A0A077Z7N2_TRITR Loading...

Pleckstrin homology domain-containing family A member 8

Mediates the non-vesicular transport of glucosylceramide (GlcCer) from the trans-Golgi network (TGN) to the plasma membrane, playing a pivotal role in the synthesis of complex glycosphingolipids; binding of both phosphatidylinositol 4-phosphate (PIP) and ARF1 are essential for this GlcCer transfer ability. Also functions as a cargo transport protein required for apical transport from the Golgi complex, including transport of AQP2 from the TGN to sites of AQP2 phosphorylation. Additionally required for primary cilium formation, possibly by being involved in the transport of raft lipids to the apical membrane, and for membrane tubulation.

AlphaFold DB , UniProt , Accession A0A077Z7N2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 414 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.2	Very low	78.7	Confident	241 Å²	241	97 Å²	97	100%	1.187	46%	0.457	S	S	*	.				0	104.5	0	-66.9	-151.2	-155.6	0	0	106	R3	M1-R3 PolarHBondContact O-N 3.22Å
2	D	59.6	Low	79.1	Confident	145 Å²	145	93.2 Å²	93.2	78%	0.775	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-63.1	128.4	172.9	-78.9	-27.5	0	0	0	107.9
3	R	59.2	Low	79.3	Confident	225 Å²	225	87.7 Å²	87.7	85%	0.849	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-60.8	135.9	174.8	-83	-177.2	177.7	179.4	-0.6	108	M1 I5	M1-R3 PolarHBondContact O-N 3.22Å; R3-I5 PolarHBondContact O-N 2.98Å
4	P	68.5	Low	78.7	Confident	88 Å²	88	83.2 Å²	83.2	57%	0.571	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-56	135.8	173.3	23.4	-31.6	0	0	0	109.2	R6	P4-R6 PolarHBondContact O-N 3.35Å
5	I	81.7	Confident	77.9	Confident	30 Å²	30	80.5 Å²	80.5	15%	0.154	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-64.6	122.4	-179.6	-67.9	157.7	0	0	0	108	R3 L28 G30 A93 T96 A97 Q100	R3-I5 PolarHBondContact O-N 2.98Å; I5-L28 HydrophobicContact CG2-CD2 3.89Å; I5-G30 PolarHBondContact O-N 2.89Å; I5-A93 HydrophobicContact CG2-CB 4.35Å; I5-T96 VanDerWaalsContact CD1-C 3.42Å; I5-T96 HydrophobicContact CD1-CG2 3.39Å; I5-T96 HydrophobicContact CG1-CG2 4.47Å; I5-A97 HydrophobicContact CD1-CB 4.26Å; I5-A97 VanDerWaalsContact CD1-N 3.31Å; I5-Q100 HydrophobicContact CD1-CG 4.4Å
6	R	89.3	Confident	76.7	Confident	139 Å²	139	76.6 Å²	76.6	53%	0.525	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.2	175.2	-167.7	170.2	-176.6	-84.4	-11	109.5	P4 E8 L28	P4-R6 PolarHBondContact O-N 3.35Å; R6-E8 IonicContact CZ-OE1 2.86Å; R6-E8 IonicContact CZ-OE2 3.59Å; R6-E8 IonicContact NH1-OE1 3.71Å; R6-E8 PolarHBondContact NH1-OE1 3.05Å; R6-E8 IonicContact NH1-OE2 2.82Å; R6-E8 PolarHBondContact NH1-OE2 2.94Å; R6-E8 IonicContact NH2-OE1 3.98Å; R6-E8 IonicContact NH2-OE2 3.59Å; R6-E8 PolarHBondContact NH2-OE2 3.12Å; R6-L28 VanDerWaalsContact CA-O 3.24Å; R6-L28 WeakPolarHBondContact CA-O 3.43Å
7	K	93.9	Very high	75.4	Confident	42 Å²	42	73.3 Å²	73.3	18%	0.183	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	133.8	171.8	-174.6	174.4	176.1	68.1	0	108.5	L28 E89 W90 A93	K7-L28 HydrophobicContact CB-CB 4.42Å; K7-L28 PolarHBondContact N-O 3.28Å; K7-L28 PolarHBondContact O-N 3.4Å; K7-E89 IonicContact NZ-OE2 3.82Å; K7-E89 PolarHBondContact NZ-OE2 3.38Å; K7-W90 HydrophobicContact CB-CZ3 4.4Å; K7-W90 HydrophobicContact CD-CD2 3.83Å; K7-W90 HydrophobicContact CD-CE3 4.04Å; K7-W90 HydrophobicContact CