F457 AromaticContact NE2-CD1 3.98Å; H406-P461 HydrophobicContact CB-CG 3.43Å; H406-P461 VanDerWaalsContact CB-CG 3.43Å
407	V	93.4	Very high	96.4	Very high	70 Å²	70	71.9 Å²	71.9	42%	0.424	36%	0.359	S	S	.	.	I	π-helix	trans	-64.4	-36.3	-175.1	179	0	0	0	0	112.4	V403	V403-V407 WeakPolarHBondContact O-CG2 3.45Å; V403-V407 PolarHBondContact O-N 3.01Å
408	G	94.1	Very high	96.4	Very high	28 Å²	28	68.4 Å²	68.4	29%	0.289	34%	0.338	S	S	.	.	I	π-helix	trans	-104.9	-56.2	-174.8	0	0	0	0	0	115.1	R404 H406 K412	R404-G408 PolarHBondContact O-N 3.16Å; H406-G408 VanDerWaalsContact C-N 3.33Å; H406-G408 PolarHBondContact O-N 3.01Å; G408-K412 WeakPolarHBondContact O-CB 3.39Å; G408-K412 WeakPolarHBondContact O-CD 3.42Å; G408-K412 WeakPolarHBondContact O-CG 3.41Å
409	G	93.6	Very high	96.4	Very high	32 Å²	32	67.5 Å²	67.5	33%	0.33	34%	0.335	S	S	.	.	I	π-helix	trans	-75.8	-63.4	-169	0	0	0	0	0	113.2	K405 R411 K412 E413	K405-G409 CarbonylContact O-C 3.52Å; K405-G409 VanDerWaalsContact O-CA 3.3Å; K405-G409 WeakPolarHBondContact O-CA 3.26Å; K405-G409 PolarHBondContact O-N 2.85Å; G409-R411 PolarHBondContact O-N 2.79Å; G409-K412 PolarHBondContact O-N 3.17Å; G409-K412 VanDerWaalsContact O-N 3.12Å; G409-E413 PolarHBondContact O-N 3.19Å; G409-E413 VanDerWaalsContact O-N 3.12Å
410	F	94.1	Very high	96.4	Very high	76 Å²	76	69.7 Å²	69.7	33%	0.333	35%	0.353	S	S	.	.	I	π-helix	trans	-58.5	-47.2	-177.5	-58.7	-30	0	0	0	111	L402 K405 H406 K412 E413 F414 F457	L402-F410 HydrophobicContact CD1-CE2 4.23Å; K405-F410 HydrophobicContact CB-CE2 4.26Å; K405-F410 HydrophobicContact CB-CZ 4.21Å; K405-F410 PolarHBondContact O-N 2.92Å; H406-F410 HydrophobicContact CB-CD2 4.47Å; H406-F410 AromaticContact CE1-CE2 3.8Å; H406-F410 AromaticContact CG-CD2 3.96Å; H406-F410 AromaticContact ND1-CD2 3.95Å; H406-F410 AromaticContact ND1-CE2 3.75Å; F410-K412 VanDerWaalsContact C-N 3.29Å; F410-K412 PolarHBondContact O-N 2.77Å; F410-E413 PolarHBondContact O-N 3.36Å; F410-F414 HydrophobicContact CB-CD2 4.44Å; F410-F414 VanDerWaalsContact O-CD2 3.29Å; F410-F414 WeakPolarHBondContact O-CD2 3.41Å; F410-F414 PolarHBondContact O-N 2.58Å; F410-F457 HydrophobicContact CB-CB 4.11Å; F410-F457 HydrophobicContact CB-CD1 4.04Å; F410-F457 HydrophobicContact CB-CG 4.04Å; F410-F457 AromaticContact CD2-CD1 3.79Å; F410-F457 HydrophobicContact CD2-CD1 3.79Å; F410-F457 HydrophobicContact CD2-CE1 4.14Å; F410-F457 HydrophobicContact CG-CD1 4.27Å
411	R	96.3	Very high	96.5	Very high	89 Å²	89	69.8 Å²	69.8	34%	0.336	35%	0.347	S	S	.	.	H	α-helix	trans	-46.1	-50.9	173.1	-172.9	-173.8	-173.3	178.3	-0.1	112.5	G409 Q415 G454 E455 A458	G409-R411 PolarHBondContact O-N 2.79Å; R411-Q415 WeakPolarHBondContact O-CB 3.18Å; R411-Q415 WeakPolarHBondContact O-CG 3.4Å; R411-Q415 PolarHBondContact O-N 3.39Å; R411-G454 WeakPolarHBondContact CG-O 3.3Å; R411-E455 IonicContact CZ-OE1 2.8Å; R411-E455 VanDerWaalsContact CZ-OE1 3.24Å; R411-E455 IonicContact CZ-OE2 2.67Å; R411-E455 VanDerWaalsContact NE-CD 3.33Å; R411-E455 IonicContact NE-OE1 3.98Å; R411-E455 PolarHBondContact NE-OE1 2.99Å; R411-E455 IonicContact NE-OE2 3.56Å; R411-E455 PolarHBondContact NE-OE2 2.85Å; R411-E455 VanDerWaalsContact NE-OE2 3.12Å; R411-E455 IonicContact NH2-OE1 2.98Å; R411-E455 PolarHBondContact NH2-OE1 2.86Å; R411-E455 IonicContact NH2-OE2 2.67Å; R411-E455 PolarHBondContact NH2-OE2 3.01Å; R411-A458 HydrophobicContact CB-CB 4.21Å; R411-A458 HydrophobicContact CG-CB 4.14Å
412	K	96.8	Very high	96.5	Very high	128 Å²	128	68.2 Å²	68.2	56%	0.557	34%	0.34	S	S	*	.	H	α-helix	trans	-67.9	-40.4	-177.8	-75	176.8	-177.4	-174.3	0	113.5	G408 G409 F410 K416	G408-K412 WeakPolarHBondContact O-CB 3.39Å; G408-K412 WeakPolarHBondContact O-CD 3.42Å; G408-K412 WeakPolarHBondContact O-CG 3.41Å; G409-K412 PolarHBondContact O-N 3.17Å; G409-K412 VanDerWaalsContact O-N 3.12Å; F410-K412 VanDerWaalsContact C-N 3.29Å; F410-K412 PolarHBondContact O-N 2.77Å; K412-K416 WeakPolarHBondContact O-CB 3.17Å; K412-K416 WeakPolarHBondContact O-CD 3.29Å; K412-K416 VanDerWaalsContact O-CG 3.24Å; K412-K416 WeakPolarHBondContact O-CG 3.25Å; K412-K416 PolarHBondContact O-N 3.48Å
413	E	97.2	Very high	96.5	Very high	104 Å²	104	68.6 Å²	68.6	49%	0.486	35%	0.35	S	S	.	.	H	α-helix	trans	-70	-38.6	178.8	-56.9	-41.8	121.6	0	0	112.1	G409 F410 K416 L417	G409-E413 PolarHBondContact O-N 3.19Å; G409-E413 VanDerWaalsContact O-N 3.12Å; F410-E413 PolarHBondContact O-N 3.36Å; E413-K416 IonicContact OE1-NZ 3.58Å; E413-K416 PolarHBondContact OE1-NZ 3.1Å; E413-K416 VanDerWaalsContact OE2-CD 3.29Å; E413-K416 WeakPolarHBondContact OE2-CD 3.39Å; E413-K416 IonicContact OE2-NZ 2.71Å; E413-K416 PolarHBondContact OE2-NZ 3.26Å; E413-L417 PolarHBondContact O-N 3.34Å; E413-L417 VanDerWaalsContact O-N 3.15Å
414	F	97.6	Very high	96.5	Very high	54 Å²	54	71.1 Å²	71.1	24%	0.237	36%	0.362	C	S	.	.	H	α-helix	trans	-65.9	-42.2	173.1	-83.6	-75.9	0	0	0	112.3	F410 L417 G418 Y450 I453 F457	F410-F414 HydrophobicContact CB-CD2 4.44Å; F410-F414 VanDerWaalsContact O-CD2 3.29Å; F410-F414 WeakPolarHBondContact O-CD2 3.41Å; F410-F414 PolarHBondContact O-N 2.58Å; F414-L417 PolarHBondContact O-N 3.21Å; F414-G418 PolarHBondContact O-N 3.28Å; F414-Y450 AromaticContact CD1-CD1 3.77Å; F414-Y450 HydrophobicContact CD1-CD1 3.77Å; F414-Y450 HydrophobicContact CD1-CE1 4.26Å; F414-Y450 HydrophobicContact CE1-CD1 4.17Å; F414-Y450 HydrophobicContact CE1-CE1 4.19Å; F414-I453 HydrophobicContact CD1-CB 4.25Å; F414-I453 HydrophobicContact CD1-CG2 3.61Å; F414-I453 HydrophobicContact CE1-CG2 3.65Å; F414-I453 HydrophobicContact CG-CG2 4.09Å; F414-I453 HydrophobicContact CZ-CG2 4.16Å; F414-F457 AromaticContact CD2-CD2 3.68Å; F414-F457 HydrophobicContact CD2-CD2 3.68Å; F414-F457 AromaticContact CD2-CE2 3.87Å; F414-F457 HydrophobicContact CD2-CE2 3.87Å; F414-F457 HydrophobicContact CD2-CG 4.49Å; F414-F457 HydrophobicContact CE1-CE2 4.37Å; F414-F457 AromaticContact CE2-CD2 3.53Å; F414-F457 HydrophobicContact CE2-CD2 3.53Å; F414-F457 AromaticContact CE2-CE2 3.21Å; F414-F457 HydrophobicContact CE2-CE2 3.21Å; F414-F457 HydrophobicContact CE2-CG 4.42Å; F414-F457 AromaticContact CE2-CZ 3.88Å; F414-F457 HydrophobicContact CE2-CZ 3.88Å; F414-F457 HydrophobicContact CG-CD2 4.47Å; F414-F457 HydrophobicContact CZ-CD2 4.19Å; F414-F457 AromaticContact CZ-CE2 3.52Å; F414-F457 HydrophobicContact CZ-CE2 3.52Å; F414-F457 HydrophobicContact CZ-CZ 4.21Å
415	Q	96	Very high	96.5	Very high	55 Å²	55	62 Å²	62	26%	0.257	33%	0.328	S	S	.	.	H	α-helix	trans	-60.4	-49.8	172.9	-76.4	171.2	-17.2	0	0	112.4	R411 L417 G418 S419 E451 E455	R411-Q415 WeakPolarHBondContact O-CB 3.18Å; R411-Q415 WeakPolarHBondContact O-CG 3.4Å; R411-Q415 PolarHBondContact O-N 3.39Å; Q415-L417 VanDerWaalsContact C-N 3.31Å; Q415-L417 PolarHBondContact O-N 3.18Å; Q415-G418 WeakPolarHBondContact O-CA 3.17Å; Q415-G418 PolarHBondContact O-N 3.04Å; Q415-G418 VanDerWaalsContact O-N 3.09Å; Q415-S419 PolarHBondContact O-N 3.41Å; Q415-S419 PolarHBondContact O-OG 3.4Å; Q415-E451 HydrophobicContact CB-CG 4.46Å; Q415-E451 HydrophobicContact CG-CG 4.39Å; Q415-E455 PolarHBondContact NE2-OE1 2.94Å
416	K	97.8	Very high	96.5	Very high	124 Å²	124	62.7 Å²	62.7	54%	0.539	33%	0.332	S	S	.	.	H	α-helix	trans	-53.5	-46.9	177.4	-77.6	163.2	172	173.4	0	112.3	K412 E413 G418 S419 A420	K412-K416 WeakPolarHBondContact O-CB 3.17Å; K412-K416 WeakPolarHBondContact O-CD 3.29Å; K412-K416 VanDerWaalsContact O-CG 3.24Å; K412-K416 WeakPolarHBondContact O-CG 3.25Å; K412-K416 PolarHBondContact O-N 3.48Å; E413-K416 IonicContact OE1-NZ 3.58Å; E413-K416 PolarHBondContact OE1-NZ 3.1Å; E413-K416 VanDerWaalsContact OE2-CD 3.29Å; E413-K416 WeakPolarHBondContact OE2-CD 3.39Å; E413-K416 IonicContact OE2-NZ 2.71Å; E413-K416 PolarHBondContact OE2-NZ 3.26Å; K416-G418 VanDerWaalsContact C-N 3.35Å; K416-S419 PolarHBondContact O-N 3.41Å; K416-A420 WeakPolarHBondContact O-CB 3.27Å; K416-A420 PolarHBondContact O-N 3.19Å
417	L	97.9	Very high	96.5	Very high	75 Å²	75	66 Å²	66	39%	0.393	36%	0.356	S	S	.	.	H	α-helix	trans	-65.4	-40.3	179	179.2	52.9	0	0	0	111.1	E413 F414 Q415 A420 F421 Y450	E413-L417 PolarHBondContact O-N 3.34Å; E413-L417 VanDerWaalsContact O-N 3.15Å; F414-L417 PolarHBondContact O-N 3.21Å; Q415-L417 VanDerWaalsContact C-N 3.31Å; Q415-L417 PolarHBondContact O-N 3.18Å; L417-A420 PolarHBondContact O-N 3.18Å; L417-F421 HydrophobicContact CD1-CD2 4.22Å; L417-F421 HydrophobicContact CD1-CE2 3.61Å; L417-F421 HydrophobicContact CD1-CZ 3.97Å; L417-F421 HydrophobicContact CG-CD2 4.34Å; L417-F421 HydrophobicContact CG-CE2 3.78Å; L417-F421 WeakPolarHBondContact O-CD2 2.89Å; L417-F421 PolarHBondContact O-N 3.29Å; L417-Y450 HydrophobicContact CB-CD1 4.33Å; L417-Y450 HydrophobicContact CD2-CD1 3.5Å; L417-Y450 HydrophobicContact CD2-CE1 3.4Å; L417-Y450 VanDerWaalsContact CD2-CE1 3.4Å; L417-Y450 HydrophobicContact CD2-CG 4.46Å; L417-Y450 HydrophobicContact CG-CD1 3.79Å; L417-Y450 HydrophobicContact CG-CE1 4.12Å; L417-Y450 HydrophobicContact CG-CG 4.33Å
418	G	97.8	Very high	96.6	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-59.2	-52	173.5	0	0	0	0	0	113.2	F414 Q415 K416 A420 F421 Q422 G447	F414-G418 PolarHBondContact O-N 3.28Å; Q415-G418 WeakPolarHBondContact O-CA 3.17Å; Q415-G418 PolarHBondContact O-N 3.04Å; Q415-G418 VanDerWaalsContact O-N 3.09Å; K416-G418 VanDerWaalsContact C-N 3.35Å; G418-A420 VanDerWaalsContact C-N 3.28Å; G418-A420 PolarHBondContact O-N 3.38Å; G418-F421 PolarHBondContact O-N 2.85Å; G418-Q422 PolarHBondContact O-N 3.33Å; G418-Q422 VanDerWaalsContact O-N 3.14Å; G418-G447 WeakPolarHBondContact CA-O 3.48Å; G418-G447 WeakPolarHBondContact O-CA 3.31Å
419	S	97.9	Very high	96.6	Very high	60 Å²	60	70.7 Å²	70.7	42%	0.42	36%	0.364	S	S	.	.	H	α-helix	trans	-65.8	-29.7	179.7	-50.3	0	0	0	0	112.6	Q415 K416 Q422 A423 E451	Q415-S419 PolarHBondContact O-N 3.41Å; Q415-S419 PolarHBondContact O-OG 3.4Å; K416-S419 PolarHBondContact O-N 3.41Å; S419-Q422 PolarHBondContact O-N 3.01Å; S419-A423 PolarHBondContact O-N 2.95Å; S419-E451 WeakPolarHBondContact CA-OE1 3.46Å; S419-E451 PolarHBondContact N-OE1 3.26Å; S419-E451 VanDerWaalsContact N-OE1 3.15Å; S419-E451 PolarHBondContact OG-OE1 3.3Å
420	A	98.4	Very high	96.6	Very high	51 Å²	51	76 Å²	76	42%	0.421	38%	0.382	S	S	.	.	H	α-helix	trans	-64.7	-42	172.8	0	0	0	0	0	112.5	K416 L417 G418 Q422 A423 I424	K416-A420 WeakPolarHBondContact O-CB 3.27Å; K416-A420 PolarHBondContact O-N 3.19Å; L417-A420 PolarHBondContact O-N 3.18Å; G418-A420 VanDerWaalsContact C-N 3.28Å; G418-A420 PolarHBondContact O-N 3.38Å; A420-Q422 VanDerWaalsContact C-N 3.33Å; A420-Q422 PolarHBondContact O-N 3.23Å; A420-A423 PolarHBondContact O-N 2.93Å; A420-I424 WeakPolarHBondContact O-CG1 3.36Å; A420-I424 PolarHBondContact O-N 3.33Å; A420-I424 VanDerWaalsContact O-N 3.14Å
421	F	98.2	Very high	96.5	Very high	56 Å²	56	76.5 Å²	76.5	25%	0.246	39%	0.389	C	S	.	.	H	α-helix	trans	-62.5	-40.2	171.8	-70.5	-60.5	0	0	0	111.8	L417 G418 A423 I424 S425 I443 T446 Y450	L417-F421 HydrophobicContact CD1-CD2 4.22Å; L417-F421 HydrophobicContact CD1-CE2 3.61Å; L417-F421 HydrophobicContact CD1-CZ 3.97Å; L417-F421 HydrophobicContact CG-CD2 4.34Å; L417-F421 HydrophobicContact CG-CE2 3.78Å; L417-F421 WeakPolarHBondContact O-CD2 2.89Å; L417-F421 PolarHBondContact O-N 3.29Å; G418-F421 PolarHBondContact O-N 2.85Å; F421-A423 VanDerWaalsContact C-N 3.33Å; F421-A423 PolarHBondContact O-N 2.83Å; F421-I424 PolarHBondContact O-N 2.66Å; F421-S425 PolarHBondContact O-N 3.24Å; F421-I443 HydrophobicContact CB-CG2 4.25Å; F421-I443 VanDerWaalsContact O-CG2 3.3Å; F421-I443 WeakPolarHBondContact O-CG2 3.44Å; F421-T446 HydrophobicContact CD1-CG2 4.45Å; F421-T446 HydrophobicContact CD2-CG2 3.79Å; F421-T446 HydrophobicContact CE1-CG2 4.46Å; F421-T446 HydrophobicContact CE2-CG2 3.78Å; F421-T446 HydrophobicContact CG-CG2 4.14Å; F421-T446 HydrophobicContact CZ-CG2 4.14Å; F421-Y450 HydrophobicContact CD2-CD2 4.41Å; F421-Y450 HydrophobicContact CE2-CD2 4.03Å; F421-Y450 HydrophobicContact CE2-CE2 4.13Å; F421-Y450 HydrophobicContact CE2-CG 4.39Å
422	Q	97.1	Very high	96	Very high	58 Å²	58	76.7 Å²	76.7	27%	0.271	40%	0.401	S	S	.	.	H	α-helix	trans	-63.2	-38.4	176.5	-61.9	-174	42.2	0	0	112.2	G418 S419 A420 S425 H426 E451	G418-Q422 PolarHBondContact O-N 3.33Å; G418-Q422 VanDerWaalsContact O-N 3.14Å; S419-Q422 PolarHBondContact O-N 3.01Å; A420-Q422 VanDerWaalsContact C-N 3.33Å; A420-Q422 PolarHBondContact O-N 3.23Å; Q422-S425 PolarHBondContact O-N 3.17Å; Q422-H426 WeakPolarHBondContact O-CB 3.44Å; Q422-H426 PolarHBondContact O-N 3.23Å; Q422-E451 PolarHBondContact NE2-OE1 3.49Å; Q422-E451 PolarHBondContact NE2-OE2 2.94Å
423	A	97.9	Very high	95.6	Very high	57 Å²	57	75.7 Å²	75.7	47%	0.471	41%	0.408	S	S	.	.	H	α-helix	trans	-64.5	-38.8	175.2	0	0	0	0	0	112.7	S419 A420 F421 H426 S427	S419-A423 PolarHBondContact O-N 2.95Å; A420-A423 PolarHBondContact O-N 2.93Å; F421-A423 VanDerWaalsContact C-N 3.33Å; F421-A423 PolarHBondContact O-N 2.83Å; A423-H426 PolarHBondContact O-N 3.01Å; A423-S427 WeakPolarHBondContact O-CB 3.19Å; A423-S427 PolarHBondContact O-N 3.2Å; A423-S427 PolarHBondContact O-OG 2.72Å
424	I	97.2	Very high	95.2	Very high	77 Å²	77	78.9 Å²	78.9	40%	0.395	42%	0.42	S	S	.	.	H	α-helix	trans	-64.1	-49.1	173.8	-66	165.6	0	0	0	110.6	A420 F421 H426 S427 F428 I443	A420-I424 WeakPolarHBondContact O-CG1 3.36Å; A420-I424 PolarHBondContact O-N 3.33Å; A420-I424 VanDerWaalsContact O-N 3.14Å; F421-I424 PolarHBondContact O-N 2.66Å; I424-H426 VanDerWaalsContact C-N 3.32Å; I424-H426 PolarHBondContact O-N 3.14Å; I424-S427 WeakPolarHBondContact O-CB 3.46Å; I424-S427 PolarHBondContact O-N 3.27Å; I424-S427 VanDerWaalsContact O-N 3.11Å; I424-F428 HydrophobicContact CG2-CD1 4.47Å; I424-F428 HydrophobicContact CG2-CD2 4.33Å; I424-F428 HydrophobicContact CG2-CE1 4.02Å; I424-F428 HydrophobicContact CG2-CE2 3.88Å; I424-F428 HydrophobicContact CG2-CZ 3.71Å; I424-F428 PolarHBondContact O-N 3.15Å; I424-I443 HydrophobicContact CB-CG2 4.48Å; I424-I443 HydrophobicContact CG2-CG2 4.4Å
425	S	96.1	Very high	94.8	Very high	3 Å²	3	78.3 Å²	78.3	2%	0.021	42%	0.423	C	S	.	.	H	α-helix	trans	-55.6	-44.4	175.9	165.7	0	0	0	0	112.2	F421 Q422 F428 Q429 N440 S444	F421-S425 PolarHBondContact O-N 3.24Å; Q422-S425 PolarHBondContact O-N 3.17Å; S425-F428 PolarHBondContact O-N 2.86Å; S425-Q429 WeakPolarHBondContact O-CG 3Å; S425-Q429 PolarHBondContact O-N 2.77Å; S425-N440 PolarHBondContact OG-O 3.49Å; S425-S444 WeakPolarHBondContact OG-CB 3.42Å
426	H	95.6	Very high	94.6	Very high	115 Å²	115	77.9 Å²	77.9	53%	0.532	43%	0.425	S	S	.	.	H	α-helix	trans	-65.5	-39.7	176.3	-175.2	42.5	0	0	0	112.2	Q422 A423 I424 F428 Q429	Q422-H426 WeakPolarHBondContact O-CB 3.44Å; Q422-H426 PolarHBondContact O-N 3.23Å; A423-H426 PolarHBondContact O-N 3.01Å; I424-H426 VanDerWaalsContact C-N 3.32Å; I424-H426 PolarHBondContact O-N 3.14Å; H426-F428 VanDerWaalsContact C-N 3.31Å; H426-F428 PolarHBondContact O-N 3.27Å; H426-Q429 WeakPolarHBondContact O-CB 3.34Å; H426-Q429 PolarHBondContact O-N 3.22Å
427	S	96.6	Very high	94.2	Very high	74 Å²	74	79.8 Å²	79.8	52%	0.517	44%	0.436	S	S	.	.	H	α-helix	trans	-63	-38.1	177.3	-56.7	0	0	0	0	111.7	A423 I424 Q429 M430	A423-S427 WeakPolarHBondContact O-CB 3.19Å; A423-S427 PolarHBondContact O-N 3.2Å; A423-S427 PolarHBondContact O-OG 2.72Å; I424-S427 WeakPolarHBondContact O-CB 3.46Å; I424-S427 PolarHBondContact O-N 3.27Å; I424-S427 VanDerWaalsContact O-N 3.11Å; S427-Q429 PolarHBondContact O-N 3.21Å; S427-M430 WeakPolarHBondContact O-CB 3.46Å; S427-M430 PolarHBondContact O-N 3.08Å
428	F	94.4	Very high	94	Very high	99 Å²	99	78.5 Å²	78.5	43%	0.434	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-8	174.8	-66.7	-3.5	0	0	0	114	I424 S425 H426 C435 N440 I443	I424-F428 HydrophobicContact CG2-CD1 4.47Å; I424-F428 HydrophobicContact CG2-CD2 4.33Å; I424-F428 HydrophobicContact CG2-CE1 4.02Å; I424-F428 HydrophobicContact CG2-CE2 3.88Å; I424-F428 HydrophobicContact CG2-CZ 3.71Å; I424-F428 PolarHBondContact O-N 3.15Å; S425-F428 PolarHBondContact O-N 2.86Å; H426-F428 VanDerWaalsContact C-N 3.31Å; H426-F428 PolarHBondContact O-N 3.27Å; F428-C435 WeakPolarHBondContact O-CB 3.23Å; F428-N440 WeakPolarHBondContact CB-OD1 3.48Å; F428-N440 WeakPolarHBondContact CD2-OD1 3.17Å; F428-N440 PolarHBondContact O-ND2 3.5Å; F428-I443 HydrophobicContact CD2-CD1 4Å; F428-I443 HydrophobicContact CE2-CD1 3.78Å
429	Q	93.7	Very high	93.8	Very high	98 Å²	98	81.4 Å²	81.4	46%	0.458	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-8.6	172.9	-69.5	167.3	-17.4	0	0	112.9	S425 H426 S427 D431 N440	S425-Q429 WeakPolarHBondContact O-CG 3Å; S425-Q429 PolarHBondContact O-N 2.77Å; H426-Q429 WeakPolarHBondContact O-CB 3.34Å; H426-Q429 PolarHBondContact O-N 3.22Å; S427-Q429 PolarHBondContact O-N 3.21Å; Q429-D431 VanDerWaalsContact C-N 3.29Å; Q429-D431 PolarHBondContact O-N 2.8Å; Q429-N440 HydrophobicContact CG-CB 4.34Å
430	M	93.3	Very high	93.6	Very high	142 Å²	142	78.8 Å²	78.8	70%	0.7	43%	0.433	S	S	*	.	S	Bend	trans	-75.4	-12.6	-175.4	-63.2	-64.5	-68.5	0	0	114.3	S427	S427-M430 WeakPolarHBondContact O-CB 3.46Å; S427-M430 PolarHBondContact O-N 3.08Å
431	D	92.3	Very high	93.5	Very high	88 Å²	88	79.4 Å²	79.4	47%	0.471	43%	0.434	S	S	.	.			trans	-129.1	78.2	178.2	-169.9	9.8	0	0	0	111.2	Q429 P433 F434 C435	Q429-D431 VanDerWaalsContact C-N 3.29Å; Q429-D431 PolarHBondContact O-N 2.8Å; D431-P433 VanDerWaalsContact C-CD 3.49Å; D431-F434 PolarHBondContact O-N 2.98Å; D431-F434 WeakPolarHBondContact OD2-CD2 3.41Å; D431-C435 PolarHBondContact O-N 3.44Å
432	P	85.7	Confident	93.4	Very high	93 Å²	93	76.7 Å²	76.7	60%	0.604	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-57.8	-37.7	-169.6	-26.1	35	0	0	0	116.7	F434 C435	P432-F434 PolarHBondContact O-N 3.23Å; P432-C435 PolarHBondContact O-N 3.45Å
433	P	89.3	Confident	93.4	Very high	106 Å²	106	74.9 Å²	74.9	69%	0.688	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-64.9	-16.9	179.7	-23.5	35.3	0	0	0	115.1	D431	D431-P433 VanDerWaalsContact C-CD 3.49Å
434	F	88.9	Confident	93.4	Very high	172 Å²	172	72.9 Å²	72.9	75%	0.754	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-120.1	8	-175.7	-61.8	-75.8	0	0	0	113.4	D431 P432	D431-F434 PolarHBondContact O-N 2.98Å; D431-F434 WeakPolarHBondContact OD2-CD2 3.41Å; P432-F434 PolarHBondContact O-N 3.23Å
435	C	89	Confident	93.4	Very high	42 Å²	42	71.8 Å²	71.8	28%	0.284	39%	0.39	S	S	.	.			trans	-96.4	154.9	-178.7	84.6	0	0	0	0	113.3	F428 D431 P432	F428-C435 WeakPolarHBondContact O-CB 3.23Å; D431-C435 PolarHBondContact O-N 3.44Å; P432-C435 PolarHBondContact O-N 3.45Å
436	S	91.8	Very high	93.5	Very high	45 Å²	45	72.2 Å²	72.2	32%	0.315	39%	0.393	S	S	.	.			trans	-106.2	108.8	166.2	169.7	0	0	0	0	108.7	A438 L439 N440	S436-A438 PolarHBondContact O-N 2.8Å; S436-L439 PolarHBondContact O-N 3.47Å; S436-L439 PolarHBondContact OG-N 3.3Å; S436-N440 WeakPolarHBondContact O-CB 3.39Å; S436-N440 PolarHBondContact O-N 3.17Å; S436-N440 PolarHBondContact O-OD1 2.95Å
437	E	90.1	Very high	93.6	Very high	164 Å²	164	66.8 Å²	66.8	77%	0.766	37%	0.368	S	S	*	.	H	α-helix	trans	-57.8	-35.6	177.9	-65	-168.5	160.5	0	0	112.1	N440 S441	E437-N440 PolarHBondContact O-N 2.87Å; E437-S441 WeakPolarHBondContact O-CB 3.38Å; E437-S441 PolarHBondContact O-N 3.39Å
438	A	92.7	Very high	93.7	Very high	49 Å²	49	70.3 Å²	70.3	41%	0.405	37%	0.37	S	S	.	.	H	α-helix	trans	-65.9	-47.7	178.6	0	0	0	0	0	111.6	S436 S441 A442 L574	S436-A438 PolarHBondContact O-N 2.8Å; A438-S441 WeakPolarHBondContact O-CB 3.39Å; A438-S441 PolarHBondContact O-N 3.39Å; A438-A442 PolarHBondContact O-N 3.01Å; A438-L574 VanDerWaalsContact C-CD2 3.47Å; A438-L574 HydrophobicContact CB-CD2 3.49Å; A438-L574 VanDerWaalsContact CB-CD2 3.49Å
439	L	94.7	Very high	93.9	Very high	61 Å²	61	65.9 Å²	65.9	32%	0.319	35%	0.351	S	S	.	.	H	α-helix	trans	-63.3	-43.3	175.3	176.5	62.8	0	0	0	111.3	S436 S441 A442 I443 Y571 L574	S436-L439 PolarHBondContact O-N 3.47Å; S436-L439 PolarHBondContact OG-N 3.3Å; L439-S441 VanDerWaalsContact C-N 3.29Å; L439-S441 PolarHBondContact O-N 2.75Å; L439-A442 PolarHBondContact O-N 3.38Å; L439-I443 HydrophobicContact CD1-CD1 3.88Å; L439-I443 HydrophobicContact CD1-CG1 4.19Å; L439-I443 HydrophobicContact CG-CD1 3.91Å; L439-I443 WeakPolarHBondContact O-CG1 3.47Å; L439-I443 PolarHBondContact O-N 3.26Å; L439-Y571 HydrophobicContact CD1-CD1 4.39Å; L439-Y571 HydrophobicContact CD1-CE1 4.13Å; L439-L574 HydrophobicContact CB-CD1 4.23Å; L439-L574 HydrophobicContact CD1-CD1 3.72Å
440	N	93.8	Very high	94.1	Very high	4 Å²	4	63.9 Å²	63.9	2%	0.021	34%	0.339	C	S	.	.	H	α-helix	trans	-62.2	-38.4	178.1	-69.6	-6.6	0	0	0	111.5	S425 F428 Q429 S436 E437 S444	S425-N440 PolarHBondContact OG-O 3.49Å; F428-N440 WeakPolarHBondContact CB-OD1 3.48Å; F428-N440 WeakPolarHBondContact CD2-OD1 3.17Å; F428-N440 PolarHBondContact O-ND2 3.5Å; Q429-N440 HydrophobicContact CG-CB 4.34Å; S436-N440 WeakPolarHBondContact O-CB 3.39Å; S436-N440 PolarHBondContact O-N 3.17Å; S436-N440 PolarHBondContact O-OD1 2.95Å; E437-N440 PolarHBondContact O-N 2.87Å; N440-S444 WeakPolarHBondContact O-CB 3.19Å; N440-S444 PolarHBondContact O-N 3.5Å
441	S	94.5	Very high	94.3	Very high	64 Å²	64	59.5 Å²	59.5	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-66.6	-45.1	174.3	-172.4	0	0	0	0	112.1	E437 A438 L439 I443 S444 H445	E437-S441 WeakPolarHBondContact O-CB 3.38Å; E437-S441 PolarHBondContact O-N 3.39Å; A438-S441 WeakPolarHBondContact O-CB 3.39Å; A438-S441 PolarHBondContact O-N 3.39Å; L439-S441 VanDerWaalsContact C-N 3.29Å; L439-S441 PolarHBondContact O-N 2.75Å; S441-I443 PolarHBondContact O-N 2.87Å; S441-S444 WeakPolarHBondContact O-CB 3.19Å; S441-S444 PolarHBondContact O-N 2.99Å; S441-H445 PolarHBondContact O-N 3.03Å
442	A	97	Very high	94.5	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-60.5	-45.5	176.1	0	0	0	0	0	112.1	A438 L439 H445 T446 M570 Y571 L574	A438-A442 PolarHBondContact O-N 3.01Å; L439-A442 PolarHBondContact O-N 3.38Å; A442-H445 PolarHBondContact O-N 3.09Å; A442-T446 PolarHBondContact O-N 2.91Å; A442-T446 PolarHBondContact O-OG1 3.07Å; A442-T446 VanDerWaalsContact O-OG1 3.12Å; A442-M570 HydrophobicContact CB-CB 3.91Å; A442-Y571 HydrophobicContact CB-CD1 4.17Å; A442-Y571 HydrophobicContact CB-CD2 4.28Å; A442-Y571 HydrophobicContact CB-CE1 3.85Å; A442-Y571 HydrophobicContact CB-CE2 3.98Å; A442-Y571 HydrophobicContact CB-CG 4.38Å; A442-Y571 PolarHBondContact O-OH 2.77Å; A442-L574 HydrophobicContact CB-CD1 4.22Å
443	I	97	Very high	95.1	Very high	19 Å²	19	53 Å²	53	10%	0.097	28%	0.283	C	S	.	.	H	α-helix	trans	-64.2	-41	175.7	-62.8	168.3	0	0	0	111.3	F421 I424 F428 L439 S441 H445 T446 G447 Y571	F421-I443 HydrophobicContact CB-CG2 4.25Å; F421-I443 VanDerWaalsContact O-CG2 3.3Å; F421-I443 WeakPolarHBondContact O-CG2 3.44Å; I424-I443 HydrophobicContact CB-CG2 4.48Å; I424-I443 HydrophobicContact CG2-CG2 4.4Å; F428-I443 HydrophobicContact CD2-CD1 4Å; F428-I443 HydrophobicContact CE2-CD1 3.78Å; L439-I443 HydrophobicContact CD1-CD1 3.88Å; L439-I443 HydrophobicContact CD1-CG1 4.19Å; L439-I443 HydrophobicContact CG-CD1 3.91Å; L439-I443 WeakPolarHBondContact O-CG1 3.47Å; L439-I443 PolarHBondContact O-N 3.26Å; S441-I443 PolarHBondContact O-N 2.87Å; I443-H445 VanDerWaalsContact C-N 3.32Å; I443-H445 PolarHBondContact O-N 3.42Å; I443-T446 PolarHBondContact O-N 3.02Å; I443-G447 PolarHBondContact O-N 3.47Å; I443-Y571 WeakPolarHBondContact CA-OH 3.44Å; I443-Y571 HydrophobicContact CG1-CE1 4.26Å; I443-Y571 PolarHBondContact N-OH 3.29Å
444	S	97.2	Very high	95.5	Very high	16 Å²	16	48 Å²	48	11%	0.112	25%	0.251	C	S	.	.	H	α-helix	trans	-61.4	-40.3	173.9	-163.8	0	0	0	0	112	S425 N440 S441 G447 R448	S425-S444 WeakPolarHBondContact OG-CB 3.42Å; N440-S444 WeakPolarHBondContact O-CB 3.19Å; N440-S444 PolarHBondContact O-N 3.5Å; S441-S444 WeakPolarHBondContact O-CB 3.19Å; S441-S444 PolarHBondContact O-N 2.99Å; S444-G447 PolarHBondContact O-N 3.2Å; S444-R448 WeakPolarHBondContact O-CG 3.43Å; S444-R448 PolarHBondContact O-N 3.48Å; S444-R448 PolarHBondContact OG-NH2 3.43Å
445	H	97.4	Very high	95.9	Very high	53 Å²	53	42.9 Å²	42.9	25%	0.245	23%	0.229	C	C	.	.	H	α-helix	trans	-65.7	-46.1	177.2	-160	99.1	0	0	0	111.3	S441 A442 I443 G447 R448 T449 M570	S441-H445 PolarHBondContact O-N 3.03Å; A442-H445 PolarHBondContact O-N 3.09Å; I443-H445 VanDerWaalsContact C-N 3.32Å; I443-H445 PolarHBondContact O-N 3.42Å; H445-G447 PolarHBondContact O-N 2.9Å; H445-R448 PolarHBondContact O-N 2.71Å; H445-T449 PolarHBondContact CD2-OG1 3.26Å; H445-T449 PolarHBondContact O-N 2.88Å; H445-T449 PolarHBondContact O-OG1 2.88Å; H445-T449 VanDerWaalsContact O-OG1 3.06Å; H445-M570 HydrophobicContact CB-CE 3.96Å; H445-M570 HydrophobicContact CB-SD 3.44Å; H445-M570 WeakPolarHBondContact CB-SD 3.42Å
446	T	98.3	Very high	96.3	Very high	13 Å²	13	42.5 Å²	42.5	8%	0.08	22%	0.224	C	C	.	.	H	α-helix	trans	-52.5	-42.8	173.1	-60.5	0	0	0	0	111.3	F421 A442 I443 R448 T449 Y450 T567 Y571	F421-T446 HydrophobicContact CD1-CG2 4.45Å; F421-T446 HydrophobicContact CD2-CG2 3.79Å; F421-T446 HydrophobicContact CE1-CG2 4.46Å; F421-T446 HydrophobicContact CE2-CG2 3.78Å; F421-T446 HydrophobicContact CG-CG2 4.14Å; F421-T446 HydrophobicContact CZ-CG2 4.14Å; A442-T446 PolarHBondContact O-N 2.91Å; A442-T446 PolarHBondContact O-OG1 3.07Å; A442-T446 VanDerWaalsContact O-OG1 3.12Å; I443-T446 PolarHBondContact O-N 3.02Å; T446-R448 PolarHBondContact O-N 2.89Å; T446-T449 PolarHBondContact O-N 3.37Å; T446-Y450 HydrophobicContact CG2-CD2 4Å; T446-Y450 HydrophobicContact CG2-CE2 4.03Å; T446-Y450 WeakPolarHBondContact O-CD2 3.49Å; T446-Y450 PolarHBondContact O-N 3.39Å; T446-T567 HydrophobicContact CG2-CG2 4.32Å; T446-T567 WeakPolarHBondContact OG1-CG2 3.44Å; T446-Y571 WeakPolarHBondContact OG1-CE2 3.44Å; T446-Y571 PolarHBondContact OG1-OH 3.18Å
447	G	98.1	Very high	96.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-56.2	-50.2	173.8	0	0	0	0	0	113.9	G418 I443 S444 H445 T449 Y450 E451	G418-G447 WeakPolarHBondContact CA-O 3.48Å; G418-G447 WeakPolarHBondContact O-CA 3.31Å; I443-G447 PolarHBondContact O-N 3.47Å; S444-G447 PolarHBondContact O-N 3.2Å; H445-G447 PolarHBondContact O-N 2.9Å; G447-T449 VanDerWaalsContact C-N 3.34Å; G447-T449 PolarHBondContact O-N 3.01Å; G447-Y450 PolarHBondContact O-N 2.96Å; G447-E451 PolarHBondContact O-N 2.79Å; G447-E451 VanDerWaalsContact O-N 3.14Å
448	R	98.1	Very high	96.9	Very high	149 Å²	149	34 Å²	34	56%	0.562	18%	0.181	S	C	*	.	H	α-helix	trans	-67	-33.5	178.6	-61.6	174.8	-149.9	-174.1	7.1	112.5	S444 H445 T446 E451 A452	S444-R448 WeakPolarHBondContact O-CG 3.43Å; S444-R448 PolarHBondContact O-N 3.48Å; S444-R448 PolarHBondContact OG-NH2 3.43Å; H445-R448 PolarHBondContact O-N 2.71Å; T446-R448 PolarHBondContact O-N 2.89Å; R448-E451 PolarHBondContact O-N 2.96Å; R448-A452 WeakPolarHBondContact O-CB 3.4Å; R448-A452 PolarHBondContact O-N 3.38Å
449	T	98.3	Very high	97	Very high	6 Å²	6	37.7 Å²	37.7	4%	0.037	19%	0.19	C	C	.	.	H	α-helix	trans	-63.1	-45	175.1	-60.7	0	0	0	0	111.1	H445 T446 G447 A452 I453 Q563 T567	H445-T449 PolarHBondContact CD2-OG1 3.26Å; H445-T449 PolarHBondContact O-N 2.88Å; H445-T449 PolarHBondContact O-OG1 2.88Å; H445-T449 VanDerWaalsContact O-OG1 3.06Å; T446-T449 PolarHBondContact O-N 3.37Å; G447-T449 VanDerWaalsContact C-N 3.34Å; G447-T449 PolarHBondContact O-N 3.01Å; T449-A452 PolarHBondContact O-N 3.04Å; T449-I453 HydrophobicContact CG2-CD1 3.96Å; T449-I453 VanDerWaalsContact O-CG1 3.31Å; T449-I453 WeakPolarHBondContact O-CG1 3.4Å; T449-I453 PolarHBondContact O-N 3.33Å; T449-Q563 HydrophobicContact CG2-CB 3.94Å; T449-T567 WeakPolarHBondContact CB-OG1 3.39Å; T449-T567 WeakPolarHBondContact CG2-OG1 3.38Å; T449-T567 PolarHBondContact OG1-OG1 3.37Å
450	Y	98.2	Very high	97.1	Very high	56 Å²	56	34.9 Å²	34.9	22%	0.22	18%	0.175	C	C	.	.	H	α-helix	trans	-67	-38.4	177.8	-88.7	-99	0	0	0	112.1	F414 L417 F421 T446 G447 I453 G454 L564	F414-Y450 AromaticContact CD1-CD1 3.77Å; F414-Y450 HydrophobicContact CD1-CD1 3.77Å; F414-Y450 HydrophobicContact CD1-CE1 4.26Å; F414-Y450 HydrophobicContact CE1-CD1 4.17Å; F414-Y450 HydrophobicContact CE1-CE1 4.19Å; L417-Y450 HydrophobicContact CB-CD1 4.33Å; L417-Y450 HydrophobicContact CD2-CD1 3.5Å; L417-Y450 HydrophobicContact CD2-CE1 3.4Å; L417-Y450 VanDerWaalsContact CD2-CE1 3.4Å; L417-Y450 HydrophobicContact CD2-CG 4.46Å; L417-Y450 HydrophobicContact CG-CD1 3.79Å; L417-Y450 HydrophobicContact CG-CE1 4.12Å; L417-Y450 HydrophobicContact CG-CG 4.33Å; F421-Y450 HydrophobicContact CD2-CD2 4.41Å; F421-Y450 HydrophobicContact CE2-CD2 4.03Å; F421-Y450 HydrophobicContact CE2-CE2 4.13Å; F421-Y450 HydrophobicContact CE2-CG 4.39Å; T446-Y450 HydrophobicContact CG2-CD2 4Å; T446-Y450 HydrophobicContact CG2-CE2 4.03Å; T446-Y450 WeakPolarHBondContact O-CD2 3.49Å; T446-Y450 PolarHBondContact O-N 3.39Å; G447-Y450 PolarHBondContact O-N 2.96Å; Y450-I453 PolarHBondContact O-N 2.8Å; Y450-G454 PolarHBondContact O-N 2.97Å; Y450-L564 HydrophobicContact CE2-CD2 3.84Å
451	E	97.6	Very high	97.3	Very high	49 Å²	49	34.8 Å²	34.8	23%	0.229	18%	0.175	C	C	.	.	H	α-helix	trans	-60.2	-45.8	170.4	-79.3	161.9	-167.1	0	0	112.2	Q415 S419 Q422 G447 R448 I453 G454 E455	Q415-E451 HydrophobicContact CB-CG 4.46Å; Q415-E451 HydrophobicContact CG-CG 4.39Å; S419-E451 WeakPolarHBondContact CA-OE1 3.46Å; S419-E451 PolarHBondContact N-OE1 3.26Å; S419-E451 VanDerWaalsContact N-OE1 3.15Å; S419-E451 PolarHBondContact OG-OE1 3.3Å; Q422-E451 PolarHBondContact NE2-OE1 3.49Å; Q422-E451 PolarHBondContact NE2-OE2 2.94Å; G447-E451 PolarHBondContact O-N 2.79Å; G447-E451 VanDerWaalsContact O-N 3.14Å; R448-E451 PolarHBondContact O-N 2.96Å; E451-I453 PolarHBondContact O-N 2.84Å; E451-G454 WeakPolarHBondContact O-CA 3.48Å; E451-G454 PolarHBondContact O-N 3.31Å; E451-G454 VanDerWaalsContact O-N 3.07Å; E451-E455 PolarHBondContact O-N 2.96Å; E451-E455 VanDerWaalsContact O-N 3.15Å
452	A	97.6	Very high	97.3	Very high	44 Å²	44	37.3 Å²	37.3	36%	0.364	18%	0.178	S	C	.	.	H	α-helix	trans	-63.7	-38.2	176.8	0	0	0	0	0	113	R448 T449 G454 E455 M456	R448-A452 WeakPolarHBondContact O-CB 3.4Å; R448-A452 PolarHBondContact O-N 3.38Å; T449-A452 PolarHBondContact O-N 3.04Å; A452-G454 VanDerWaalsContact C-N 3.27Å; A452-G454 PolarHBondContact O-N 2.67Å; A452-E455 PolarHBondContact O-N 2.83Å; A452-M456 WeakPolarHBondContact O-CG 3.27Å; A452-M456 PolarHBondContact O-N 3.36Å
453	I	98.1	Very high	97.2	Very high	1 Å²	1	40 Å²	40	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-62.5	-37.3	172.1	-71	165.2	0	0	0	110.5	F414 T449 Y450 E451 E455 M456 F457 V560 Q563 L564	F414-I453 HydrophobicContact CD1-CB 4.25Å; F414-I453 HydrophobicContact CD1-CG2 3.61Å; F414-I453 HydrophobicContact CE1-CG2 3.65Å; F414-I453 HydrophobicContact CG-CG2 4.09Å; F414-I453 HydrophobicContact CZ-CG2 4.16Å; T449-I453 HydrophobicContact CG2-CD1 3.96Å; T449-I453 VanDerWaalsContact O-CG1 3.31Å; T449-I453 WeakPolarHBondContact O-CG1 3.4Å; T449-I453 PolarHBondContact O-N 3.33Å; Y450-I453 PolarHBondContact O-N 2.8Å; E451-I453 PolarHBondContact O-N 2.84Å; I453-E455 VanDerWaalsContact C-N 3.35Å; I453-E455 PolarHBondContact O-N 2.95Å; I453-M456 HydrophobicContact CG1-SD 4.49Å; I453-M456 WeakPolarHBondContact O-CB 3.3Å; I453-M456 PolarHBondContact O-N 3.49Å; I453-F457 HydrophobicContact CG2-CD2 3.85Å; I453-F457 HydrophobicContact CG2-CE2 3.82Å; I453-F457 WeakPolarHBondContact O-CD2 3.37Å; I453-F457 PolarHBondContact O-N 3.18Å; I453-V560 HydrophobicContact CD1-CG1 4.18Å; I453-V560 HydrophobicContact CG1-CG1 4.37Å; I453-V560 HydrophobicContact CG2-CG1 4.13Å; I453-V560 HydrophobicContact CG2-CG2 4.46Å; I453-Q563 HydrophobicContact CD1-CB 4.26Å; I453-Q563 HydrophobicContact CG1-CB 4.28Å; I453-L564 HydrophobicContact CD1-CD2 3.71Å; I453-L564 HydrophobicContact CD1-CG 3.99Å
454	G	97.6	Very high	97.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.6	-42.7	173.1	0	0	0	0	0	113.2	R411 Y450 E451 A452 F457 A458	R411-G454 WeakPolarHBondContact CG-O 3.3Å; Y450-G454 PolarHBondContact O-N 2.97Å; E451-G454 WeakPolarHBondContact O-CA 3.48Å; E451-G454 PolarHBondContact O-N 3.31Å; E451-G454 VanDerWaalsContact O-N 3.07Å; A452-G454 VanDerWaalsContact C-N 3.27Å; A452-G454 PolarHBondContact O-N 2.67Å; G454-F457 PolarHBondContact O-N 3.14Å; G454-A458 PolarHBondContact O-N 3.35Å; G454-A458 VanDerWaalsContact O-N 3.16Å
455	E	97.5	Very high	97.1	Very high	66 Å²	66	38.4 Å²	38.4	31%	0.308	18%	0.183	S	C	.	.	H	α-helix	trans	-66.5	-42.2	173.5	-59.9	-53.8	140.6	0	0	112.1	R411 Q415 E451 A452 I453 F457 A458 E459	R411-E455 IonicContact CZ-OE1 2.8Å; R411-E455 VanDerWaalsContact CZ-OE1 3.24Å; R411-E455 IonicContact CZ-OE2 2.67Å; R411-E455 VanDerWaalsContact NE-CD 3.33Å; R411-E455 IonicContact NE-OE1 3.98Å; R411-E455 PolarHBondContact NE-OE1 2.99Å; R411-E455 IonicContact NE-OE2 3.56Å; R411-E455 PolarHBondContact NE-OE2 2.85Å; R411-E455 VanDerWaalsContact NE-OE2 3.12Å; R411-E455 IonicContact NH2-OE1 2.98Å; R411-E455 PolarHBondContact NH2-OE1 2.86Å; R411-E455 IonicContact NH2-OE2 2.67Å; R411-E455 PolarHBondContact NH2-OE2 3.01Å; Q415-E455 PolarHBondContact NE2-OE1 2.94Å; E451-E455 PolarHBondContact O-N 2.96Å; E451-E455 VanDerWaalsContact O-N 3.15Å; A452-E455 PolarHBondContact O-N 2.83Å; I453-E455 VanDerWaalsContact C-N 3.35Å; I453-E455 PolarHBondContact O-N 2.95Å; E455-F457 VanDerWaalsContact C-N 3.28Å; E455-F457 PolarHBondContact O-N 2.97Å; E455-A458 WeakPolarHBondContact O-CA 3.44Å; E455-A458 WeakPolarHBondContact O-CB 3.38Å; E455-A458 PolarHBondContact O-N 2.97Å; E455-E459 PolarHBondContact O-N 2.81Å
456	M	97.5	Very high	97	Very high	33 Å²	33	38.1 Å²	38.1	16%	0.163	18%	0.181	C	C	.	.	H	α-helix	trans	-57.3	-40.8	174.6	-68.7	170.2	56.5	0	0	112	A452 I453 A458 Q460 F556 R559 V560 Q563	A452-M456 WeakPolarHBondContact O-CG 3.27Å; A452-M456 PolarHBondContact O-N 3.36Å; I453-M456 HydrophobicContact CG1-SD 4.49Å; I453-M456 WeakPolarHBondContact O-CB 3.3Å; I453-M456 PolarHBondContact O-N 3.49Å; M456-A458 VanDerWaalsContact C-N 3.33Å; M456-Q460 WeakPolarHBondContact O-CB 3.45Å; M456-Q460 PolarHBondContact O-N 3.33Å; M456-F556 HydrophobicContact CB-CE2 4.09Å; M456-F556 WeakPolarHBondContact O-CE2 3.44Å; M456-R559 HydrophobicContact CE-CB 3.67Å; M456-V560 HydrophobicContact CE-CG2 3.73Å; M456-Q563 HydrophobicContact SD-CG 4.06Å
457	F	96.9	Very high	96.9	Very high	16 Å²	16	41.5 Å²	41.5	7%	0.07	20%	0.196	C	C	.	.	H	α-helix	trans	-63	-37.4	172.7	-91.2	-77.2	0	0	0	112.3	H406 F410 F414 I453 G454 E455 P461 F556 Y557	H406-F457 WeakPolarHBondContact CB-O 3.46Å; H406-F457 AromaticContact CD2-CD1 3.75Å; H406-F457 PolarHBondContact CD2-O 2.95Å; H406-F457 VanDerWaalsContact CD2-O 3.32Å; H406-F457 AromaticContact NE2-CD1 3.98Å; F410-F457 HydrophobicContact CB-CB 4.11Å; F410-F457 HydrophobicContact CB-CD1 4.04Å; F410-F457 HydrophobicContact CB-CG 4.04Å; F410-F457 AromaticContact CD2-CD1 3.79Å; F410-F457 HydrophobicContact CD2-CD1 3.79Å; F410-F457 HydrophobicContact CD2-CE1 4.14Å; F410-F457 HydrophobicContact CG-CD1 4.27Å; F414-F457 AromaticContact CD2-CD2 3.68Å; F414-F457 HydrophobicContact CD2-CD2 3.68Å; F414-F457 AromaticContact CD2-CE2 3.87Å; F414-F457 HydrophobicContact CD2-CE2 3.87Å; F414-F457 HydrophobicContact CD2-CG 4.49Å; F414-F457 HydrophobicContact CE1-CE2 4.37Å; F414-F457 AromaticContact CE2-CD2 3.53Å; F414-F457 HydrophobicContact CE2-CD2 3.53Å; F414-F457 AromaticContact CE2-CE2 3.21Å; F414-F457 HydrophobicContact CE2-CE2 3.21Å; F414-F457 HydrophobicContact CE2-CG 4.42Å; F414-F457 AromaticContact CE2-CZ 3.88Å; F414-F457 HydrophobicContact CE2-CZ 3.88Å; F414-F457 HydrophobicContact CG-CD2 4.47Å; F414-F457 HydrophobicContact CZ-CD2 4.19Å; F414-F457 AromaticContact CZ-CE2 3.52Å; F414-F457 HydrophobicContact CZ-CE2 3.52Å; F414-F457 HydrophobicContact CZ-CZ 4.21Å; I453-F457 HydrophobicContact CG2-CD2 3.85Å; I453-F457 HydrophobicContact CG2-CE2 3.82Å; I453-F457 WeakPolarHBondContact O-CD2 3.37Å; I453-F457 PolarHBondContact O-N 3.18Å; G454-F457 PolarHBondContact O-N 3.14Å; E455-F457 VanDerWaalsContact C-N 3.28Å; E455-F457 PolarHBondContact O-N 2.97Å; F457-P461 WeakPolarHBondContact O-CD 3.41Å; F457-F556 AromaticContact CD1-CE1 3.99Å; F457-F556 HydrophobicContact CD1-CE1 3.99Å; F457-F556 AromaticContact CD1-CZ 3.6Å; F457-F556 HydrophobicContact CD1-CZ 3.6Å; F457-F556 AromaticContact CD2-CZ 3.87Å; F457-F556 HydrophobicContact CD2-CZ 3.87Å; F457-F556 AromaticContact CE1-CE1 3.55Å; F457-F556 HydrophobicContact CE1-CE1 3.55Å; F457-F556 AromaticContact CE1-CZ 3.61Å; F457-F556 HydrophobicContact CE1-CZ 3.61Å; F457-F556 HydrophobicContact CE2-CE1 4.22Å; F457-F556 AromaticContact CE2-CZ 3.85Å; F457-F556 HydrophobicContact CE2-CZ 3.85Å; F457-F556 AromaticContact CG-CZ 3.73Å; F457-F556 HydrophobicContact CG-CZ 3.73Å; F457-F556 AromaticContact CZ-CE1 3.68Å; F457-F556 HydrophobicContact CZ-CE1 3.68Å; F457-F556 AromaticContact CZ-CZ 3.74Å; F457-F556 HydrophobicContact CZ-CZ 3.74Å; F457-Y557 HydrophobicContact CZ-CE1 4.45Å
458	A	96.6	Very high	96.8	Very high	14 Å²	14	42 Å²	42	12%	0.116	20%	0.198	C	C	.	.	H	α-helix	trans	-70.1	-35.2	-179.9	0	0	0	0	0	113.1	R411 G454 E455 M456	R411-A458 HydrophobicContact CB-CB 4.21Å; R411-A458 HydrophobicContact CG-CB 4.14Å; G454-A458 PolarHBondContact O-N 3.35Å; G454-A458 VanDerWaalsContact O-N 3.16Å; E455-A458 WeakPolarHBondContact O-CA 3.44Å; E455-A458 WeakPolarHBondContact O-CB 3.38Å; E455-A458 PolarHBondContact O-N 2.97Å; M456-A458 VanDerWaalsContact C-N 3.33Å
459	E	96	Very high	96.8	Very high	128 Å²	128	35.8 Å²	35.8	60%	0.598	18%	0.176	S	C	*	.	H	α-helix	trans	-81.3	-31.5	178.8	-65.4	-168.5	144.9	0	0	113.7	E455 P461 K462	E455-E459 PolarHBondContact O-N 2.81Å; E459-P461 VanDerWaalsContact O-N 3.13Å; E459-K462 WeakPolarHBondContact O-CB 3.19Å; E459-K462 PolarHBondContact O-N 3.04Å; E459-K462 VanDerWaalsContact O-N 3.08Å
460	Q	96.7	Very high	96.7	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-50.1	-40.2	-171.3	-178.8	58.5	20.9	0	0	115.7	M456 K462 N463 D464 Q552 F556	M456-Q460 WeakPolarHBondContact O-CB 3.45Å; M456-Q460 PolarHBondContact O-N 3.33Å; Q460-K462 PolarHBondContact O-N 2.96Å; Q460-N463 WeakPolarHBondContact O-CB 3.49Å; Q460-N463 PolarHBondContact O-N 3.03Å; Q460-N463 PolarHBondContact OE1-ND2 2.86Å; Q460-D464 PolarHBondContact NE2-OD2 3.4Å; Q460-Q552 PolarHBondContact NE2-O 2.94Å; Q460-F556 HydrophobicContact CB-CD2 3.77Å; Q460-F556 HydrophobicContact CB-CE2 3.8Å; Q460-F556 HydrophobicContact CB-CG 4.44Å; Q460-F556 HydrophobicContact CB-CZ 4.49Å; Q460-F556 HydrophobicContact CG-CB 4.19Å; Q460-F556 HydrophobicContact CG-CD1 4.39Å; Q460-F556 HydrophobicContact CG-CD2 3.58Å; Q460-F556 HydrophobicContact CG-CE2 4.05Å; Q460-F556 HydrophobicContact CG-CG 3.78Å
461	P	96.9	Very high	96.7	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.013	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-55.4	-23.2	179.7	-28.6	36.3	0	0	0	115.6	V403 H406 F457 E459 N463 L465 F466	V403-P461 HydrophobicContact CG1-CB 4.48Å; V403-P461 HydrophobicContact CG2-CB 4.17Å; H406-P461 HydrophobicContact CB-CG 3.43Å; H406-P461 VanDerWaalsContact CB-CG 3.43Å; F457-P461 WeakPolarHBondContact O-CD 3.41Å; E459-P461 VanDerWaalsContact O-N 3.13Å; P461-N463 PolarHBondContact O-N 2.97Å; P461-L465 HydrophobicContact CB-CB 4.24Å; P461-L465 HydrophobicContact CB-CD1 4.19Å; P461-L465 HydrophobicContact CG-CD1 4.29Å; P461-L465 PolarHBondContact O-N 3.32Å; P461-F466 HydrophobicContact CB-CD1 4.25Å; P461-F466 HydrophobicContact CB-CE1 3.98Å; P461-F466 WeakPolarHBondContact O-CB 3.35Å; P461-F466 WeakPolarHBondContact O-CD1 3.31Å; P461-F466 VanDerWaalsContact O-CG 3.3Å; P461-F466 WeakPolarHBondContact O-CG 3.45Å; P461-F466 PolarHBondContact O-N 3.09Å
462	K	93.8	Very high	96.7	Very high	117 Å²	117	31.5 Å²	31.5	51%	0.509	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-65	-28.7	174.3	-64	-174.7	174.1	-170.6	0	112.3	E459 Q460 F466	E459-K462 WeakPolarHBondContact O-CB 3.19Å; E459-K462 PolarHBondContact O-N 3.04Å; E459-K462 VanDerWaalsContact O-N 3.08Å; Q460-K462 PolarHBondContact O-N 2.96Å; K462-F466 HydrophobicContact CB-CD2 4.4Å; K462-F466 HydrophobicContact CB-CE2 4.5Å; K462-F466 HydrophobicContact CG-CD2 4.17Å; K462-F466 HydrophobicContact CG-CE2 3.78Å; K462-F466 HydrophobicContact CG-CZ 4.42Å
463	N	95	Very high	96.7	Very high	56 Å²	56	31.1 Å²	31.1	30%	0.299	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-32.2	-176	-57.4	-42.2	0	0	0	112.6	Q460 P461 Q467	Q460-N463 WeakPolarHBondContact O-CB 3.49Å; Q460-N463 PolarHBondContact O-N 3.03Å; Q460-N463 PolarHBondContact OE1-ND2 2.86Å; P461-N463 PolarHBondContact O-N 2.97Å; N463-Q467 PolarHBondContact O-NE2 3.2Å
464	D	96	Very high	96.7	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.6	-63.1	-168.6	51.6	18.1	0	0	0	114.9	Q460 F466 Q467 M468 Y549 Q552 Q553	Q460-D464 PolarHBondContact NE2-OD2 3.4Å; D464-F466 VanDerWaalsContact C-N 3.3Å; D464-F466 PolarHBondContact O-N 3.42Å; D464-Q467 PolarHBondContact O-N 3Å; D464-Q467 VanDerWaalsContact O-N 3.09Å; D464-M468 PolarHBondContact O-N 3.08Å; D464-Y549 HydrophobicContact CB-CD2 3.94Å; D464-Y549 HydrophobicContact CB-CE2 4.49Å; D464-Q552 HydrophobicContact CB-CB 3.77Å; D464-Q552 HydrophobicContact CB-CG 4.32Å; D464-Q553 PolarHBondContact OD2-NE2 3.12Å
465	L	96.8	Very high	96.7	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-62.8	-35.1	-173.1	-70.3	170.6	0	0	0	112.4	A399 L402 V403 P461 M468 L469 Y549	A399-L465 HydrophobicContact CB-CD2 4.28Å; L402-L465 HydrophobicContact CB-CD1 4.23Å; L402-L465 HydrophobicContact CD2-CD1 4.17Å; L402-L465 HydrophobicContact CD2-CD2 4.1Å; L402-L465 HydrophobicContact CG-CD1 3.93Å; V403-L465 HydrophobicContact CG2-CB 3.84Å; V403-L465 HydrophobicContact CG2-CD1 4.07Å; P461-L465 HydrophobicContact CB-CB 4.24Å; P461-L465 HydrophobicContact CB-CD1 4.19Å; P461-L465 HydrophobicContact CG-CD1 4.29Å; P461-L465 PolarHBondContact O-N 3.32Å; L465-M468 PolarHBondContact O-N 3.06Å; L465-L469 WeakPolarHBondContact O-CB 3.39Å; L465-L469 VanDerWaalsContact O-CG 3.27Å; L465-L469 WeakPolarHBondContact O-CG 3.32Å; L465-L469 PolarHBondContact O-N 2.95Å; L465-Y549 HydrophobicContact CD2-CD2 4.48Å; L465-Y549 HydrophobicContact CD2-CE2 3.77Å; L465-Y549 HydrophobicContact CG-CE2 4.37Å
466	F	96.1	Very high	96.7	Very high	47 Å²	47	31 Å²	31	21%	0.206	15%	0.153	C	C	.	.	H	α-helix	trans	-64.4	-40	175.4	-74.8	10	0	0	0	111.9	V403 P461 K462 D464 L469 D470	V403-F466 HydrophobicContact CG1-CE1 3.8Å; V403-F466 HydrophobicContact CG2-CD1 4.18Å; V403-F466 HydrophobicContact CG2-CE1 4Å; P461-F466 HydrophobicContact CB-CD1 4.25Å; P461-F466 HydrophobicContact CB-CE1 3.98Å; P461-F466 WeakPolarHBondContact O-CB 3.35Å; P461-F466 WeakPolarHBondContact O-CD1 3.31Å; P461-F466 VanDerWaalsContact O-CG 3.3Å; P461-F466 WeakPolarHBondContact O-CG 3.45Å; P461-F466 PolarHBondContact O-N 3.09Å; K462-F466 HydrophobicContact CB-CD2 4.4Å; K462-F466 HydrophobicContact CB-CE2 4.5Å; K462-F466 HydrophobicContact CG-CD2 4.17Å; K462-F466 HydrophobicContact CG-CE2 3.78Å; K462-F466 HydrophobicContact CG-CZ 4.42Å; D464-F466 VanDerWaalsContact C-N 3.3Å; D464-F466 PolarHBondContact O-N 3.42Å; F466-L469 PolarHBondContact O-N 3.45Å; F466-D470 WeakPolarHBondContact O-CB 3.44Å; F466-D470 PolarHBondContact O-N 2.85Å
467	Q	95	Very high	96.6	Very high	84 Å²	84	29.7 Å²	29.7	39%	0.393	15%	0.148	S	C	.	.	H	α-helix	trans	-70.5	-36.7	177.8	-55.6	-169.8	36.6	0	0	111.3	N463 D464 T471 N548	N463-Q467 PolarHBondContact O-NE2 3.2Å; D464-Q467 PolarHBondContact O-N 3Å; D464-Q467 VanDerWaalsContact O-N 3.09Å; Q467-T471 PolarHBondContact O-N 3.31Å; Q467-T471 VanDerWaalsContact O-N 3.09Å; Q467-T471 PolarHBondContact O-OG1 2.8Å; Q467-T471 VanDerWaalsContact O-OG1 3.07Å; Q467-N548 PolarHBondContact OE1-ND2 3.29Å
468	M	97.3	Very high	96.6	Very high	11 Å²	11	29 Å²	29	5%	0.054	15%	0.145	C	C	.	.	H	α-helix	trans	-61.5	-50.7	171	-178.6	-178.2	-72.6	0	0	111.5	A399 D464 L465 D470 T471 L472 M545 M546 Y549	A399-M468 HydrophobicContact CB-SD 4.31Å; D464-M468 PolarHBondContact O-N 3.08Å; L465-M468 PolarHBondContact O-N 3.06Å; M468-D470 VanDerWaalsContact C-N 3.31Å; M468-D470 PolarHBondContact O-N 3.37Å; M468-T471 PolarHBondContact O-N 3.3Å; M468-L472 HydrophobicContact CG-CD1 3.81Å; M468-L472 HydrophobicContact CG-CG 4.36Å; M468-L472 VanDerWaalsContact O-CG 3.27Å; M468-L472 WeakPolarHBondContact O-CG 3.24Å; M468-L472 PolarHBondContact O-N 3.04Å; M468-M545 HydrophobicContact CB-CG 4.28Å; M468-M545 HydrophobicContact CB-SD 4.39Å; M468-M545 HydrophobicContact CG-CG 4.17Å; M468-M545 HydrophobicContact CG-SD 3.8Å; M468-M546 HydrophobicContact CE-SD 4.2Å; M468-Y549 HydrophobicContact CE-CD1 4Å; M468-Y549 HydrophobicContact CE-CD2 3.48Å; M468-Y549 VanDerWaalsContact CE-CD2 3.48Å; M468-Y549 HydrophobicContact CE-CE1 4.47Å; M468-Y549 HydrophobicContact CE-CE2 4.01Å; M468-Y549 HydrophobicContact CE-CG 3.49Å; M468-Y549 VanDerWaalsContact CE-CG 3.49Å
469	L	97.6	Very high	96.6	Very high	19 Å²	19	28.6 Å²	28.6	10%	0.099	14%	0.141	C	C	.	.	H	α-helix	trans	-63.1	-34.5	-179.9	-74.4	168	0	0	0	113.2	S396 A399 S400 V403 L465 F466 S473	S396-L469 WeakPolarHBondContact O-CD2 3.45Å; A399-L469 HydrophobicContact CB-CD2 3.73Å; A399-L469 HydrophobicContact CB-CG 4.03Å; S400-L469 WeakPolarHBondContact OG-CD2 3.2Å; V403-L469 HydrophobicContact CG2-CD1 3.86Å; L465-L469 WeakPolarHBondContact O-CB 3.39Å; L465-L469 VanDerWaalsContact O-CG 3.27Å; L465-L469 WeakPolarHBondContact O-CG 3.32Å; L465-L469 PolarHBondContact O-N 2.95Å; F466-L469 PolarHBondContact O-N 3.45Å; L469-S473 VanDerWaalsContact O-CB 3.3Å; L469-S473 WeakPolarHBondContact O-CB 3.24Å; L469-S473 PolarHBondContact O-N 2.89Å
470	D	96.8	Very high	96.6	Very high	5 Å²	5	25.4 Å²	25.4	3%	0.027	13%	0.133	C	C	.	.	H	α-helix	trans	-72.8	-37.8	176.7	-67.1	-26.4	0	0	0	111.6	R308 R309 L312 F466 M468 S473 L474	R308-D470 IonicContact CZ-OD2 3.17Å; R308-D470 IonicContact NE-OD2 3.36Å; R308-D470 PolarHBondContact NE-OD2 3.06Å; R308-D470 IonicContact NH2-OD2 3.83Å; R308-D470 PolarHBondContact NH2-OD2 3.13Å; R309-D470 HydrophobicContact CG-CB 4.04Å; R309-D470 IonicContact CZ-OD1 3.2Å; R309-D470 VanDerWaalsContact CZ-OD1 3.25Å; R309-D470 IonicContact NE-OD1 2.66Å; R309-D470 PolarHBondContact NE-OD1 2.81Å; R309-D470 IonicContact NH2-OD1 3.03Å; R309-D470 PolarHBondContact NH2-OD1 3.15Å; L312-D470 VanDerWaalsContact CD1-C 3.49Å; L312-D470 HydrophobicContact CD1-CB 3.89Å; F466-D470 WeakPolarHBondContact O-CB 3.44Å; F466-D470 PolarHBondContact O-N 2.85Å; M468-D470 VanDerWaalsContact C-N 3.31Å; M468-D470 PolarHBondContact O-N 3.37Å; D470-S473 PolarHBondContact O-N 3.23Å; D470-L474 PolarHBondContact O-N 3.16Å
471	T	97.9	Very high	96.6	Very high	16 Å²	16	26.6 Å²	26.6	10%	0.098	14%	0.139	C	C	.	.	H	α-helix	trans	-65	-45.7	170.2	-59.7	0	0	0	0	112.3	Q467 M468 S473 L474 Y475 D541 M545	Q467-T471 PolarHBondContact O-N 3.31Å; Q467-T471 VanDerWaalsContact O-N 3.09Å; Q467-T471 PolarHBondContact O-OG1 2.8Å; Q467-T471 VanDerWaalsContact O-OG1 3.07Å; M468-T471 PolarHBondContact O-N 3.3Å; T471-S473 VanDerWaalsContact C-N 3.28Å; T471-S473 PolarHBondContact O-N 3.14Å; T471-L474 WeakPolarHBondContact O-CB 3.31Å; T471-L474 PolarHBondContact O-N 2.75Å; T471-Y475 HydrophobicContact CG2-CD2 4.33Å; T471-Y475 HydrophobicContact CG2-CE2 4.48Å; T471-Y475 WeakPolarHBondContact O-CD2 3.27Å; T471-Y475 PolarHBondContact O-N 2.91Å; T471-D541 HydrophobicContact CG2-CB 4.4Å; T471-M545 HydrophobicContact CG2-CB 4.34Å; T471-M545 HydrophobicContact CG2-CG 4.42Å; T471-M545 HydrophobicContact CG2-SD 3.77Å
472	L	97.9	Very high	96.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.1	-40	177.8	-67.4	168.6	0	0	0	111.1	V392 L395 M468 L474 Y475 Q476 F542 M545	V392-L472 HydrophobicContact CG1-CB 4.1Å; V392-L472 HydrophobicContact CG1-CD2 3.95Å; V392-L472 HydrophobicContact CG2-CD2 4.41Å; L395-L472 HydrophobicContact CB-CD1 4.3Å; L395-L472 HydrophobicContact CD2-CD1 4.06Å; L395-L472 HydrophobicContact CD2-CD2 3.97Å; L395-L472 HydrophobicContact CG-CD1 3.83Å; L395-L472 HydrophobicContact CG-CD2 4.49Å; M468-L472 HydrophobicContact CG-CD1 3.81Å; M468-L472 HydrophobicContact CG-CG 4.36Å; M468-L472 VanDerWaalsContact O-CG 3.27Å; M468-L472 WeakPolarHBondContact O-CG 3.24Å; M468-L472 PolarHBondContact O-N 3.04Å; L472-L474 VanDerWaalsContact C-N 3.33Å; L472-L474 PolarHBondContact O-N 2.98Å; L472-Y475 PolarHBondContact O-N 2.82Å; L472-Y475 VanDerWaalsContact O-N 3.1Å; L472-Q476 WeakPolarHBondContact O-CG 3.27Å; L472-Q476 PolarHBondContact O-N 2.81Å; L472-F542 HydrophobicContact CD2-CE1 4.24Å; L472-F542 HydrophobicContact CD2-CZ 4.25Å; L472-M545 HydrophobicContact CD2-CE 4.36Å; L472-M545 HydrophobicContact CD2-SD 4.33Å; L472-M545 HydrophobicContact CG-SD 4.25Å
473	S	97.1	Very high	96.6	Very high	35 Å²	35	24.8 Å²	24.8	25%	0.245	14%	0.14	C	C	.	.	H	α-helix	trans	-64.8	-31.1	176.9	-169.2	0	0	0	0	113.9	R309 L469 D470 T471 G477	R309-S473 PolarHBondContact NH1-OG 2.65Å; L469-S473 VanDerWaalsContact O-CB 3.3Å; L469-S473 WeakPolarHBondContact O-CB 3.24Å; L469-S473 PolarHBondContact O-N 2.89Å; D470-S473 PolarHBondContact O-N 3.23Å; T471-S473 VanDerWaalsContact C-N 3.28Å; T471-S473 PolarHBondContact O-N 3.14Å; S473-G477 PolarHBondContact O-N 3.35Å
474	L	97.4	Very high	96.4	Very high	14 Å²	14	25.8 Å²	25.8	7%	0.073	15%	0.145	C	C	.	.	H	α-helix	trans	-62.9	-45.9	170.4	175.5	68	0	0	0	110.2	P287 L312 D470 T471 L472 G477 L478	P287-L474 HydrophobicContact CB-CD1 3.67Å; L312-L474 HydrophobicContact CB-CD2 4.43Å; D470-L474 PolarHBondContact O-N 3.16Å; T471-L474 WeakPolarHBondContact O-CB 3.31Å; T471-L474 PolarHBondContact O-N 2.75Å; L472-L474 VanDerWaalsContact C-N 3.33Å; L472-L474 PolarHBondContact O-N 2.98Å; L474-G477 PolarHBondContact O-N 2.77Å; L474-L478 HydrophobicContact CD1-CD1 4.36Å; L474-L478 HydrophobicContact CG-CD1 4.03Å; L474-L478 WeakPolarHBondContact O-CG 3.32Å; L474-L478 PolarHBondContact O-N 2.94Å
475	Y	98.1	Very high	96.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-68.3	-34	-178.9	-85.8	-80.8	0	0	0	113.8	M388 T471 L472 L478 L479 F534 R537 R538 D541 F542	M388-Y475 HydrophobicContact CE-CD1 3.61Å; M388-Y475 HydrophobicContact CE-CE1 4.26Å; M388-Y475 HydrophobicContact CE-CG 4.15Å; T471-Y475 HydrophobicContact CG2-CD2 4.33Å; T471-Y475 HydrophobicContact CG2-CE2 4.48Å; T471-Y475 WeakPolarHBondContact O-CD2 3.27Å; T471-Y475 PolarHBondContact O-N 2.91Å; L472-Y475 PolarHBondContact O-N 2.82Å; L472-Y475 VanDerWaalsContact O-N 3.1Å; Y475-L478 HydrophobicContact CD1-CD1 4.35Å; Y475-L478 HydrophobicContact CE1-CD1 4.18Å; Y475-L478 PolarHBondContact O-N 3.15Å; Y475-L479 VanDerWaalsContact O-CB 3.25Å; Y475-L479 WeakPolarHBondContact O-CB 3.37Å; Y475-L479 WeakPolarHBondContact O-CD1 3.42Å; Y475-L479 WeakPolarHBondContact O-CG 3.29Å; Y475-L479 PolarHBondContact O-N 3.26Å; Y475-F534 AromaticContact CD1-CE2 3.66Å; Y475-F534 HydrophobicContact CD1-CE2 3.66Å; Y475-F534 AromaticContact CD1-CZ 3.76Å; Y475-F534 HydrophobicContact CD1-CZ 3.76Å; Y475-F534 HydrophobicContact CE1-CD2 4.27Å; Y475-F534 AromaticContact CE1-CE2 3.57Å; Y475-F534 HydrophobicContact CE1-CE2 3.57Å; Y475-F534 AromaticContact CE1-CZ 3.82Å; Y475-F534 HydrophobicContact CE1-CZ 3.82Å; Y475-R537 WeakPolarHBondContact OH-CG 3.5Å; Y475-R537 PolarHBondContact OH-O 2.84Å; Y475-R538 HydrophobicContact CE1-CB 4.02Å; Y475-R538 WeakPolarHBondContact OH-CA 3.35Å; Y475-R538 PolarHBondContact OH-N 3.06Å; Y475-D541 HydrophobicContact CE2-CB 3.88Å; Y475-D541 PolarHBondContact OH-OD2 3.09Å; Y475-F542 HydrophobicContact CD1-CE2 4.14Å; Y475-F542 AromaticContact CD2-CE2 3.69Å; Y475-F542 HydrophobicContact CD2-CE2 3.69Å; Y475-F542 HydrophobicContact CD2-CZ 4.45Å; Y475-F542 HydrophobicContact CE1-CE2 4.36Å; Y475-F542 HydrophobicContact CE2-CD2 4.37Å; Y475-F542 AromaticContact CE2-CE2 3.94Å; Y475-F542 HydrophobicContact CE2-CE2 3.94Å; Y475-F542 AromaticContact CG-CE2 3.82Å; Y475-F542 HydrophobicContact CG-CE2 3.82Å; Y475-F542 HydrophobicContact CG-CZ 4.39Å
476	Q	96.6	Very high	96.2	Very high	51 Å²	51	26.4 Å²	26.4	24%	0.238	15%	0.148	C	C	.	.	H	α-helix	trans	-61	-43.5	171.7	-65.9	-177.3	-85.5	0	0	111.6	V392 L472 L479 S480	V392-Q476 HydrophobicContact CG1-CG 3.52Å; L472-Q476 WeakPolarHBondContact O-CG 3.27Å; L472-Q476 PolarHBondContact O-N 2.81Å; Q476-L479 PolarHBondContact O-N 2.95Å; Q476-S480 WeakPolarHBondContact O-CB 3.34Å; Q476-S480 PolarHBondContact O-N 2.7Å
477	G	95.6	Very high	96	Very high	6 Å²	6	28.5 Å²	28.5	6%	0.062	16%	0.158	C	C	.	.	H	α-helix	trans	-59.2	-53	173.9	0	0	0	0	0	112.1	H288 S473 L474 L479 S480	H288-G477 PolarHBondContact NE2-O 3.27Å; S473-G477 PolarHBondContact O-N 3.35Å; L474-G477 PolarHBondContact O-N 2.77Å; G477-L479 VanDerWaalsContact C-N 3.3Å; G477-L479 PolarHBondContact O-N 2.83Å; G477-S480 PolarHBondContact O-N 2.85Å; G477-S480 PolarHBondContact O-OG 3.45Å
478	L	97.1	Very high	95.8	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-60.3	-36.1	178.7	-66.7	171.2	0	0	0	113.3	S285 P287 L474 Y475 F482 F534	S285-L478 WeakPolarHBondContact O-CD2 3.34Å; S285-L478 WeakPolarHBondContact OG-CA 3.47Å; S285-L478 PolarHBondContact OG-O 3.4Å; P287-L478 HydrophobicContact CB-CD2 4.07Å; L474-L478 HydrophobicContact CD1-CD1 4.36Å; L474-L478 HydrophobicContact CG-CD1 4.03Å; L474-L478 WeakPolarHBondContact O-CG 3.32Å; L474-L478 PolarHBondContact O-N 2.94Å; Y475-L478 HydrophobicContact CD1-CD1 4.35Å; Y475-L478 HydrophobicContact CE1-CD1 4.18Å; Y475-L478 PolarHBondContact O-N 3.15Å; L478-F482 WeakPolarHBondContact O-CD2 3.38Å; L478-F482 WeakPolarHBondContact O-CE2 3.27Å; L478-F534 HydrophobicContact CB-CD2 4.4Å; L478-F534 HydrophobicContact CB-CE2 3.98Å; L478-F534 HydrophobicContact CD1-CE2 4.44Å
479	L	97.3	Very high	95.5	Very high	6 Å²	6	24.1 Å²	24.1	3%	0.031	14%	0.138	C	C	.	.	H	α-helix	trans	-71.6	-38.1	178.3	-74.3	165.3	0	0	0	112	M388 D389 V392 Y475 Q476 G477 N481 F482 P483 F534	M388-L479 HydrophobicContact CB-CD1 4.24Å; M388-L479 HydrophobicContact CB-CD2 4.31Å; M388-L479 HydrophobicContact CE-CD1 4.28Å; M388-L479 HydrophobicContact CG-CD1 3.84Å; M388-L479 HydrophobicContact CG-CD2 4.43Å; M388-L479 HydrophobicContact SD-CD1 4.17Å; M388-L479 HydrophobicContact SD-CD2 4.19Å; D389-L479 HydrophobicContact CB-CB 4.27Å; D389-L479 HydrophobicContact CB-CD1 4.08Å; V392-L479 HydrophobicContact CG2-CD1 4.39Å; Y475-L479 VanDerWaalsContact O-CB 3.25Å; Y475-L479 WeakPolarHBondContact O-CB 3.37Å; Y475-L479 WeakPolarHBondContact O-CD1 3.42Å; Y475-L479 WeakPolarHBondContact O-CG 3.29Å; Y475-L479 PolarHBondContact O-N 3.26Å; Q476-L479 PolarHBondContact O-N 2.95Å; G477-L479 VanDerWaalsContact C-N 3.3Å; G477-L479 PolarHBondContact O-N 2.83Å; L479-N481 PolarHBondContact O-N 2.83Å; L479-F482 PolarHBondContact O-N 3.22Å; L479-P483 VanDerWaalsContact O-CD 3.29Å; L479-P483 WeakPolarHBondContact O-CD 3.43Å; L479-F534 HydrophobicContact CD2-CE1 4.36Å; L479-F534 HydrophobicContact CD2-CE2 4.39Å; L479-F534 HydrophobicContact CD2-CZ 3.7Å; L479-F534 HydrophobicContact CG-CZ 4.12Å
480	S	96.1	Very high	95.3	Very high	61 Å²	61	25.7 Å²	25.7	43%	0.427	14%	0.144	S	C	.	.	H	α-helix	trans	-63.2	-20.9	179.1	75.5	0	0	0	0	114.7	H288 Q476 G477 P483	H288-S480 PolarHBondContact CE1-OG 3.44Å; H288-S480 PolarHBondContact NE2-OG 3.42Å; Q476-S480 WeakPolarHBondContact O-CB 3.34Å; Q476-S480 PolarHBondContact O-N 2.7Å; G477-S480 PolarHBondContact O-N 2.85Å; G477-S480 PolarHBondContact O-OG 3.45Å; S480-P483 WeakPolarHBondContact O-CD 3.31Å
481	N	95.6	Very high	95	Very high	25 Å²	25	26.1 Å²	26.1	13%	0.134	15%	0.149	C	C	.	.	H	α-helix	trans	-75.7	-33.7	176.7	-61.9	-28.5	0	0	0	112.8	S285 V286 H288 L479 D484 I485	S285-N481 WeakPolarHBondContact OG-CB 3.39Å; S285-N481 PolarHBondContact OG-ND2 2.66Å; V286-N481 PolarHBondContact N-ND2 2.82Å; V286-N481 PolarHBondContact O-ND2 3.43Å; H288-N481 PolarHBondContact NE2-OD1 3.02Å; L479-N481 PolarHBondContact O-N 2.83Å; N481-D484 PolarHBondContact O-N 2.81Å; N481-I485 HydrophobicContact CB-CD1 4.21Å; N481-I485 WeakPolarHBondContact O-CG1 3.4Å; N481-I485 PolarHBondContact O-N 2.82Å
482	F	96	Very high	94.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.8	-34	-170.3	-77.4	-68	0	0	0	116	F381 L478 L479 D484 I485 I486 E530 F534	F381-F482 HydrophobicContact CE1-CB 4.31Å; F381-F482 AromaticContact CE1-CD1 3.6Å; F381-F482 HydrophobicContact CE1-CD1 3.6Å; F381-F482 HydrophobicContact CE1-CD2 4.2Å; F381-F482 AromaticContact CE1-CE1 3.88Å; F381-F482 HydrophobicContact CE1-CE1 3.88Å; F381-F482 HydrophobicContact CE1-CE2 4.44Å; F381-F482 AromaticContact CE1-CG 3.78Å; F381-F482 HydrophobicContact CE1-CG 3.78Å; F381-F482 HydrophobicContact CE1-CZ 4.3Å; F381-F482 HydrophobicContact CZ-CD1 4.09Å; F381-F482 HydrophobicContact CZ-CD2 4.22Å; F381-F482 AromaticContact CZ-CE1 3.93Å; F381-F482 HydrophobicContact CZ-CE1 3.93Å; F381-F482 HydrophobicContact CZ-CE2 4.08Å; F381-F482 HydrophobicContact CZ-CG 4.24Å; F381-F482 AromaticContact CZ-CZ 3.93Å; F381-F482 HydrophobicContact CZ-CZ 3.93Å; L478-F482 WeakPolarHBondContact O-CD2 3.38Å; L478-F482 WeakPolarHBondContact O-CE2 3.27Å; L479-F482 PolarHBondContact O-N 3.22Å; F482-D484 VanDerWaalsContact C-N 3.29Å; F482-D484 PolarHBondContact O-N 2.98Å; F482-I485 HydrophobicContact CD1-CD1 4.42Å; F482-I485 PolarHBondContact O-N 3.04Å; F482-I486 HydrophobicContact CB-CD1 4.09Å; F482-I486 VanDerWaalsContact O-CB 3.27Å; F482-I486 WeakPolarHBondContact O-CB 3.47Å; F482-I486 WeakPolarHBondContact O-CD1 3.27Å; F482-I486 WeakPolarHBondContact O-CG1 3.37Å; F482-I486 PolarHBondContact O-N 2.88Å; F482-E530 HydrophobicContact CE1-CG 4.14Å; F482-E530 HydrophobicContact CZ-CG 4.42Å; F482-F534 HydrophobicContact CE2-CB 4.39Å; F482-F534 HydrophobicContact CE2-CD1 4.45Å; F482-F534 AromaticContact CE2-CD2 3.65Å; F482-F534 HydrophobicContact CE2-CD2 3.65Å; F482-F534 AromaticContact CE2-CE2 3.98Å; F482-F534 HydrophobicContact CE2-CE2 3.98Å; F482-F534 AromaticContact CE2-CG 3.9Å; F482-F534 HydrophobicContact CE2-CG 3.9Å; F482-F534 HydrophobicContact CZ-CB 3.97Å; F482-F534 HydrophobicContact CZ-CD2 4.06Å; F482-F534 AromaticContact CZ-CG 3.98Å; F482-F534 HydrophobicContact CZ-CG 3.98Å
483	P	95.3	Very high	94.5	Very high	82 Å²	82	25.5 Å²	25.5	53%	0.532	15%	0.145	S	C	.	.	H	α-helix	trans	-53.3	-43.4	175	-29.8	36.4	0	0	0	113.7	L479 S480 H487	L479-P483 VanDerWaalsContact O-CD 3.29Å; L479-P483 WeakPolarHBondContact O-CD 3.43Å; S480-P483 WeakPolarHBondContact O-CD 3.31Å; P483-H487 WeakPolarHBondContact O-CB 3.39Å; P483-H487 PolarHBondContact O-N 2.83Å; P483-H487 VanDerWaalsContact O-N 3.14Å
484	D	91.8	Very high	94.3	Very high	77 Å²	77	26.4 Å²	26.4	41%	0.412	15%	0.154	S	C	.	.	H	α-helix	trans	-69.4	-50	176.8	-96.9	16.7	0	0	0	110.8	C188 R191 N481 F482 I486 H487 L488	C188-D484 PolarHBondContact SG-OD2 2.81Å; R191-D484 IonicContact NH2-OD2 2.75Å; N481-D484 PolarHBondContact O-N 2.81Å; F482-D484 VanDerWaalsContact C-N 3.29Å; F482-D484 PolarHBondContact O-N 2.98Å; D484-I486 VanDerWaalsContact C-N 3.32Å; D484-I486 PolarHBondContact O-N 2.78Å; D484-H487 WeakPolarHBondContact O-CA 3.2Å; D484-H487 VanDerWaalsContact O-CB 3.31Å; D484-H487 WeakPolarHBondContact O-CB 3.45Å; D484-H487 PolarHBondContact O-N 2.93Å; D484-L488 WeakPolarHBondContact O-CG 3.42Å; D484-L488 PolarHBondContact O-N 3.13Å
485	I	92.9	Very high	94	Very high	10 Å²	10	26.7 Å²	26.7	5%	0.051	16%	0.155	C	C	.	.	H	α-helix	trans	-59	-41.9	-179.1	-57.4	167.8	0	0	0	111.5	V283 N481 F482 H487 L488 Q489 L527	V283-I485 HydrophobicContact CB-CG2 4.38Å; N481-I485 HydrophobicContact CB-CD1 4.21Å; N481-I485 WeakPolarHBondContact O-CG1 3.4Å; N481-I485 PolarHBondContact O-N 2.82Å; F482-I485 HydrophobicContact CD1-CD1 4.42Å; F482-I485 PolarHBondContact O-N 3.04Å; I485-H487 VanDerWaalsContact C-N 3.31Å; I485-H487 PolarHBondContact O-N 2.97Å; I485-L488 WeakPolarHBondContact O-CB 3.34Å; I485-L488 PolarHBondContact O-N 3.03Å; I485-L488 VanDerWaalsContact O-N 3.16Å; I485-Q489 PolarHBondContact O-N 2.77Å; I485-L527 HydrophobicContact CG2-CD1 3.78Å
486	I	94.2	Very high	93.7	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-66	-34.9	176.3	-68.4	165	0	0	0	111.1	V378 F381 K382 F482 D484 L488 Q489 K490	V378-I486 HydrophobicContact CG1-CG2 3.83Å; F381-I486 HydrophobicContact CD1-CD1 3.96Å; F381-I486 HydrophobicContact CE1-CD1 4.3Å; K382-I486 HydrophobicContact CB-CD1 4Å; K382-I486 HydrophobicContact CB-CG2 4.32Å; K382-I486 HydrophobicContact CD-CG2 4.14Å; K382-I486 HydrophobicContact CG-CD1 4.25Å; K382-I486 HydrophobicContact CG-CG2 4.25Å; F482-I486 HydrophobicContact CB-CD1 4.09Å; F482-I486 VanDerWaalsContact O-CB 3.27Å; F482-I486 WeakPolarHBondContact O-CB 3.47Å; F482-I486 WeakPolarHBondContact O-CD1 3.27Å; F482-I486 WeakPolarHBondContact O-CG1 3.37Å; F482-I486 PolarHBondContact O-N 2.88Å; D484-I486 VanDerWaalsContact C-N 3.32Å; D484-I486 PolarHBondContact O-N 2.78Å; I486-L488 VanDerWaalsContact C-N 3.33Å; I486-Q489 PolarHBondContact O-N 3.3Å; I486-K490 PolarHBondContact O-N 2.86Å
487	H	92.4	Very high	93.5	Very high	91 Å²	91	29.8 Å²	29.8	42%	0.421	17%	0.168	S	C	.	.	H	α-helix	trans	-65.6	-35.5	172.9	-174.7	82.2	0	0	0	111.9	P483 D484 I485 K490 G491	P483-H487 WeakPolarHBondContact O-CB 3.39Å; P483-H487 PolarHBondContact O-N 2.83Å; P483-H487 VanDerWaalsContact O-N 3.14Å; D484-H487 WeakPolarHBondContact O-CA 3.2Å; D484-H487 VanDerWaalsContact O-CB 3.31Å; D484-H487 WeakPolarHBondContact O-CB 3.45Å; D484-H487 PolarHBondContact O-N 2.93Å; I485-H487 VanDerWaalsContact C-N 3.31Å; I485-H487 PolarHBondContact O-N 2.97Å; H487-K490 PolarHBondContact O-N 3.25Å; H487-G491 PolarHBondContact O-N 2.93Å
488	L	90.9	Very high	93.4	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.016	18%	0.176	C	C	.	.	H	α-helix	trans	-59.8	-48.7	173.9	-52.1	-175.1	0	0	0	111.5	C188 F189 S192 V194 T282 V283 D484 I485 I486 K490 G491 A492	C188-L488 HydrophobicContact CB-CD2 4.4Å; C188-L488 WeakPolarHBondContact O-CD2 3.2Å; F189-L488 HydrophobicContact CB-CD2 4.45Å; F189-L488 WeakPolarHBondContact CE2-O 3.34Å; S192-L488 VanDerWaalsContact OG-CD2 3.27Å; S192-L488 WeakPolarHBondContact OG-CD2 3.44Å; V194-L488 HydrophobicContact CG2-CB 4.38Å; V194-L488 HydrophobicContact CG2-CD1 3.95Å; T282-L488 VanDerWaalsContact O-CD1 3.3Å; T282-L488 WeakPolarHBondContact O-CD1 3.41Å; V283-L488 HydrophobicContact CG1-CD1 4.37Å; D484-L488 WeakPolarHBondContact O-CG 3.42Å; D484-L488 PolarHBondContact O-N 3.13Å; I485-L488 WeakPolarHBondContact O-CB 3.34Å; I485-L488 PolarHBondContact O-N 3.03Å; I485-L488 VanDerWaalsContact O-N 3.16Å; I486-L488 VanDerWaalsContact C-N 3.33Å; L488-K490 PolarHBondContact O-N 3.42Å; L488-G491 PolarHBondContact O-N 3.07Å; L488-A492 PolarHBondContact O-N 3.31Å
489	Q	91.3	Very high	93.1	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-66.2	-37.9	179.1	-177.4	58.9	27.7	0	0	112.3	V378 I485 I486 A492 F493 V523 G524 L527	V378-Q489 HydrophobicContact CG2-CG 4.39Å; I485-Q489 PolarHBondContact O-N 2.77Å; I486-Q489 PolarHBondContact O-N 3.3Å; Q489-A492 WeakPolarHBondContact O-CB 3.2Å; Q489-A492 PolarHBondContact O-N 3.42Å; Q489-F493 HydrophobicContact CG-CD2 3.94Å; Q489-F493 HydrophobicContact CG-CE2 3.53Å; Q489-F493 HydrophobicContact CG-CZ 4.11Å; Q489-F493 WeakPolarHBondContact O-CD2 3.36Å; Q489-F493 PolarHBondContact O-N 2.98Å; Q489-V523 VanDerWaalsContact OE1-C 3.26Å; Q489-V523 VanDerWaalsContact OE1-CB 3.3Å; Q489-G524 VanDerWaalsContact OE1-N 3.11Å; Q489-L527 HydrophobicContact CB-CD2 3.6Å; Q489-L527 HydrophobicContact CG-CD2 3.96Å
490	K	92.4	Very high	92.8	Very high	52 Å²	52	33.7 Å²	33.7	23%	0.226	19%	0.185	C	C	.	.	H	α-helix	trans	-66.6	-35.6	174.6	-77.6	-171.7	168.7	-66.8	0	113	D379 I486 H487 L488 F493 A494	D379-K490 VanDerWaalsContact CG-CE 3.44Å; D379-K490 WeakPolarHBondContact OD1-CE 3.23Å; D379-K490 IonicContact OD1-NZ 2.75Å; D379-K490 PolarHBondContact OD1-NZ 2.97Å; D379-K490 WeakPolarHBondContact OD2-CE 3.45Å; D379-K490 IonicContact OD2-NZ 3.54Å; D379-K490 PolarHBondContact OD2-NZ 3.4Å; I486-K490 PolarHBondContact O-N 2.86Å; H487-K490 PolarHBondContact O-N 3.25Å; L488-K490 PolarHBondContact O-N 3.42Å; K490-F493 PolarHBondContact O-N 3.01Å; K490-A494 WeakPolarHBondContact O-CB 3.2Å; K490-A494 PolarHBondContact O-N 2.99Å
491	G	91.3	Very high	92.6	Very high	13 Å²	13	36.9 Å²	36.9	13%	0.134	19%	0.188	C	C	.	.	H	α-helix	trans	-60.3	-44.5	169	0	0	0	0	0	112	F189 H487 L488 A494 K495	F189-G491 VanDerWaalsContact CE2-C 3.48Å; H487-G491 PolarHBondContact O-N 2.93Å; L488-G491 PolarHBondContact O-N 3.07Å; G491-A494 PolarHBondContact O-N 2.96Å; G491-K495 WeakPolarHBondContact O-CG 3.03Å; G491-K495 PolarHBondContact O-N 3.31Å
492	A	91.8	Very high	92.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.9	-43.3	176.6	0	0	0	0	0	112.8	I198 L488 Q489 K495 V496 C520	I198-A492 HydrophobicContact CD1-CB 3.7Å; I198-A492 HydrophobicContact CG1-CB 3.86Å; L488-A492 PolarHBondContact O-N 3.31Å; Q489-A492 WeakPolarHBondContact O-CB 3.2Å; Q489-A492 PolarHBondContact O-N 3.42Å; A492-K495 PolarHBondContact O-N 3.36Å; A492-V496 PolarHBondContact O-N 3.46Å; A492-V496 VanDerWaalsContact O-N 3.09Å; A492-C520 HydrophobicContact CB-CB 4.44Å
493	F	92.9	Very high	92	Very high	4 Å²	4	37 Å²	37	2%	0.018	19%	0.19	C	C	.	.	H	α-helix	trans	-62	-43	173.8	-73.3	-49.6	0	0	0	112.6	L371 V374 E375 Q489 K490 K495 V496 K497	L371-F493 HydrophobicContact CB-CE1 4.36Å; L371-F493 HydrophobicContact CD2-CE1 4.22Å; V374-F493 HydrophobicContact CB-CZ 4.06Å; V374-F493 HydrophobicContact CG1-CZ 3.89Å; E375-F493 HydrophobicContact CB-CD2 4.09Å; E375-F493 HydrophobicContact CB-CE1 4.48Å; E375-F493 HydrophobicContact CB-CE2 3.69Å; E375-F493 HydrophobicContact CB-CZ 3.9Å; E375-F493 HydrophobicContact CG-CD2 3.88Å; E375-F493 HydrophobicContact CG-CE2 3.91Å; Q489-F493 HydrophobicContact CG-CD2 3.94Å; Q489-F493 HydrophobicContact CG-CE2 3.53Å; Q489-F493 HydrophobicContact CG-CZ 4.11Å; Q489-F493 WeakPolarHBondContact O-CD2 3.36Å; Q489-F493 PolarHBondContact O-N 2.98Å; K490-F493 PolarHBondContact O-N 3.01Å; F493-K495 VanDerWaalsContact C-N 3.3Å; F493-K495 PolarHBondContact O-N 3.42Å; F493-V496 PolarHBondContact O-N 3.24Å; F493-K497 WeakPolarHBondContact O-CG 3.49Å; F493-K497 PolarHBondContact O-N 3.5Å
494	A	92.6	Very high	91.8	Very high	53 Å²	53	38.6 Å²	38.6	44%	0.438	19%	0.194	S	C	.	.	H	α-helix	trans	-59	-42.1	175.7	0	0	0	0	0	111.4	K490 G491 K497 E498	K490-A494 WeakPolarHBondContact O-CB 3.2Å; K490-A494 PolarHBondContact O-N 2.99Å; G491-A494 PolarHBondContact O-N 2.96Å; A494-K497 PolarHBondContact O-N 2.77Å; A494-E498 WeakPolarHBondContact O-CB 3.4Å; A494-E498 PolarHBondContact O-N 2.78Å
495	K	91.5	Very high	91.8	Very high	21 Å²	21	39 Å²	39	9%	0.091	19%	0.193	C	C	.	.	H	α-helix	trans	-66.1	-35	177	-67.8	-68.9	152.4	-159.6	0	113.6	V179 G180 F189 E195 I198 L199 G491 A492 F493 E498 S499 I516	V179-K495 HydrophobicContact CG1-CD 3.48Å; V179-K495 VanDerWaalsContact CG1-CD 3.48Å; G180-K495 PolarHBondContact O-NZ 3Å; F189-K495 HydrophobicContact CE1-CG 4.11Å; F189-K495 HydrophobicContact CZ-CG 4.01Å; E195-K495 VanDerWaalsContact OE1-CE 3.23Å; E195-K495 WeakPolarHBondContact OE1-CE 3.07Å; E195-K495 IonicContact OE1-NZ 3.33Å; I198-K495 HydrophobicContact CG2-CB 3.81Å; I198-K495 HydrophobicContact CG2-CG 4.38Å; L199-K495 HydrophobicContact CD2-CD 4.49Å; G491-K495 WeakPolarHBondContact O-CG 3.03Å; G491-K495 PolarHBondContact O-N 3.31Å; A492-K495 PolarHBondContact O-N 3.36Å; F493-K495 VanDerWaalsContact C-N 3.3Å; F493-K495 PolarHBondContact O-N 3.42Å; K495-E498 IonicContact NZ-OE1 3.97Å; K495-E498 IonicContact NZ-OE2 2.76Å; K495-E498 PolarHBondContact NZ-OE2 2.95Å; K495-E498 PolarHBondContact O-N 2.96Å; K495-S499 WeakPolarHBondContact O-CB 3.42Å; K495-S499 PolarHBondContact O-N 3.24Å; K495-S499 PolarHBondContact O-OG 2.97Å; K495-I516 HydrophobicContact CB-CG2 4.5Å
496	V	92.9	Very high	91.7	Very high	8 Å²	8	41.8 Å²	41.8	5%	0.048	22%	0.224	C	C	.	.	H	α-helix	trans	-67	-43.3	172.8	176.6	0	0	0	0	111.7	L371 A492 F493 E498 S499 Q500 I516 R517 C520	L371-V496 HydrophobicContact CD1-CG1 3.9Å; A492-V496 PolarHBondContact O-N 3.46Å; A492-V496 VanDerWaalsContact O-N 3.09Å; F493-V496 PolarHBondContact O-N 3.24Å; V496-E498 VanDerWaalsContact C-N 3.31Å; V496-E498 PolarHBondContact O-N 3.15Å; V496-S499 WeakPolarHBondContact CA-OG 3.31Å; V496-S499 PolarHBondContact O-N 3.45Å; V496-S499 PolarHBondContact O-OG 3.34Å; V496-S499 VanDerWaalsContact O-OG 3.04Å; V496-Q500 WeakPolarHBondContact O-CB 3.5Å; V496-Q500 PolarHBondContact O-N 3.45Å; V496-I516 HydrophobicContact CG2-CG2 4.1Å; V496-R517 HydrophobicContact CG1-CB 4.39Å; V496-R517 HydrophobicContact CG1-CG 4.26Å; V496-C520 HydrophobicContact CG2-CB 3.35Å
497	K	92.3	Very high	91.4	Very high	107 Å²	107	48 Å²	48	47%	0.465	25%	0.247	S	C	.	.	H	α-helix	trans	-64.3	-38.1	176.9	-68.6	172.1	-179.6	177.8	0	111.2	E375 F493 A494 R501	E375-K497 IonicContact OE1-NZ 3.57Å; E375-K497 PolarHBondContact OE1-NZ 3.5Å; E375-K497 IonicContact OE2-NZ 3.57Å; E375-K497 PolarHBondContact OE2-NZ 3.39Å; F493-K497 WeakPolarHBondContact O-CG 3.49Å; F493-K497 PolarHBondContact O-N 3.5Å; A494-K497 PolarHBondContact O-N 2.77Å; K497-R501 PolarHBondContact O-N 3.16Å
498	E	92.1	Very high	91.3	Very high	45 Å²	45	44.3 Å²	44.3	21%	0.21	23%	0.23	C	C	.	.	H	α-helix	trans	-67.5	-46.6	174.7	-165.2	-169.8	152.2	0	0	112.4	G180 A494 K495 V496 R501 M502	G180-E498 PolarHBondContact N-OE1 2.87Å; A494-E498 WeakPolarHBondContact O-CB 3.4Å; A494-E498 PolarHBondContact O-N 2.78Å; K495-E498 IonicContact NZ-OE1 3.97Å; K495-E498 IonicContact NZ-OE2 2.76Å; K495-E498 PolarHBondContact NZ-OE2 2.95Å; K495-E498 PolarHBondContact O-N 2.96Å; V496-E498 VanDerWaalsContact C-N 3.31Å; V496-E498 PolarHBondContact O-N 3.15Å; E498-R501 PolarHBondContact O-N 3.32Å; E498-M502 HydrophobicContact CG-CE 3.67Å; E498-M502 PolarHBondContact O-N 2.81Å; E498-M502 VanDerWaalsContact O-N 3.11Å; E498-M502 WeakPolarHBondContact OE1-CE 3.27Å
499	S	92.1	Very high	91.3	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.007	25%	0.252	C	S	.	.	H	α-helix	trans	-66.3	-39.6	-179.8	66.7	0	0	0	0	112.5	K495 V496 M502 S503	K495-S499 WeakPolarHBondContact O-CB 3.42Å; K495-S499 PolarHBondContact O-N 3.24Å; K495-S499 PolarHBondContact O-OG 2.97Å; V496-S499 WeakPolarHBondContact CA-OG 3.31Å; V496-S499 PolarHBondContact O-N 3.45Å; V496-S499 PolarHBondContact O-OG 3.34Å; V496-S499 VanDerWaalsContact O-OG 3.04Å; S499-M502 PolarHBondContact O-N 2.84Å; S499-S503 PolarHBondContact O-N 3.12Å
500	Q	90.4	Very high	91.2	Very high	49 Å²	49	53.5 Å²	53.5	23%	0.229	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-51.5	176.6	-172.5	60.5	55.7	0	0	110.5	V496 M502 S503 D504	V496-Q500 WeakPolarHBondContact O-CB 3.5Å; V496-Q500 PolarHBondContact O-N 3.45Å; Q500-M502 VanDerWaalsContact C-N 3.27Å; Q500-M502 PolarHBondContact O-N 2.82Å; Q500-S503 CarbonylContact O-C 3.6Å; Q500-S503 WeakPolarHBondContact O-CA 3.31Å; Q500-S503 VanDerWaalsContact O-CB 3.31Å; Q500-S503 WeakPolarHBondContact O-CB 3.18Å; Q500-S503 PolarHBondContact O-N 3.02Å; Q500-D504 PolarHBondContact NE2-OD1 3.09Å; Q500-D504 PolarHBondContact O-N 3.37Å
501	R	91.8	Very high	91.1	Very high	129 Å²	129	57.5 Å²	57.5	49%	0.487	31%	0.307	S	S	.	.	H	α-helix	trans	-56.4	-39.7	177.4	-176.5	-178.5	63.7	101.2	-5.8	112.4	K497 E498 S503 D504 E505	K497-R501 PolarHBondContact O-N 3.16Å; E498-R501 PolarHBondContact O-N 3.32Å; R501-S503 VanDerWaalsContact C-N 3.34Å; R501-D504 PolarHBondContact O-N 3.48Å; R501-E505 HydrophobicContact CG-CG 4.47Å; R501-E505 WeakPolarHBondContact CG-OE1 3.41Å; R501-E505 IonicContact CZ-OE1 2.7Å; R501-E505 IonicContact NE-OE1 3.71Å; R501-E505 IonicContact NH1-OE1 3.96Å; R501-E505 PolarHBondContact NH1-OE1 2.77Å; R501-E505 IonicContact NH1-OE2 3.25Å; R501-E505 WeakPolarHBondContact O-CB 3.18Å; R501-E505 VanDerWaalsContact O-CG 3.29Å; R501-E505 WeakPolarHBondContact O-CG 3.44Å; R501-E505 PolarHBondContact O-N 3.03Å
502	M	88.4	Confident	91	Very high	8 Å²	8	60.6 Å²	60.6	4%	0.039	32%	0.318	C	S	.	.	H	α-helix	trans	-71.5	-27.4	176.4	-67.7	-155.2	-129	0	0	113.6	V178 V179 E498 S499 Q500 G506 R507 M508	V178-M502 HydrophobicContact CG1-SD 4.06Å; V179-M502 HydrophobicContact CG2-CE 4.19Å; E498-M502 HydrophobicContact CG-CE 3.67Å; E498-M502 PolarHBondContact O-N 2.81Å; E498-M502 VanDerWaalsContact O-N 3.11Å; E498-M502 WeakPolarHBondContact OE1-CE 3.27Å; S499-M502 PolarHBondContact O-N 2.84Å; Q500-M502 VanDerWaalsContact C-N 3.27Å; Q500-M502 PolarHBondContact O-N 2.82Å; M502-G506 PolarHBondContact O-N 2.75Å; M502-R507 HydrophobicContact CB-CB 4.47Å; M502-R507 CarbonylContact O-C 3.41Å; M502-R507 WeakPolarHBondContact O-CA 3.22Å; M502-R507 WeakPolarHBondContact O-CB 3.5Å; M502-R507 PolarHBondContact O-N 3.42Å; M502-M508 HydrophobicContact CB-CB 4.05Å; M502-M508 PolarHBondContact O-N 3.48Å
503	S	91.5	Very high	90.9	Very high	20 Å²	20	60.6 Å²	60.6	14%	0.14	32%	0.318	C	S	.	.	H	α-helix	trans	-69.3	-41.9	169	-167.1	0	0	0	0	111.2	S499 Q500 R501 E505 G506	S499-S503 PolarHBondContact O-N 3.12Å; Q500-S503 CarbonylContact O-C 3.6Å; Q500-S503 WeakPolarHBondContact O-CA 3.31Å; Q500-S503 VanDerWaalsContact O-CB 3.31Å; Q500-S503 WeakPolarHBondContact O-CB 3.18Å; Q500-S503 PolarHBondContact O-N 3.02Å; R501-S503 VanDerWaalsContact C-N 3.34Å; S503-E505 VanDerWaalsContact C-N 3.34Å; S503-G506 PolarHBondContact O-N 3.37Å
504	D	90.9	Very high	90.8	Very high	115 Å²	115	62.7 Å²	62.7	62%	0.615	33%	0.329	S	S	*	.	H	α-helix	trans	-67.9	-33.7	178.6	-52.6	-27.7	0	0	0	111.7	Q500 R501 G506	Q500-D504 PolarHBondContact NE2-OD1 3.09Å; Q500-D504 PolarHBondContact O-N 3.37Å; R501-D504 PolarHBondContact O-N 3.48Å; D504-G506 PolarHBondContact O-N 3.22Å
505	E	92.3	Very high	90.7	Very high	86 Å²	86	60.8 Å²	60.8	40%	0.402	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-1.7	169.8	-73.7	171.6	-165.1	0	0	113.6	R501 S503 R507	R501-E505 HydrophobicContact CG-CG 4.47Å; R501-E505 WeakPolarHBondContact CG-OE1 3.41Å; R501-E505 IonicContact CZ-OE1 2.7Å; R501-E505 IonicContact NE-OE1 3.71Å; R501-E505 IonicContact NH1-OE1 3.96Å; R501-E505 PolarHBondContact NH1-OE1 2.77Å; R501-E505 IonicContact NH1-OE2 3.25Å; R501-E505 WeakPolarHBondContact O-CB 3.18Å; R501-E505 VanDerWaalsContact O-CG 3.29Å; R501-E505 WeakPolarHBondContact O-CG 3.44Å; R501-E505 PolarHBondContact O-N 3.03Å; S503-E505 VanDerWaalsContact C-N 3.34Å; E505-R507 VanDerWaalsContact C-N 3.25Å; E505-R507 HydrophobicContact CB-CG 4.1Å; E505-R507 PolarHBondContact O-N 2.92Å; E505-R507 VanDerWaalsContact OE2-CD 3.32Å; E505-R507 WeakPolarHBondContact OE2-CD 3.46Å; E505-R507 IonicContact OE2-CZ 2.79Å; E505-R507 IonicContact OE2-NE 4Å; E505-R507 IonicContact OE2-NH1 3.52Å; E505-R507 PolarHBondContact OE2-NH1 3.31Å
506	G	89.2	Confident	90.7	Very high	67 Å²	67	59.9 Å²	59.9	69%	0.691	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	16.9	-178.3	0	0	0	0	0	114.7	M502 S503 D504	M502-G506 PolarHBondContact O-N 2.75Å; S503-G506 PolarHBondContact O-N 3.37Å; D504-G506 PolarHBondContact O-N 3.22Å
507	R	88.4	Confident	90.6	Very high	136 Å²	136	63.2 Å²	63.2	51%	0.513	32%	0.323	S	S	.	.	S	Bend	trans	-98	-19	-175.2	-65.5	168.3	61.5	-146.4	-7.8	113.5	M502 E505	M502-R507 HydrophobicContact CB-CB 4.47Å; M502-R507 CarbonylContact O-C 3.41Å; M502-R507 WeakPolarHBondContact O-CA 3.22Å; M502-R507 WeakPolarHBondContact O-CB 3.5Å; M502-R507 PolarHBondContact O-N 3.42Å; E505-R507 VanDerWaalsContact C-N 3.25Å; E505-R507 HydrophobicContact CB-CG 4.1Å; E505-R507 PolarHBondContact O-N 2.92Å; E505-R507 VanDerWaalsContact OE2-CD 3.32Å; E505-R507 WeakPolarHBondContact OE2-CD 3.46Å; E505-R507 IonicContact OE2-CZ 2.79Å; E505-R507 IonicContact OE2-NE 4Å; E505-R507 IonicContact OE2-NH1 3.52Å; E505-R507 PolarHBondContact OE2-NH1 3.31Å
508	M	89.6	Confident	90.6	Very high	12 Å²	12	64.9 Å²	64.9	6%	0.059	33%	0.327	C	S	.	.	S	Bend	trans	-125	147.8	175.9	170.4	167.4	-78	0	0	109.7	V178 V179 M502 E512 A513 I516	V178-M508 HydrophobicContact CB-CE 3.99Å; V179-M508 HydrophobicContact CB-CE 4.35Å; V179-M508 HydrophobicContact CG2-CE 3.62Å; V179-M508 HydrophobicContact CG2-SD 4.26Å; M502-M508 HydrophobicContact CB-CB 4.05Å; M502-M508 PolarHBondContact O-N 3.48Å; M508-E512 HydrophobicContact CE-CG 3.96Å; M508-E512 WeakPolarHBondContact CE-OE1 3.37Å; M508-E512 HydrophobicContact CG-CB 4.01Å; M508-E512 HydrophobicContact CG-CG 4.36Å; M508-E512 HydrophobicContact SD-CB 4.24Å; M508-E512 HydrophobicContact SD-CG 4.16Å; M508-A513 HydrophobicContact CG-CB 4.44Å; M508-A513 HydrophobicContact SD-CB 3.97Å; M508-I516 HydrophobicContact CE-CD1 4.19Å; M508-I516 HydrophobicContact SD-CD1 4.17Å
509	A	91.9	Very high	90.6	Very high	58 Å²	58	65.9 Å²	65.9	48%	0.479	33%	0.328	S	S	.	.			trans	-74	139.2	172.9	0	0	0	0	0	110.9	D511 E512 A513	A509-D511 VanDerWaalsContact C-N 3.27Å; A509-D511 PolarHBondContact O-N 2.93Å; A509-E512 WeakPolarHBondContact O-CB 3.44Å; A509-E512 PolarHBondContact O-N 2.94Å; A509-A513 PolarHBondContact O-N 3.41Å
510	Q	89.1	Confident	90.6	Very high	140 Å²	140	65.9 Å²	65.9	65%	0.654	33%	0.328	S	S	*	.	H	α-helix	trans	-57.9	-39	-177.3	-171.5	172.9	-9.2	0	0	112.3	E512 A513 D514	Q510-E512 PolarHBondContact O-N 2.88Å; Q510-A513 PolarHBondContact O-N 2.94Å; Q510-D514 WeakPolarHBondContact O-CB 3.5Å; Q510-D514 PolarHBondContact O-N 3.19Å
511	D	90.1	Very high	90.7	Very high	136 Å²	136	65.8 Å²	65.8	73%	0.727	33%	0.326	S	S	*	.	H	α-helix	trans	-59	-31	175.1	-68.8	-45.7	0	0	0	113.8	A509 G515	A509-D511 VanDerWaalsContact C-N 3.27Å; A509-D511 PolarHBondContact O-N 2.93Å; D511-G515 PolarHBondContact O-N 3.15Å
512	E	89.3	Confident	90.7	Very high	77 Å²	77	60.6 Å²	60.6	36%	0.36	31%	0.308	S	S	.	.	H	α-helix	trans	-75.9	-45.2	179.2	-169.9	178.6	170.5	0	0	110.7	M508 A509 Q510 D514 G515 I516	M508-E512 HydrophobicContact CE-CG 3.96Å; M508-E512 WeakPolarHBondContact CE-OE1 3.37Å; M508-E512 HydrophobicContact CG-CB 4.01Å; M508-E512 HydrophobicContact CG-CG 4.36Å; M508-E512 HydrophobicContact SD-CB 4.24Å; M508-E512 HydrophobicContact SD-CG 4.16Å; A509-E512 WeakPolarHBondContact O-CB 3.44Å; A509-E512 PolarHBondContact O-N 2.94Å; Q510-E512 PolarHBondContact O-N 2.88Å; E512-D514 VanDerWaalsContact C-N 3.29Å; E512-D514 PolarHBondContact O-N 3.03Å; E512-G515 WeakPolarHBondContact O-CA 3.39Å; E512-G515 PolarHBondContact O-N 3.3Å; E512-G515 VanDerWaalsContact O-N 3.15Å; E512-I516 WeakPolarHBondContact O-CG1 3.29Å; E512-I516 PolarHBondContact O-N 3.05Å
513	A	89.4	Confident	90.9	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.008	31%	0.307	C	S	.	.	H	α-helix	trans	-61.4	-37.9	171.7	0	0	0	0	0	111.7	M508 A509 Q510 I516 R517	M508-A513 HydrophobicContact CG-CB 4.44Å; M508-A513 HydrophobicContact SD-CB 3.97Å; A509-A513 PolarHBondContact O-N 3.41Å; Q510-A513 PolarHBondContact O-N 2.94Å; A513-I516 PolarHBondContact O-N 2.8Å; A513-R517 WeakPolarHBondContact O-CB 3.47Å; A513-R517 PolarHBondContact O-N 2.56Å
514	D	89.9	Confident	91	Very high	47 Å²	47	59.5 Å²	59.5	25%	0.251	30%	0.302	S	S	.	.	H	α-helix	trans	-67.9	-35.5	174.5	-126.8	38.6	0	0	0	112	Q510 E512 R517 R518	Q510-D514 WeakPolarHBondContact O-CB 3.5Å; Q510-D514 PolarHBondContact O-N 3.19Å; E512-D514 VanDerWaalsContact C-N 3.29Å; E512-D514 PolarHBondContact O-N 3.03Å; D514-R517 PolarHBondContact O-N 2.93Å; D514-R517 IonicContact OD1-NE 2.71Å; D514-R518 WeakPolarHBondContact O-CB 3.47Å; D514-R518 WeakPolarHBondContact O-CD 3.49Å; D514-R518 WeakPolarHBondContact O-CG 3.36Å; D514-R518 PolarHBondContact O-N 2.98Å; D514-R518 IonicContact OD2-CZ 2.72Å; D514-R518 IonicContact OD2-NE 3.58Å; D514-R518 IonicContact OD2-NH2 2.69Å; D514-R518 PolarHBondContact OD2-NH2 3.05Å
515	G	90.9	Very high	91.3	Very high	14 Å²	14	54.2 Å²	54.2	14%	0.144	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-46.1	169.8	0	0	0	0	0	112.6	D511 E512 R518 R519	D511-G515 PolarHBondContact O-N 3.15Å; E512-G515 WeakPolarHBondContact O-CA 3.39Å; E512-G515 PolarHBondContact O-N 3.3Å; E512-G515 VanDerWaalsContact O-N 3.15Å; G515-R518 PolarHBondContact O-N 3.24Å; G515-R519 WeakPolarHBondContact O-CG 3.37Å; G515-R519 PolarHBondContact O-N 3.43Å; G515-R519 VanDerWaalsContact O-N 3.08Å; G515-R519 PolarHBondContact O-NE 3.07Å
516	I	92.3	Very high	91.4	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-45.5	174.8	-67.2	168.8	0	0	0	110.3	V179 I198 L199 K495 V496 M508 E512 A513 R518 R519 C520	V179-I516 HydrophobicContact CG2-CD1 4.12Å; I198-I516 HydrophobicContact CG2-CG2 3.84Å; L199-I516 HydrophobicContact CD2-CD1 4.41Å; K495-I516 HydrophobicContact CB-CG2 4.5Å; V496-I516 HydrophobicContact CG2-CG2 4.1Å; M508-I516 HydrophobicContact CE-CD1 4.19Å; M508-I516 HydrophobicContact SD-CD1 4.17Å; E512-I516 WeakPolarHBondContact O-CG1 3.29Å; E512-I516 PolarHBondContact O-N 3.05Å; A513-I516 PolarHBondContact O-N 2.8Å; I516-R518 PolarHBondContact O-N 3.01Å; I516-R519 PolarHBondContact O-N 3.19Å; I516-C520 WeakPolarHBondContact O-CB 3.4Å; I516-C520 PolarHBondContact O-N 2.84Å
517	R	91.2	Very high	91.7	Very high	77 Å²	77	47 Å²	47	29%	0.291	22%	0.222	S	C	.	.	H	α-helix	trans	-59.5	-44.5	176.2	-168	-170.1	-72.9	-129.7	5.5	112.4	L371 V496 A513 D514 C520 R521	L371-R517 HydrophobicContact CD1-CG 4.18Å; V496-R517 HydrophobicContact CG1-CB 4.39Å; V496-R517 HydrophobicContact CG1-CG 4.26Å; A513-R517 WeakPolarHBondContact O-CB 3.47Å; A513-R517 PolarHBondContact O-N 2.56Å; D514-R517 PolarHBondContact O-N 2.93Å; D514-R517 IonicContact OD1-NE 2.71Å; R517-C520 PolarHBondContact O-N 3.33Å; R517-R521 PolarHBondContact O-N 2.91Å; R517-R521 VanDerWaalsContact O-N 3.11Å
518	R	90.8	Very high	92	Very high	143 Å²	143	40.8 Å²	40.8	54%	0.54	20%	0.199	S	C	.	.	H	α-helix	trans	-63.2	-42	177.5	-71.7	165	-157.6	-168.6	9.9	111.9	D514 G515 I516 R521 V522	D514-R518 WeakPolarHBondContact O-CB 3.47Å; D514-R518 WeakPolarHBondContact O-CD 3.49Å; D514-R518 WeakPolarHBondContact O-CG 3.36Å; D514-R518 PolarHBondContact O-N 2.98Å; D514-R518 IonicContact OD2-CZ 2.72Å; D514-R518 IonicContact OD2-NE 3.58Å; D514-R518 IonicContact OD2-NH2 2.69Å; D514-R518 PolarHBondContact OD2-NH2 3.05Å; G515-R518 PolarHBondContact O-N 3.24Å; I516-R518 PolarHBondContact O-N 3.01Å; R518-R521 WeakPolarHBondContact O-CB 3.45Å; R518-R521 PolarHBondContact O-N 3.14Å; R518-V522 PolarHBondContact O-N 3.13Å
519	R	92.2	Very high	92.4	Very high	66 Å²	66	40.2 Å²	40.2	25%	0.249	20%	0.196	C	C	.	.	H	α-helix	trans	-72.2	-34.6	178.4	-66.2	-179.6	-56.6	-108.5	-2.3	112.1	F197 I198 L199 G515 I516 R521 V522 V523	F197-R519 HydrophobicContact CD1-CB 4.2Å; F197-R519 HydrophobicContact CE1-CB 3.78Å; F197-R519 HydrophobicContact CE1-CG 4.34Å; F197-R519 WeakPolarHBondContact CE1-O 3.39Å; F197-R519 HydrophobicContact CZ-CB 4.27Å; F197-R519 HydrophobicContact CZ-CG 4.34Å; F197-R519 WeakPolarHBondContact O-CD 3.3Å; F197-R519 PolarHBondContact O-NE 3.39Å; I198-R519 HydrophobicContact CD1-CB 4.28Å; I198-R519 VanDerWaalsContact O-CZ 3.29Å; I198-R519 PolarHBondContact O-NE 3.36Å; I198-R519 PolarHBondContact O-NH2 3Å; L199-R519 PolarHBondContact O-NH2 2.75Å; G515-R519 WeakPolarHBondContact O-CG 3.37Å; G515-R519 PolarHBondContact O-N 3.43Å; G515-R519 VanDerWaalsContact O-N 3.08Å; G515-R519 PolarHBondContact O-NE 3.07Å; I516-R519 PolarHBondContact O-N 3.19Å; R519-R521 VanDerWaalsContact C-N 3.34Å; R519-R521 PolarHBondContact O-N 3.18Å; R519-V522 WeakPolarHBondContact O-CB 3.45Å; R519-V522 PolarHBondContact O-N 3.31Å; R519-V522 VanDerWaalsContact O-N 3.13Å; R519-V523 PolarHBondContact O-N 2.99Å
520	C	92.7	Very high	92.6	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.007	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-38.2	170.9	-173.9	0	0	0	0	112.9	I198 A492 V496 I516 R517 V522 V523 G524	I198-C520 VanDerWaalsContact CD1-CA 3.48Å; I198-C520 HydrophobicContact CD1-CB 4.02Å; A492-C520 HydrophobicContact CB-CB 4.44Å; V496-C520 HydrophobicContact CG2-CB 3.35Å; I516-C520 WeakPolarHBondContact O-CB 3.4Å; I516-C520 PolarHBondContact O-N 2.84Å; R517-C520 PolarHBondContact O-N 3.33Å; C520-V522 VanDerWaalsContact C-N 3.29Å; C520-V522 PolarHBondContact O-N 3.45Å; C520-V523 PolarHBondContact O-N 2.92Å; C520-G524 PolarHBondContact O-N 3.38Å
521	R	92	Very high	93	Very high	47 Å²	47	31.7 Å²	31.7	18%	0.177	15%	0.147	C	C	.	.	H	α-helix	trans	-58.4	-38	172	-75.6	174.5	66.6	-158.4	1.5	112.4	I364 T366 E367 L371 R517 R518 R519 V523 G524 F525	I364-R521 HydrophobicContact CD1-CB 4.36Å; T366-R521 PolarHBondContact O-NH2 2.92Å; E367-R521 PolarHBondContact O-NH2 2.99Å; L371-R521 HydrophobicContact CD2-CG 4.43Å; R517-R521 PolarHBondContact O-N 2.91Å; R517-R521 VanDerWaalsContact O-N 3.11Å; R518-R521 WeakPolarHBondContact O-CB 3.45Å; R518-R521 PolarHBondContact O-N 3.14Å; R519-R521 VanDerWaalsContact C-N 3.34Å; R519-R521 PolarHBondContact O-N 3.18Å; R521-V523 PolarHBondContact O-N 3.16Å; R521-G524 PolarHBondContact O-N 3.42Å; R521-F525 HydrophobicContact CB-CD2 4.32Å; R521-F525 HydrophobicContact CB-CE2 4.41Å; R521-F525 WeakPolarHBondContact O-CB 3.47Å; R521-F525 WeakPolarHBondContact O-CD2 3.4Å; R521-F525 PolarHBondContact O-N 2.9Å
522	V	93	Very high	93.4	Very high	19 Å²	19	26.2 Å²	26.2	12%	0.115	12%	0.117	C	C	.	.	H	α-helix	trans	-60.2	-46.9	178.6	177.7	0	0	0	0	111.7	F197 F362 I364 R518 R519 C520 A526	F197-V522 HydrophobicContact CE1-CB 4.17Å; F197-V522 HydrophobicContact CE1-CG1 4.37Å; F197-V522 HydrophobicContact CZ-CB 4.13Å; F197-V522 HydrophobicContact CZ-CG1 4.06Å; F197-V522 HydrophobicContact CZ-CG2 4.47Å; F362-V522 HydrophobicContact CB-CG1 3.92Å; F362-V522 HydrophobicContact CD2-CG1 3.92Å; F362-V522 HydrophobicContact CG-CG1 4.45Å; I364-V522 HydrophobicContact CD1-CG2 3.94Å; I364-V522 HydrophobicContact CG1-CG2 4.47Å; I364-V522 HydrophobicContact CG2-CB 4.49Å; I364-V522 HydrophobicContact CG2-CG1 4.42Å; I364-V522 HydrophobicContact CG2-CG2 4.34Å; R518-V522 PolarHBondContact O-N 3.13Å; R519-V522 WeakPolarHBondContact O-CB 3.45Å; R519-V522 PolarHBondContact O-N 3.31Å; R519-V522 VanDerWaalsContact O-N 3.13Å; C520-V522 VanDerWaalsContact C-N 3.29Å; C520-V522 PolarHBondContact O-N 3.45Å; V522-A526 WeakPolarHBondContact O-CB 3.48Å; V522-A526 PolarHBondContact O-N 3.07Å; V522-A526 VanDerWaalsContact O-N 3.11Å
523	V	92.9	Very high	93.7	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.012	10%	0.104	C	C	.	.	H	α-helix	trans	-66.9	-40.7	177.5	-168.5	0	0	0	0	111.1	V194 F197 I198 V283 L359 Q489 R519 C520 R521 A526 L527	V194-V523 HydrophobicContact CG1-CG2 4.19Å; F197-V523 HydrophobicContact CD1-CG2 4.18Å; F197-V523 HydrophobicContact CE1-CG2 4.09Å; I198-V523 HydrophobicContact CD1-CG2 4.01Å; V283-V523 HydrophobicContact CG1-CG1 4.23Å; L359-V523 HydrophobicContact CD1-CG2 3.96Å; Q489-V523 VanDerWaalsContact OE1-C 3.26Å; Q489-V523 VanDerWaalsContact OE1-CB 3.3Å; R519-V523 PolarHBondContact O-N 2.99Å; C520-V523 PolarHBondContact O-N 2.92Å; R521-V523 PolarHBondContact O-N 3.16Å; V523-A526 PolarHBondContact O-N 3.01Å; V523-L527 PolarHBondContact O-N 3.47Å
524	G	93.6	Very high	94.1	Very high	4 Å²	4	23.5 Å²	23.5	4%	0.041	10%	0.104	C	C	.	.	H	α-helix	trans	-67.4	-34.4	178.9	0	0	0	0	0	114.3	Q489 C520 R521 Q528	Q489-G524 VanDerWaalsContact OE1-N 3.11Å; C520-G524 PolarHBondContact O-N 3.38Å; R521-G524 PolarHBondContact O-N 3.42Å; G524-Q528 WeakPolarHBondContact O-CG 3.25Å; G524-Q528 PolarHBondContact O-N 2.79Å; G524-Q528 PolarHBondContact O-NE2 3.23Å
525	F	95.5	Very high	94.5	Very high	3 Å²	3	23 Å²	23	1%	0.013	10%	0.1	C	C	.	.	H	α-helix	trans	-68.5	-44	171.1	-86.3	-64.7	0	0	0	111.3	I214 M216 P221 I364 P365 E367 Q369 R521 Q528 A529	I214-F525 HydrophobicContact CD1-CB 4Å; I214-F525 HydrophobicContact CG2-CB 4.43Å; M216-F525 HydrophobicContact SD-CE1 4.03Å; P221-F525 HydrophobicContact CB-CD1 3.89Å; P221-F525 HydrophobicContact CG-CD1 3.58Å; P221-F525 HydrophobicContact CG-CE1 3.86Å; I364-F525 HydrophobicContact CB-CB 4.42Å; I364-F525 HydrophobicContact CB-CD2 3.77Å; I364-F525 HydrophobicContact CB-CE2 4.29Å; I364-F525 HydrophobicContact CB-CG 4.21Å; I364-F525 HydrophobicContact CD1-CD2 3.79Å; I364-F525 HydrophobicContact CD1-CE2 4.01Å; I364-F525 HydrophobicContact CG1-CD2 4.37Å; I364-F525 HydrophobicContact CG2-CB 3.74Å; I364-F525 HydrophobicContact CG2-CD2 3.86Å; I364-F525 HydrophobicContact CG2-CG 4.05Å; P365-F525 HydrophobicContact CB-CE1 4.38Å; P365-F525 HydrophobicContact CB-CZ 4.39Å; P365-F525 HydrophobicContact CG-CD1 4.39Å; P365-F525 HydrophobicContact CG-CE1 4.08Å; E367-F525 WeakPolarHBondContact O-CZ 3.42Å; Q369-F525 HydrophobicContact CG-CE1 4.34Å; Q369-F525 HydrophobicContact CG-CZ 4.29Å; R521-F525 HydrophobicContact CB-CD2 4.32Å; R521-F525 HydrophobicContact CB-CE2 4.41Å; R521-F525 WeakPolarHBondContact O-CB 3.47Å; R521-F525 WeakPolarHBondContact O-CD2 3.4Å; R521-F525 PolarHBondContact O-N 2.9Å; F525-Q528 PolarHBondContact O-N 3.45Å; F525-A529 WeakPolarHBondContact O-CB 3.46Å; F525-A529 PolarHBondContact O-N 3.31Å
526	A	95.1	Very high	94.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.4	-44.9	178.7	0	0	0	0	0	112.4	I214 W223 V283 F362 V522 V523 A529 E530	I214-A526 HydrophobicContact CD1-CB 4.12Å; W223-A526 HydrophobicContact CH2-CB 3.79Å; W223-A526 HydrophobicContact CZ2-CB 4.19Å; V283-A526 HydrophobicContact CG2-CB 4.02Å; F362-A526 HydrophobicContact CD2-CB 3.91Å; F362-A526 HydrophobicContact CE2-CB 3.47Å; F362-A526 VanDerWaalsContact CE2-CB 3.47Å; F362-A526 HydrophobicContact CZ-CB 4.28Å; V522-A526 WeakPolarHBondContact O-CB 3.48Å; V522-A526 PolarHBondContact O-N 3.07Å; V522-A526 VanDerWaalsContact O-N 3.11Å; V523-A526 PolarHBondContact O-N 3.01Å; A526-A529 PolarHBondContact O-N 2.94Å; A526-E530 WeakPolarHBondContact O-CB 3.44Å; A526-E530 PolarHBondContact O-N 2.98Å
527	L	95.4	Very high	95	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-64.8	-39.6	176.5	178.6	53.7	0	0	0	112.3	V378 I485 Q489 V523 E530 M531	V378-L527 HydrophobicContact CG1-CD2 4.23Å; V378-L527 HydrophobicContact CG2-CD2 3.84Å; V378-L527 HydrophobicContact CG2-CG 4.48Å; I485-L527 HydrophobicContact CG2-CD1 3.78Å; Q489-L527 HydrophobicContact CB-CD2 3.6Å; Q489-L527 HydrophobicContact CG-CD2 3.96Å; V523-L527 PolarHBondContact O-N 3.47Å; L527-E530 PolarHBondContact O-N 3.18Å; L527-M531 HydrophobicContact CD1-CG 4Å; L527-M531 HydrophobicContact CD1-SD 4.04Å; L527-M531 HydrophobicContact CG-CG 4.39Å; L527-M531 HydrophobicContact CG-SD 3.85Å; L527-M531 WeakPolarHBondContact O-CB 3.36Å; L527-M531 WeakPolarHBondContact O-CG 3.47Å; L527-M531 PolarHBondContact O-N 3.26Å
528	Q	95.8	Very high	95.3	Very high	6 Å²	6	25.4 Å²	25.4	3%	0.028	11%	0.108	C	C	.	.	H	α-helix	trans	-64.3	-41.3	174.3	-78.1	172.8	95.6	0	0	112.2	P221 V374 G524 F525 E530 M531 N532	P221-Q528 HydrophobicContact CB-CB 3.88Å; P221-Q528 HydrophobicContact CG-CB 3.86Å; V374-Q528 HydrophobicContact CG1-CG 4.36Å; G524-Q528 WeakPolarHBondContact O-CG 3.25Å; G524-Q528 PolarHBondContact O-N 2.79Å; G524-Q528 PolarHBondContact O-NE2 3.23Å; F525-Q528 PolarHBondContact O-N 3.45Å; Q528-E530 VanDerWaalsContact C-N 3.3Å; Q528-E530 PolarHBondContact O-N 2.81Å; Q528-M531 PolarHBondContact O-N 3.31Å; Q528-N532 WeakPolarHBondContact O-CB 3.26Å; Q528-N532 PolarHBondContact O-N 3.12Å
529	A	96.8	Very high	95.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.9	-40.6	174.8	0	0	0	0	0	111.9	I214 P221 W223 F525 A526 N532 H533	I214-A529 HydrophobicContact CD1-CB 4.4Å; I214-A529 HydrophobicContact CG1-CB 4.3Å; I214-A529 HydrophobicContact CG2-CB 4.23Å; P221-A529 WeakPolarHBondContact O-CA 3.36Å; W223-A529 HydrophobicContact CD2-CB 3.8Å; W223-A529 HydrophobicContact CE3-CB 4.33Å; W223-A529 HydrophobicContact CG-CB 4.01Å; W223-A529 HydrophobicContact CZ2-CB 4.15Å; F525-A529 WeakPolarHBondContact O-CB 3.46Å; F525-A529 PolarHBondContact O-N 3.31Å; A526-A529 PolarHBondContact O-N 2.94Å; A529-N532 PolarHBondContact O-N 3.41Å; A529-H533 PolarHBondContact O-N 3.16Å
530	E	97.3	Very high	95.8	Very high	3 Å²	3	23.1 Å²	23.1	1%	0.014	11%	0.108	C	C	.	.	H	α-helix	trans	-67.8	-47.2	177.1	-170.7	61.2	-166	0	0	112.9	W223 S285 H320 F482 A526 L527 Q528 N532 H533 F534	W223-E530 PolarHBondContact NE1-OE2 3.37Å; S285-E530 WeakPolarHBondContact CB-OE1 3.26Å; S285-E530 PolarHBondContact N-OE1 2.67Å; H320-E530 IonicContact CE1-OE2 3.12Å; H320-E530 IonicContact NE2-OE1 2.71Å; H320-E530 IonicContact NE2-OE2 2.78Å; H320-E530 PolarHBondContact NE2-OE2 2.83Å; F482-E530 HydrophobicContact CE1-CG 4.14Å; F482-E530 HydrophobicContact CZ-CG 4.42Å; A526-E530 WeakPolarHBondContact O-CB 3.44Å; A526-E530 PolarHBondContact O-N 2.98Å; L527-E530 PolarHBondContact O-N 3.18Å; Q528-E530 VanDerWaalsContact C-N 3.3Å; Q528-E530 PolarHBondContact O-N 2.81Å; E530-N532 VanDerWaalsContact C-N 3.27Å; E530-N532 PolarHBondContact O-N 2.93Å; E530-H533 PolarHBondContact O-N 2.86Å; E530-F534 WeakPolarHBondContact O-CB 3.32Å; E530-F534 PolarHBondContact O-N 2.67Å
531	M	97.1	Very high	96.1	Very high	17 Å²	17	23.7 Å²	23.7	8%	0.084	11%	0.111	C	C	.	.	H	α-helix	trans	-56.6	-42.6	173.7	-73.5	166.5	37	0	0	111.4	V378 F381 L527 Q528 F534 H535	V378-M531 HydrophobicContact CG2-SD 4.41Å; F381-M531 HydrophobicContact CB-CE 3.52Å; F381-M531 HydrophobicContact CB-SD 3.93Å; F381-M531 HydrophobicContact CD1-CG 3.8Å; F381-M531 HydrophobicContact CD1-SD 3.98Å; F381-M531 HydrophobicContact CD2-CB 4.07Å; F381-M531 HydrophobicContact CD2-CE 3.92Å; F381-M531 HydrophobicContact CD2-CG 3.75Å; F381-M531 HydrophobicContact CD2-SD 4.25Å; F381-M531 HydrophobicContact CE1-CG 3.86Å; F381-M531 HydrophobicContact CE2-CB 4Å; F381-M531 HydrophobicContact CE2-CG 3.79Å; F381-M531 HydrophobicContact CG-CE 3.74Å; F381-M531 HydrophobicContact CG-CG 3.75Å; F381-M531 HydrophobicContact CG-SD 3.78Å; F381-M531 HydrophobicContact CZ-CB 4.42Å; F381-M531 HydrophobicContact CZ-CG 3.86Å; L527-M531 HydrophobicContact CD1-CG 4Å; L527-M531 HydrophobicContact CD1-SD 4.04Å; L527-M531 HydrophobicContact CG-CG 4.39Å; L527-M531 HydrophobicContact CG-SD 3.85Å; L527-M531 WeakPolarHBondContact O-CB 3.36Å; L527-M531 WeakPolarHBondContact O-CG 3.47Å; L527-M531 PolarHBondContact O-N 3.26Å; Q528-M531 PolarHBondContact O-N 3.31Å; M531-F534 PolarHBondContact O-N 2.73Å; M531-H535 PolarHBondContact O-CD2 2.92Å; M531-H535 VanDerWaalsContact O-CG 3.31Å; M531-H535 PolarHBondContact O-N 2.74Å
532	N	97.1	Very high	96.3	Very high	20 Å²	20	24 Å²	24	11%	0.107	11%	0.113	C	C	.	.	H	α-helix	trans	-68.8	-38.4	177.2	-87.3	-28.5	0	0	0	112.8	R219 P221 Q528 A529 E530 H535 Q536	R219-N532 PolarHBondContact O-ND2 3.28Å; P221-N532 PolarHBondContact O-ND2 3.22Å; Q528-N532 WeakPolarHBondContact O-CB 3.26Å; Q528-N532 PolarHBondContact O-N 3.12Å; A529-N532 PolarHBondContact O-N 3.41Å; E530-N532 VanDerWaalsContact C-N 3.27Å; E530-N532 PolarHBondContact O-N 2.93Å; N532-H535 PolarHBondContact O-N 3.44Å; N532-Q536 WeakPolarHBondContact O-CB 3.49Å; N532-Q536 WeakPolarHBondContact O-CG 3.42Å; N532-Q536 PolarHBondContact O-N 3.03Å
533	H	97.3	Very high	96.6	Very high	17 Å²	17	28.7 Å²	28.7	8%	0.079	13%	0.133	C	C	.	.	H	α-helix	trans	-65.2	-44.1	173.4	-177.4	61.2	0	0	0	111.8	H320 A529 E530 H535 Q536 R537	H320-H533 AromaticContact CD2-CD2 3.27Å; H320-H533 PolarHBondContact CD2-CD2 2.87Å; H320-H533 AromaticContact CD2-NE2 3.33Å; H320-H533 PolarHBondContact CD2-NE2 3.26Å; H320-H533 VanDerWaalsContact CD2-NE2 3.33Å; H320-H533 AromaticContact CG-CD2 3.98Å; H320-H533 AromaticContact CG-NE2 3.68Å; H320-H533 AromaticContact NE2-CD2 3.52Å; A529-H533 PolarHBondContact O-N 3.16Å; E530-H533 PolarHBondContact O-N 2.86Å; H533-H535 PolarHBondContact O-N 3.06Å; H533-Q536 WeakPolarHBondContact O-CB 3.39Å; H533-Q536 PolarHBondContact O-N 3.45Å; H533-R537 PolarHBondContact O-N 3.46Å
534	F	97.9	Very high	96.8	Very high	5 Å²	5	33 Å²	33	2%	0.022	15%	0.152	C	C	.	.	H	α-helix	trans	-57.6	-45.7	174.3	176.9	-93.4	0	0	0	112.1	F381 F384 M388 Y475 L478 L479 F482 E530 M531 R537 R538	F381-F534 HydrophobicContact CE2-CD1 4.21Å; F381-F534 HydrophobicContact CZ-CD1 4.2Å; F384-F534 AromaticContact CE1-CE1 3.99Å; F384-F534 HydrophobicContact CE1-CE1 3.99Å; F384-F534 HydrophobicContact CZ-CE1 4.36Å; M388-F534 HydrophobicContact CE-CZ 4.1Å; M388-F534 HydrophobicContact SD-CE1 3.93Å; M388-F534 HydrophobicContact SD-CZ 3.83Å; Y475-F534 AromaticContact CD1-CE2 3.66Å; Y475-F534 HydrophobicContact CD1-CE2 3.66Å; Y475-F534 AromaticContact CD1-CZ 3.76Å; Y475-F534 HydrophobicContact CD1-CZ 3.76Å; Y475-F534 HydrophobicContact CE1-CD2 4.27Å; Y475-F534 AromaticContact CE1-CE2 3.57Å; Y475-F534 HydrophobicContact CE1-CE2 3.57Å; Y475-F534 AromaticContact CE1-CZ 3.82Å; Y475-F534 HydrophobicContact CE1-CZ 3.82Å; L478-F534 HydrophobicContact CB-CD2 4.4Å; L478-F534 HydrophobicContact CB-CE2 3.98Å; L478-F534 HydrophobicContact CD1-CE2 4.44Å; L479-F534 HydrophobicContact CD2-CE1 4.36Å; L479-F534 HydrophobicContact CD2-CE2 4.39Å; L479-F534 HydrophobicContact CD2-CZ 3.7Å; L479-F534 HydrophobicContact CG-CZ 4.12Å; F482-F534 HydrophobicContact CE2-CB 4.39Å; F482-F534 HydrophobicContact CE2-CD1 4.45Å; F482-F534 AromaticContact CE2-CD2 3.65Å; F482-F534 HydrophobicContact CE2-CD2 3.65Å; F482-F534 AromaticContact CE2-CE2 3.98Å; F482-F534 HydrophobicContact CE2-CE2 3.98Å; F482-F534 AromaticContact CE2-CG 3.9Å; F482-F534 HydrophobicContact CE2-CG 3.9Å; F482-F534 HydrophobicContact CZ-CB 3.97Å; F482-F534 HydrophobicContact CZ-CD2 4.06Å; F482-F534 AromaticContact CZ-CG 3.98Å; F482-F534 HydrophobicContact CZ-CG 3.98Å; E530-F534 WeakPolarHBondContact O-CB 3.32Å; E530-F534 PolarHBondContact O-N 2.67Å; M531-F534 PolarHBondContact O-N 2.73Å; F534-R537 PolarHBondContact O-N 3.29Å; F534-R538 WeakPolarHBondContact O-CB 3.49Å; F534-R538 PolarHBondContact O-N 3.05Å
535	H	97.7	Very high	97	Very high	35 Å²	35	33.4 Å²	33.4	16%	0.162	15%	0.153	C	C	.	.	H	α-helix	trans	-63.3	-42.3	176.4	-72.1	-38.8	0	0	0	112.9	F381 F384 M531 N532 H533 R538 E539	F381-H535 AromaticContact CD2-CE1 3.82Å; F381-H535 AromaticContact CD2-NE2 3.55Å; F381-H535 AromaticContact CE2-CE1 3.61Å; F381-H535 AromaticContact CE2-NE2 3.65Å; F384-H535 AromaticContact CD1-CE1 3.84Å; F384-H535 AromaticContact CE1-CE1 3.49Å; F384-H535 VanDerWaalsContact CE1-CE1 3.49Å; F384-H535 WeakPolarHBondContact CE1-CE1 3.31Å; F384-H535 AromaticContact CZ-CE1 3.96Å; M531-H535 PolarHBondContact O-CD2 2.92Å; M531-H535 VanDerWaalsContact O-CG 3.31Å; M531-H535 PolarHBondContact O-N 2.74Å; N532-H535 PolarHBondContact O-N 3.44Å; H533-H535 PolarHBondContact O-N 3.06Å; H535-R538 VanDerWaalsContact ND1-CZ 3.33Å; H535-R538 PolarHBondContact ND1-NH1 2.7Å; H535-R538 PolarHBondContact O-N 2.99Å; H535-E539 VanDerWaalsContact O-CD 3.27Å; H535-E539 WeakPolarHBondContact O-CG 3.35Å; H535-E539 PolarHBondContact O-N 3.38Å
536	Q	96.4	Very high	97.1	Very high	66 Å²	66	37.1 Å²	37.1	31%	0.308	17%	0.171	S	C	.	.	H	α-helix	trans	-58.6	-50.7	174.8	-74.5	168.2	33.4	0	0	111.9	N532 H533 E539 L540	N532-Q536 WeakPolarHBondContact O-CB 3.49Å; N532-Q536 WeakPolarHBondContact O-CG 3.42Å; N532-Q536 PolarHBondContact O-N 3.03Å; H533-Q536 WeakPolarHBondContact O-CB 3.39Å; H533-Q536 PolarHBondContact O-N 3.45Å; Q536-E539 PolarHBondContact O-N 3.18Å; Q536-L540 PolarHBondContact O-N 3.31Å
537	R	96.8	Very high	97.2	Very high	22 Å²	22	40.6 Å²	40.6	8%	0.083	19%	0.188	C	C	.	.	H	α-helix	trans	-65	-42.7	-179.9	-170.6	70.2	-146.2	-155.1	5	111.4	D315 S319 Y475 H533 F534 E539 L540 D541	D315-R537 IonicContact OD2-CZ 2.69Å; D315-R537 IonicContact OD2-NH1 3.75Å; D315-R537 PolarHBondContact OD2-NH1 3.14Å; D315-R537 IonicContact OD2-NH2 3.04Å; D315-R537 PolarHBondContact OD2-NH2 2.9Å; S319-R537 PolarHBondContact OG-NH1 3.35Å; Y475-R537 WeakPolarHBondContact OH-CG 3.5Å; Y475-R537 PolarHBondContact OH-O 2.84Å; H533-R537 PolarHBondContact O-N 3.46Å; F534-R537 PolarHBondContact O-N 3.29Å; R537-E539 PolarHBondContact O-N 3.47Å; R537-L540 WeakPolarHBondContact O-CB 3.3Å; R537-L540 PolarHBondContact O-N 3.15Å; R537-D541 WeakPolarHBondContact CG-OD2 3.19Å; R537-D541 IonicContact CZ-OD1 2.81Å; R537-D541 IonicContact CZ-OD2 3.29Å; R537-D541 VanDerWaalsContact NE-CG 3.32Å; R537-D541 IonicContact NE-OD1 2.7Å; R537-D541 PolarHBondContact NE-OD1 2.87Å; R537-D541 IonicContact NE-OD2 3.62Å; R537-D541 PolarHBondContact NE-OD2 2.99Å; R537-D541 IonicContact NH2-OD1 2.67Å; R537-D541 PolarHBondContact NH2-OD1 3.49Å; R537-D541 IonicContact NH2-OD2 3.74Å; R537-D541 PolarHBondContact NH2-OD2 3.25Å; R537-D541 PolarHBondContact O-N 3.03Å
538	R	97.4	Very high	97.3	Very high	57 Å²	57	42.4 Å²	42.4	22%	0.215	20%	0.198	C	C	.	.	H	α-helix	trans	-54.6	-47.4	175	173.2	-158.6	66.9	172.7	-1.4	112.2	M388 Y475 F534 H535 L540 D541 F542	M388-R538 HydrophobicContact CE-CG 4.1Å; Y475-R538 HydrophobicContact CE1-CB 4.02Å; Y475-R538 WeakPolarHBondContact OH-CA 3.35Å; Y475-R538 PolarHBondContact OH-N 3.06Å; F534-R538 WeakPolarHBondContact O-CB 3.49Å; F534-R538 PolarHBondContact O-N 3.05Å; H535-R538 VanDerWaalsContact ND1-CZ 3.33Å; H535-R538 PolarHBondContact ND1-NH1 2.7Å; H535-R538 PolarHBondContact O-N 2.99Å; R538-L540 VanDerWaalsContact C-N 3.3Å; R538-L540 PolarHBondContact O-N 3.14Å; R538-D541 PolarHBondContact O-N 3.33Å; R538-F542 HydrophobicContact CG-CD2 4.04Å; R538-F542 HydrophobicContact CG-CE2 4.33Å; R538-F542 WeakPolarHBondContact O-CB 3.47Å; R538-F542 WeakPolarHBondContact O-CD2 3.21Å; R538-F542 PolarHBondContact O-N 3.32Å
539	E	97.6	Very high	97.4	Very high	85 Å²	85	44.3 Å²	44.3	40%	0.397	21%	0.205	S	C	.	.	H	α-helix	trans	-63.7	-36.1	-179.5	-78.3	152.2	-150.3	0	0	112.1	R219 H535 Q536 R537 K543	R219-E539 IonicContact CZ-OE2 3.93Å; R219-E539 IonicContact NH1-OE1 2.76Å; R219-E539 IonicContact NH1-OE2 3.74Å; R219-E539 PolarHBondContact NH1-OE2 3.38Å; R219-E539 IonicContact NH2-OE2 2.72Å; H535-E539 VanDerWaalsContact O-CD 3.27Å; H535-E539 WeakPolarHBondContact O-CG 3.35Å; H535-E539 PolarHBondContact O-N 3.38Å; Q536-E539 PolarHBondContact O-N 3.18Å; R537-E539 PolarHBondContact O-N 3.47Å; E539-K543 WeakPolarHBondContact O-CB 3.34Å
540	L	97	Very high	97.5	Very high	76 Å²	76	48.8 Å²	48.8	40%	0.398	23%	0.228	S	C	.	.	H	α-helix	trans	-70.8	-50.3	175.4	-169.6	67.3	0	0	0	111.9	Q536 R537 R538 K543 H544	Q536-L540 PolarHBondContact O-N 3.31Å; R537-L540 WeakPolarHBondContact O-CB 3.3Å; R537-L540 PolarHBondContact O-N 3.15Å; R538-L540 VanDerWaalsContact C-N 3.3Å; R538-L540 PolarHBondContact O-N 3.14Å; L540-K543 WeakPolarHBondContact O-CB 3.42Å; L540-K543 PolarHBondContact O-N 3.18Å; L540-H544 WeakPolarHBondContact CD1-CE1 3.44Å; L540-H544 PolarHBondContact O-N 2.92Å
541	D	97.4	Very high	97.6	Very high	13 Å²	13	55.3 Å²	55.3	7%	0.07	25%	0.253	C	S	.	.	H	α-helix	trans	-71.6	-44.7	-172.3	-75.1	-21.9	0	0	0	112.9	T471 Y475 R537 R538 K543 H544 M545	T471-D541 HydrophobicContact CG2-CB 4.4Å; Y475-D541 HydrophobicContact CE2-CB 3.88Å; Y475-D541 PolarHBondContact OH-OD2 3.09Å; R537-D541 WeakPolarHBondContact CG-OD2 3.19Å; R537-D541 IonicContact CZ-OD1 2.81Å; R537-D541 IonicContact CZ-OD2 3.29Å; R537-D541 VanDerWaalsContact NE-CG 3.32Å; R537-D541 IonicContact NE-OD1 2.7Å; R537-D541 PolarHBondContact NE-OD1 2.87Å; R537-D541 IonicContact NE-OD2 3.62Å; R537-D541 PolarHBondContact NE-OD2 2.99Å; R537-D541 IonicContact NH2-OD1 2.67Å; R537-D541 PolarHBondContact NH2-OD1 3.49Å; R537-D541 IonicContact NH2-OD2 3.74Å; R537-D541 PolarHBondContact NH2-OD2 3.25Å; R537-D541 PolarHBondContact O-N 3.03Å; R538-D541 PolarHBondContact O-N 3.33Å; D541-K543 VanDerWaalsContact C-N 3.28Å; D541-K543 PolarHBondContact O-N 3.16Å; D541-H544 PolarHBondContact O-N 3.15Å; D541-M545 WeakPolarHBondContact O-CB 3.48Å; D541-M545 PolarHBondContact O-N 2.75Å
542	F	98	Very high	97.6	Very high	52 Å²	52	56.8 Å²	56.8	23%	0.228	26%	0.259	C	S	.	.	H	α-helix	trans	-66.2	-33.6	177.2	-81.5	-105.9	0	0	0	111.4	M388 V392 L472 Y475 R538 M545 M546	M388-F542 HydrophobicContact CE-CE2 3.68Å; M388-F542 HydrophobicContact CE-CZ 3.73Å; V392-F542 HydrophobicContact CG2-CZ 4.16Å; L472-F542 HydrophobicContact CD2-CE1 4.24Å; L472-F542 HydrophobicContact CD2-CZ 4.25Å; Y475-F542 HydrophobicContact CD1-CE2 4.14Å; Y475-F542 AromaticContact CD2-CE2 3.69Å; Y475-F542 HydrophobicContact CD2-CE2 3.69Å; Y475-F542 HydrophobicContact CD2-CZ 4.45Å; Y475-F542 HydrophobicContact CE1-CE2 4.36Å; Y475-F542 HydrophobicContact CE2-CD2 4.37Å; Y475-F542 AromaticContact CE2-CE2 3.94Å; Y475-F542 HydrophobicContact CE2-CE2 3.94Å; Y475-F542 AromaticContact CG-CE2 3.82Å; Y475-F542 HydrophobicContact CG-CE2 3.82Å; Y475-F542 HydrophobicContact CG-CZ 4.39Å; R538-F542 HydrophobicContact CG-CD2 4.04Å; R538-F542 HydrophobicContact CG-CE2 4.33Å; R538-F542 WeakPolarHBondContact O-CB 3.47Å; R538-F542 WeakPolarHBondContact O-CD2 3.21Å; R538-F542 PolarHBondContact O-N 3.32Å; F542-M545 HydrophobicContact CD1-CE 3.59Å; F542-M545 HydrophobicContact CE1-CE 3.85Å; F542-M545 HydrophobicContact CG-CE 4.23Å; F542-M546 WeakPolarHBondContact O-CB 3.47Å; F542-M546 VanDerWaalsContact O-CG 3.27Å; F542-M546 WeakPolarHBondContact O-CG 3.18Å; F542-M546 PolarHBondContact O-N 3.46Å
543	K	98.2	Very high	97.7	Very high	119 Å²	119	56.9 Å²	56.9	52%	0.517	26%	0.259	S	S	.	.	H	α-helix	trans	-62.1	-49.8	171.2	175.7	-172.9	175.8	-171.5	0	111.3	E539 L540 D541 Q547	E539-K543 WeakPolarHBondContact O-CB 3.34Å; L540-K543 WeakPolarHBondContact O-CB 3.42Å; L540-K543 PolarHBondContact O-N 3.18Å; D541-K543 VanDerWaalsContact C-N 3.28Å; D541-K543 PolarHBondContact O-N 3.16Å; K543-Q547 VanDerWaalsContact O-CB 3.31Å; K543-Q547 WeakPolarHBondContact O-CB 3.4Å; K543-Q547 VanDerWaalsContact O-CG 3.27Å; K543-Q547 WeakPolarHBondContact O-CG 3.17Å; K543-Q547 PolarHBondContact O-N 3.47Å
544	H	97.1	Very high	97.7	Very high	93 Å²	93	60.7 Å²	60.7	43%	0.431	28%	0.279	S	S	.	.	H	α-helix	trans	-67.4	-42.3	-179.8	-68.2	163.9	0	0	0	112.6	L540 D541 Q547 N548	L540-H544 WeakPolarHBondContact CD1-CE1 3.44Å; L540-H544 PolarHBondContact O-N 2.92Å; D541-H544 PolarHBondContact O-N 3.15Å; H544-Q547 PolarHBondContact O-N 3.12Å; H544-N548 WeakPolarHBondContact O-CB 3.43Å; H544-N548 PolarHBondContact O-N 2.67Å
545	M	97.4	Very high	97.7	Very high	12 Å²	12	64.5 Å²	64.5	6%	0.059	30%	0.299	C	S	.	.	H	α-helix	trans	-56.2	-52.5	175.2	-178.2	-177	74.6	0	0	111.6	M468 T471 L472 D541 F542 N548 Y549	M468-M545 HydrophobicContact CB-CG 4.28Å; M468-M545 HydrophobicContact CB-SD 4.39Å; M468-M545 HydrophobicContact CG-CG 4.17Å; M468-M545 HydrophobicContact CG-SD 3.8Å; T471-M545 HydrophobicContact CG2-CB 4.34Å; T471-M545 HydrophobicContact CG2-CG 4.42Å; T471-M545 HydrophobicContact CG2-SD 3.77Å; L472-M545 HydrophobicContact CD2-CE 4.36Å; L472-M545 HydrophobicContact CD2-SD 4.33Å; L472-M545 HydrophobicContact CG-SD 4.25Å; D541-M545 WeakPolarHBondContact O-CB 3.48Å; D541-M545 PolarHBondContact O-N 2.75Å; F542-M545 HydrophobicContact CD1-CE 3.59Å; F542-M545 HydrophobicContact CE1-CE 3.85Å; F542-M545 HydrophobicContact CG-CE 4.23Å; M545-N548 PolarHBondContact O-N 3.04Å; M545-Y549 WeakPolarHBondContact O-CB 3.45Å; M545-Y549 PolarHBondContact O-N 3.31Å
546	M	98	Very high	97.8	Very high	80 Å²	80	62.9 Å²	62.9	39%	0.394	29%	0.292	S	S	.	.	H	α-helix	trans	-69.2	-37.5	-179.5	-66.5	-55.2	-62.8	0	0	112.3	M468 F542 L550	M468-M546 HydrophobicContact CE-SD 4.2Å; F542-M546 WeakPolarHBondContact O-CB 3.47Å; F542-M546 VanDerWaalsContact O-CG 3.27Å; F542-M546 WeakPolarHBondContact O-CG 3.18Å; F542-M546 PolarHBondContact O-N 3.46Å; M546-L550 WeakPolarHBondContact O-CB 3.37Å; M546-L550 VanDerWaalsContact O-CG 3.29Å; M546-L550 WeakPolarHBondContact O-CG 3.44Å; M546-L550 PolarHBondContact O-N 2.92Å
547	Q	98.1	Very high	97.8	Very high	74 Å²	74	65.7 Å²	65.7	35%	0.346	30%	0.301	S	S	.	.	H	α-helix	trans	-63.7	-41.3	174	-78.8	-169.6	6.7	0	0	112.6	K543 H544 R551	K543-Q547 VanDerWaalsContact O-CB 3.31Å; K543-Q547 WeakPolarHBondContact O-CB 3.4Å; K543-Q547 VanDerWaalsContact O-CG 3.27Å; K543-Q547 WeakPolarHBondContact O-CG 3.17Å; K543-Q547 PolarHBondContact O-N 3.47Å; H544-Q547 PolarHBondContact O-N 3.12Å; Q547-R551 WeakPolarHBondContact O-CB 3.08Å; Q547-R551 WeakPolarHBondContact O-CD 3.29Å; Q547-R551 WeakPolarHBondContact O-CG 3.37Å; Q547-R551 PolarHBondContact O-N 2.93Å; Q547-R551 VanDerWaalsContact O-N 3.14Å
548	N	97.2	Very high	97.9	Very high	39 Å²	39	69.7 Å²	69.7	21%	0.209	32%	0.32	C	S	.	.	H	α-helix	trans	-67.5	-50.2	177.4	-175.5	44.2	0	0	0	111	Q467 H544 M545 L550 R551 Q552	Q467-N548 PolarHBondContact OE1-ND2 3.29Å; H544-N548 WeakPolarHBondContact O-CB 3.43Å; H544-N548 PolarHBondContact O-N 2.67Å; M545-N548 PolarHBondContact O-N 3.04Å; N548-L550 VanDerWaalsContact C-N 3.34Å; N548-L550 PolarHBondContact O-N 3.06Å; N548-R551 PolarHBondContact O-N 3.27Å; N548-Q552 WeakPolarHBondContact O-CG 3.48Å; N548-Q552 PolarHBondContact O-N 2.86Å
549	Y	98	Very high	97.9	Very high	45 Å²	45	71.5 Å²	71.5	18%	0.176	33%	0.327	C	S	.	.	H	α-helix	trans	-51.8	-50.9	177.4	176.9	-98.6	0	0	0	112.1	D464 L465 M468 M545 R551 Q552 Q553	D464-Y549 HydrophobicContact CB-CD2 3.94Å; D464-Y549 HydrophobicContact CB-CE2 4.49Å; L465-Y549 HydrophobicContact CD2-CD2 4.48Å; L465-Y549 HydrophobicContact CD2-CE2 3.77Å; L465-Y549 HydrophobicContact CG-CE2 4.37Å; M468-Y549 HydrophobicContact CE-CD1 4Å; M468-Y549 HydrophobicContact CE-CD2 3.48Å; M468-Y549 VanDerWaalsContact CE-CD2 3.48Å; M468-Y549 HydrophobicContact CE-CE1 4.47Å; M468-Y549 HydrophobicContact CE-CE2 4.01Å; M468-Y549 HydrophobicContact CE-CG 3.49Å; M468-Y549 VanDerWaalsContact CE-CG 3.49Å; M545-Y549 WeakPolarHBondContact O-CB 3.45Å; M545-Y549 PolarHBondContact O-N 3.31Å; Y549-R551 PolarHBondContact O-N 3.47Å; Y549-Q552 PolarHBondContact O-N 3.5Å; Y549-Q553 HydrophobicContact CD1-CG 4.34Å; Y549-Q553 HydrophobicContact CD2-CG 4.38Å; Y549-Q553 HydrophobicContact CE1-CG 3.93Å; Y549-Q553 HydrophobicContact CE2-CG 3.96Å; Y549-Q553 WeakPolarHBondContact O-CB 3.49Å; Y549-Q553 VanDerWaalsContact O-CG 3.29Å; Y549-Q553 WeakPolarHBondContact O-CG 3.07Å; Y549-Q553 PolarHBondContact O-N 3.42Å
550	L	98.4	Very high	98	Very high	95 Å²	95	68.2 Å²	68.2	50%	0.497	31%	0.313	S	S	.	.	H	α-helix	trans	-65.8	-39.5	-179.5	-68.2	172.7	0	0	0	112.7	M546 N548 Q553 I554	M546-L550 WeakPolarHBondContact O-CB 3.37Å; M546-L550 VanDerWaalsContact O-CG 3.29Å; M546-L550 WeakPolarHBondContact O-CG 3.44Å; M546-L550 PolarHBondContact O-N 2.92Å; N548-L550 VanDerWaalsContact C-N 3.34Å; N548-L550 PolarHBondContact O-N 3.06Å; L550-Q553 PolarHBondContact O-N 3.23Å; L550-I554 WeakPolarHBondContact O-CB 3.45Å; L550-I554 WeakPolarHBondContact O-CD1 3.39Å; L550-I554 WeakPolarHBondContact O-CG1 3.35Å; L550-I554 PolarHBondContact O-N 3.26Å
551	R	98.4	Very high	98	Very high	140 Å²	140	66.2 Å²	66.2	53%	0.528	31%	0.311	S	S	.	.	H	α-helix	trans	-61.4	-45.8	174.9	-74.9	170.2	-172.5	134.9	7.7	111.7	Q547 N548 Y549 I554 L555	Q547-R551 WeakPolarHBondContact O-CB 3.08Å; Q547-R551 WeakPolarHBondContact O-CD 3.29Å; Q547-R551 WeakPolarHBondContact O-CG 3.37Å; Q547-R551 PolarHBondContact O-N 2.93Å; Q547-R551 VanDerWaalsContact O-N 3.14Å; N548-R551 PolarHBondContact O-N 3.27Å; Y549-R551 PolarHBondContact O-N 3.47Å; R551-I554 PolarHBondContact O-N 3.26Å; R551-L555 WeakPolarHBondContact O-CG 3.49Å; R551-L555 PolarHBondContact O-N 2.91Å
552	Q	98.1	Very high	98	Very high	47 Å²	47	71.2 Å²	71.2	22%	0.22	33%	0.333	C	S	.	.	H	α-helix	trans	-67.6	-38.9	-179.2	-66.5	-63.5	-13.3	0	0	112.3	Q460 D464 N548 Y549 L555 F556	Q460-Q552 PolarHBondContact NE2-O 2.94Å; D464-Q552 HydrophobicContact CB-CB 3.77Å; D464-Q552 HydrophobicContact CB-CG 4.32Å; N548-Q552 WeakPolarHBondContact O-CG 3.48Å; N548-Q552 PolarHBondContact O-N 2.86Å; Y549-Q552 PolarHBondContact O-N 3.5Å; Q552-L555 PolarHBondContact O-N 3Å; Q552-F556 VanDerWaalsContact O-CB 3.31Å; Q552-F556 WeakPolarHBondContact O-CB 3.41Å; Q552-F556 PolarHBondContact O-N 2.75Å
553	Q	98.1	Very high	98	Very high	22 Å²	22	71.9 Å²	71.9	10%	0.103	34%	0.337	C	S	.	.	H	α-helix	trans	-63.9	-42.2	173	-72.9	-76.5	-61.3	0	0	111.9	D464 Y549 L550 F556 Y557	D464-Q553 PolarHBondContact OD2-NE2 3.12Å; Y549-Q553 HydrophobicContact CD1-CG 4.34Å; Y549-Q553 HydrophobicContact CD2-CG 4.38Å; Y549-Q553 HydrophobicContact CE1-CG 3.93Å; Y549-Q553 HydrophobicContact CE2-CG 3.96Å; Y549-Q553 WeakPolarHBondContact O-CB 3.49Å; Y549-Q553 VanDerWaalsContact O-CG 3.29Å; Y549-Q553 WeakPolarHBondContact O-CG 3.07Å; Y549-Q553 PolarHBondContact O-N 3.42Å; L550-Q553 PolarHBondContact O-N 3.23Å; Q553-F556 WeakPolarHBondContact O-CB 3.29Å; Q553-F556 PolarHBondContact O-N 2.91Å; Q553-Y557 WeakPolarHBondContact O-CD2 3.24Å; Q553-Y557 PolarHBondContact O-N 3.36Å
554	I	98.4	Very high	98	Very high	97 Å²	97	69.3 Å²	69.3	50%	0.497	33%	0.329	S	S	.	.	H	α-helix	trans	-59.6	-50.5	173.9	-70.6	163.1	0	0	0	110.6	L550 R551 F556 Y557 Q558	L550-I554 WeakPolarHBondContact O-CB 3.45Å; L550-I554 WeakPolarHBondContact O-CD1 3.39Å; L550-I554 WeakPolarHBondContact O-CG1 3.35Å; L550-I554 PolarHBondContact O-N 3.26Å; R551-I554 PolarHBondContact O-N 3.26Å; I554-F556 PolarHBondContact O-N 3.37Å; I554-Y557 PolarHBondContact O-N 2.86Å; I554-Q558 HydrophobicContact CG2-CG 4.41Å; I554-Q558 WeakPolarHBondContact O-CB 3.48Å; I554-Q558 VanDerWaalsContact O-CG 3.26Å; I554-Q558 WeakPolarHBondContact O-CG 3.22Å; I554-Q558 PolarHBondContact O-N 3.4Å
555	L	98.3	Very high	98.1	Very high	86 Å²	86	69.6 Å²	69.6	45%	0.45	33%	0.33	S	S	.	.	H	α-helix	trans	-64	-27	178	-69.2	170.7	0	0	0	112.9	R551 Q552 R559	R551-L555 WeakPolarHBondContact O-CG 3.49Å; R551-L555 PolarHBondContact O-N 2.91Å; Q552-L555 PolarHBondContact O-N 3Å; L555-R559 VanDerWaalsContact O-CG 3.27Å; L555-R559 WeakPolarHBondContact O-CG 3.33Å; L555-R559 PolarHBondContact O-N 3.39Å; L555-R559 PolarHBondContact O-NE 3.32Å
556	F	98.3	Very high	98	Very high	0 Å²	0	74.7 Å²	74.7	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-70.4	-57.3	173.3	175.1	-104.1	0	0	0	111.8	M456 F457 Q460 Q552 Q553 I554 Q558 R559 V560	M456-F556 HydrophobicContact CB-CE2 4.09Å; M456-F556 WeakPolarHBondContact O-CE2 3.44Å; F457-F556 AromaticContact CD1-CE1 3.99Å; F457-F556 HydrophobicContact CD1-CE1 3.99Å; F457-F556 AromaticContact CD1-CZ 3.6Å; F457-F556 HydrophobicContact CD1-CZ 3.6Å; F457-F556 AromaticContact CD2-CZ 3.87Å; F457-F556 HydrophobicContact CD2-CZ 3.87Å; F457-F556 AromaticContact CE1-CE1 3.55Å; F457-F556 HydrophobicContact CE1-CE1 3.55Å; F457-F556 AromaticContact CE1-CZ 3.61Å; F457-F556 HydrophobicContact CE1-CZ 3.61Å; F457-F556 HydrophobicContact CE2-CE1 4.22Å; F457-F556 AromaticContact CE2-CZ 3.85Å; F457-F556 HydrophobicContact CE2-CZ 3.85Å; F457-F556 AromaticContact CG-CZ 3.73Å; F457-F556 HydrophobicContact CG-CZ 3.73Å; F457-F556 AromaticContact CZ-CE1 3.68Å; F457-F556 HydrophobicContact CZ-CE1 3.68Å; F457-F556 AromaticContact CZ-CZ 3.74Å; F457-F556 HydrophobicContact CZ-CZ 3.74Å; Q460-F556 HydrophobicContact CB-CD2 3.77Å; Q460-F556 HydrophobicContact CB-CE2 3.8Å; Q460-F556 HydrophobicContact CB-CG 4.44Å; Q460-F556 HydrophobicContact CB-CZ 4.49Å; Q460-F556 HydrophobicContact CG-CB 4.19Å; Q460-F556 HydrophobicContact CG-CD1 4.39Å; Q460-F556 HydrophobicContact CG-CD2 3.58Å; Q460-F556 HydrophobicContact CG-CE2 4.05Å; Q460-F556 HydrophobicContact CG-CG 3.78Å; Q552-F556 VanDerWaalsContact O-CB 3.31Å; Q552-F556 WeakPolarHBondContact O-CB 3.41Å; Q552-F556 PolarHBondContact O-N 2.75Å; Q553-F556 WeakPolarHBondContact O-CB 3.29Å; Q553-F556 PolarHBondContact O-N 2.91Å; I554-F556 PolarHBondContact O-N 3.37Å; F556-Q558 VanDerWaalsContact C-N 3.27Å; F556-Q558 PolarHBondContact O-N 3.49Å; F556-R559 PolarHBondContact O-N 3.44Å; F556-R559 VanDerWaalsContact O-N 3.07Å; F556-V560 HydrophobicContact CE1-CG2 4.08Å; F556-V560 HydrophobicContact CE2-CG2 4.09Å; F556-V560 HydrophobicContact CZ-CG2 3.83Å; F556-V560 PolarHBondContact O-N 2.95Å
557	Y	98.3	Very high	97.9	Very high	126 Å²	126	71.2 Å²	71.2	49%	0.494	34%	0.335	S	S	.	.	H	α-helix	trans	-65.7	-30	-178.6	-68.8	-66	0	0	0	112.8	F457 Q553 I554 V560 G561	F457-Y557 HydrophobicContact CZ-CE1 4.45Å; Q553-Y557 WeakPolarHBondContact O-CD2 3.24Å; Q553-Y557 PolarHBondContact O-N 3.36Å; I554-Y557 PolarHBondContact O-N 2.86Å; Y557-V560 PolarHBondContact O-N 3.49Å; Y557-G561 PolarHBondContact O-N 3.26Å
558	Q	98.4	Very high	97.9	Very high	106 Å²	106	73 Å²	73	50%	0.495	35%	0.347	S	S	.	.	H	α-helix	trans	-61.9	-45.7	169.6	-76	174.9	-18	0	0	112.3	I554 F556 G561 Q562	I554-Q558 HydrophobicContact CG2-CG 4.41Å; I554-Q558 WeakPolarHBondContact O-CB 3.48Å; I554-Q558 VanDerWaalsContact O-CG 3.26Å; I554-Q558 WeakPolarHBondContact O-CG 3.22Å; I554-Q558 PolarHBondContact O-N 3.4Å; F556-Q558 VanDerWaalsContact C-N 3.27Å; F556-Q558 PolarHBondContact O-N 3.49Å; Q558-G561 PolarHBondContact O-N 2.97Å; Q558-Q562 VanDerWaalsContact O-CG 3.32Å; Q558-Q562 WeakPolarHBondContact O-CG 3.4Å; Q558-Q562 PolarHBondContact O-N 3.21Å
559	R	98	Very high	97.9	Very high	95 Å²	95	78.3 Å²	78.3	36%	0.358	36%	0.364	S	S	.	.	H	α-helix	trans	-63.6	-40	175.5	-75.2	177.2	-67.5	152	0.9	112	M456 L555 F556 Q562 Q563	M456-R559 HydrophobicContact CE-CB 3.67Å; L555-R559 VanDerWaalsContact O-CG 3.27Å; L555-R559 WeakPolarHBondContact O-CG 3.33Å; L555-R559 PolarHBondContact O-N 3.39Å; L555-R559 PolarHBondContact O-NE 3.32Å; F556-R559 PolarHBondContact O-N 3.44Å; F556-R559 VanDerWaalsContact O-N 3.07Å; R559-Q562 PolarHBondContact O-N 3.14Å; R559-Q563 WeakPolarHBondContact O-CG 3.5Å; R559-Q563 PolarHBondContact O-N 3.27Å
560	V	98	Very high	97.7	Very high	16 Å²	16	79.2 Å²	79.2	10%	0.097	37%	0.37	C	S	.	.	H	α-helix	trans	-62.3	-45.8	175.1	175.1	0	0	0	0	110.7	I453 M456 F556 Y557 Q562 Q563 L564	I453-V560 HydrophobicContact CD1-CG1 4.18Å; I453-V560 HydrophobicContact CG1-CG1 4.37Å; I453-V560 HydrophobicContact CG2-CG1 4.13Å; I453-V560 HydrophobicContact CG2-CG2 4.46Å; M456-V560 HydrophobicContact CE-CG2 3.73Å; F556-V560 HydrophobicContact CE1-CG2 4.08Å; F556-V560 HydrophobicContact CE2-CG2 4.09Å; F556-V560 HydrophobicContact CZ-CG2 3.83Å; F556-V560 PolarHBondContact O-N 2.95Å; Y557-V560 PolarHBondContact O-N 3.49Å; V560-Q562 VanDerWaalsContact C-N 3.33Å; V560-Q562 PolarHBondContact O-N 3.4Å; V560-Q563 PolarHBondContact O-N 3.31Å; V560-L564 HydrophobicContact CG1-CD1 4.32Å; V560-L564 PolarHBondContact O-N 3.29Å; V560-L564 VanDerWaalsContact O-N 3.16Å
561	G	98.2	Very high	97.6	Very high	34 Å²	34	78.3 Å²	78.3	35%	0.351	36%	0.361	S	S	.	.	H	α-helix	trans	-57.5	-42.7	175.3	0	0	0	0	0	113.1	Y557 Q558 Q563 L564 E565	Y557-G561 PolarHBondContact O-N 3.26Å; Q558-G561 PolarHBondContact O-N 2.97Å; G561-Q563 PolarHBondContact O-N 3.26Å; G561-L564 PolarHBondContact O-N 2.92Å; G561-E565 WeakPolarHBondContact O-CB 3.42Å; G561-E565 PolarHBondContact O-N 3.38Å
562	Q	98	Very high	97.2	Very high	118 Å²	118	76.8 Å²	76.8	55%	0.551	36%	0.363	S	S	*	.	H	α-helix	trans	-62.9	-36.2	176.7	-72.4	166.9	-5.1	0	0	113.3	Q558 R559 V560 K566	Q558-Q562 VanDerWaalsContact O-CG 3.32Å; Q558-Q562 WeakPolarHBondContact O-CG 3.4Å; Q558-Q562 PolarHBondContact O-N 3.21Å; R559-Q562 PolarHBondContact O-N 3.14Å; V560-Q562 VanDerWaalsContact C-N 3.33Å; V560-Q562 PolarHBondContact O-N 3.4Å; Q562-K566 VanDerWaalsContact O-CB 3.26Å; Q562-K566 WeakPolarHBondContact O-CB 3.44Å; Q562-K566 PolarHBondContact O-N 2.99Å
563	Q	97.6	Very high	96	Very high	65 Å²	65	81.7 Å²	81.7	30%	0.304	39%	0.391	S	S	.	.	H	α-helix	trans	-67.5	-41.4	175	-65.3	-56.4	-25.6	0	0	111.7	T449 I453 M456 R559 V560 G561 T567	T449-Q563 HydrophobicContact CG2-CB 3.94Å; I453-Q563 HydrophobicContact CD1-CB 4.26Å; I453-Q563 HydrophobicContact CG1-CB 4.28Å; M456-Q563 HydrophobicContact SD-CG 4.06Å; R559-Q563 WeakPolarHBondContact O-CG 3.5Å; R559-Q563 PolarHBondContact O-N 3.27Å; V560-Q563 PolarHBondContact O-N 3.31Å; G561-Q563 PolarHBondContact O-N 3.26Å; Q563-T567 WeakPolarHBondContact O-CB 3.48Å; Q563-T567 PolarHBondContact O-N 3.35Å; Q563-T567 VanDerWaalsContact O-N 3.16Å; Q563-T567 PolarHBondContact O-OG1 3.45Å
564	L	98.1	Very high	94.9	Very high	65 Å²	65	86 Å²	86	34%	0.34	41%	0.414	S	S	.	.	H	α-helix	trans	-66.3	-44	176	-64.3	173.6	0	0	0	111.6	Y450 I453 V560 G561 T567 L568	Y450-L564 HydrophobicContact CE2-CD2 3.84Å; I453-L564 HydrophobicContact CD1-CD2 3.71Å; I453-L564 HydrophobicContact CD1-CG 3.99Å; V560-L564 HydrophobicContact CG1-CD1 4.32Å; V560-L564 PolarHBondContact O-N 3.29Å; V560-L564 VanDerWaalsContact O-N 3.16Å; G561-L564 PolarHBondContact O-N 2.92Å; L564-T567 WeakPolarHBondContact O-CB 3.3Å; L564-T567 PolarHBondContact O-N 3.41Å; L564-L568 WeakPolarHBondContact O-CB 3.16Å; L564-L568 PolarHBondContact O-N 3.02Å
565	E	97.8	Very high	94.7	Very high	99 Å²	99	85.4 Å²	85.4	46%	0.463	41%	0.41	S	S	.	.	H	α-helix	trans	-63.9	-45	177.9	-168.2	-167.9	170	0	0	112.1	G561 T567 L568 R569	G561-E565 WeakPolarHBondContact O-CB 3.42Å; G561-E565 PolarHBondContact O-N 3.38Å; E565-T567 PolarHBondContact O-N 3.28Å; E565-L568 PolarHBondContact O-N 3.32Å; E565-R569 WeakPolarHBondContact O-CG 3.07Å; E565-R569 PolarHBondContact O-N 3.04Å; E565-R569 IonicContact OE1-CZ 3.85Å; E565-R569 IonicContact OE1-NE 2.8Å; E565-R569 IonicContact OE1-NH2 3.99Å; E565-R569 PolarHBondContact OE1-NH2 2.96Å
566	K	96.1	Very high	94.5	Very high	120 Å²	120	85.4 Å²	85.4	52%	0.522	41%	0.408	S	S	.	.	H	α-helix	trans	-56.1	-38.8	174.1	176.4	-172.2	168.4	-163.8	0	112	Q562	Q562-K566 VanDerWaalsContact O-CB 3.26Å; Q562-K566 WeakPolarHBondContact O-CB 3.44Å; Q562-K566 PolarHBondContact O-N 2.99Å
567	T	97	Very high	94.3	Very high	6 Å²	6	90.1 Å²	90.1	4%	0.037	43%	0.43	C	S	.	.	H	α-helix	trans	-74.7	-41.8	-178.8	-60.2	0	0	0	0	111.7	T446 T449 Q563 L564 E565 R569 M570	T446-T567 HydrophobicContact CG2-CG2 4.32Å; T446-T567 WeakPolarHBondContact OG1-CG2 3.44Å; T449-T567 WeakPolarHBondContact CB-OG1 3.39Å; T449-T567 WeakPolarHBondContact CG2-OG1 3.38Å; T449-T567 PolarHBondContact OG1-OG1 3.37Å; Q563-T567 WeakPolarHBondContact O-CB 3.48Å; Q563-T567 PolarHBondContact O-N 3.35Å; Q563-T567 VanDerWaalsContact O-N 3.16Å; Q563-T567 PolarHBondContact O-OG1 3.45Å; L564-T567 WeakPolarHBondContact O-CB 3.3Å; L564-T567 PolarHBondContact O-N 3.41Å; E565-T567 PolarHBondContact O-N 3.28Å; T567-R569 PolarHBondContact O-N 2.98Å; T567-M570 WeakPolarHBondContact O-CB 3.48Å; T567-M570 PolarHBondContact O-N 2.74Å
568	L	97.6	Very high	94.1	Very high	113 Å²	113	88 Å²	88	59%	0.592	43%	0.426	S	S	*	.	H	α-helix	trans	-55.3	-41.1	176.6	178.9	61	0	0	0	111.6	L564 E565 M570 Y571	L564-L568 WeakPolarHBondContact O-CB 3.16Å; L564-L568 PolarHBondContact O-N 3.02Å; E565-L568 PolarHBondContact O-N 3.32Å; L568-M570 PolarHBondContact O-N 3.47Å; L568-Y571 WeakPolarHBondContact O-CB 3.11Å; L568-Y571 WeakPolarHBondContact O-CD2 3.42Å; L568-Y571 PolarHBondContact O-N 3.36Å
569	R	96.4	Very high	93.8	Very high	149 Å²	149	86.9 Å²	86.9	56%	0.562	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-62.8	-12.1	179.1	-65.1	173.3	-170.2	-168.6	3.2	114.9	E565 T567 Y571 D572	E565-R569 WeakPolarHBondContact O-CG 3.07Å; E565-R569 PolarHBondContact O-N 3.04Å; E565-R569 IonicContact OE1-CZ 3.85Å; E565-R569 IonicContact OE1-NE 2.8Å; E565-R569 IonicContact OE1-NH2 3.99Å; E565-R569 PolarHBondContact OE1-NH2 2.96Å; T567-R569 PolarHBondContact O-N 2.98Å; R569-Y571 PolarHBondContact O-N 3.11Å; R569-D572 WeakPolarHBondContact CA-OD2 3.41Å
570	M	94.9	Very high	93.6	Very high	64 Å²	64	86.3 Å²	86.3	32%	0.315	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-75.2	-10.1	170.7	-65.9	-168.2	63.4	0	0	113.4	A442 H445 T567 L568	A442-M570 HydrophobicContact CB-CB 3.91Å; H445-M570 HydrophobicContact CB-CE 3.96Å; H445-M570 HydrophobicContact CB-SD 3.44Å; H445-M570 WeakPolarHBondContact CB-SD 3.42Å; T567-M570 WeakPolarHBondContact O-CB 3.48Å; T567-M570 PolarHBondContact O-N 2.74Å; L568-M570 PolarHBondContact O-N 3.47Å
571	Y	95.8	Very high	93.2	Very high	77 Å²	77	91.4 Å²	91.4	30%	0.302	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-97.8	-6.5	177.4	-63.3	-95.1	0	0	0	113.4	L439 A442 I443 T446 L568 R569 N573 L574	L439-Y571 HydrophobicContact CD1-CD1 4.39Å; L439-Y571 HydrophobicContact CD1-CE1 4.13Å; A442-Y571 HydrophobicContact CB-CD1 4.17Å; A442-Y571 HydrophobicContact CB-CD2 4.28Å; A442-Y571 HydrophobicContact CB-CE1 3.85Å; A442-Y571 HydrophobicContact CB-CE2 3.98Å; A442-Y571 HydrophobicContact CB-CG 4.38Å; A442-Y571 PolarHBondContact O-OH 2.77Å; I443-Y571 WeakPolarHBondContact CA-OH 3.44Å; I443-Y571 HydrophobicContact CG1-CE1 4.26Å; I443-Y571 PolarHBondContact N-OH 3.29Å; T446-Y571 WeakPolarHBondContact OG1-CE2 3.44Å; T446-Y571 PolarHBondContact OG1-OH 3.18Å; L568-Y571 WeakPolarHBondContact O-CB 3.11Å; L568-Y571 WeakPolarHBondContact O-CD2 3.42Å; L568-Y571 PolarHBondContact O-N 3.36Å; R569-Y571 PolarHBondContact O-N 3.11Å; Y571-N573 VanDerWaalsContact C-N 3.28Å; Y571-N573 PolarHBondContact O-N 3.22Å; Y571-L574 HydrophobicContact CD1-CD1 3.55Å; Y571-L574 HydrophobicContact CE1-CD1 4.32Å; Y571-L574 HydrophobicContact CG-CD1 4.1Å
572	D	90.3	Very high	92.9	Very high	107 Å²	107	95.8 Å²	95.8	57%	0.572	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-15.2	-172.7	-66.2	-14.4	0	0	0	114.5	R569	R569-D572 WeakPolarHBondContact CA-OD2 3.41Å
573	N	71.5	Confident	92.4	Very high	151 Å²	151	93.9 Å²	93.9	81%	0.807	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.6	48	-172.6	-60.8	-92.3	0	0	0	111.9	Y571	Y571-N573 VanDerWaalsContact C-N 3.28Å; Y571-N573 PolarHBondContact O-N 3.22Å
574	L	76.1	Confident	92	Very high	111 Å²	111	96.5 Å²	96.5	58%	0.581	46%	0.463	S	S	*	.			trans	-103.4	0	-177.4	-64.1	-175	0	0	0	114	A438 L439 A442 Y571	A438-L574 VanDerWaalsContact C-CD2 3.47Å; A438-L574 HydrophobicContact CB-CD2 3.49Å; A438-L574 VanDerWaalsContact CB-CD2 3.49Å; L439-L574 HydrophobicContact CB-CD1 4.23Å; L439-L574 HydrophobicContact CD1-CD1 3.72Å; A442-L574 HydrophobicContact CB-CD1 4.22Å; Y571-L574 HydrophobicContact CD1-CD1 3.55Å; Y571-L574 HydrophobicContact CE1-CD1 4.32Å; Y571-L574 HydrophobicContact CG-CD1 4.1Å

Retrieved 574 of 574 residues in 2372.7 ms (Link to these results)

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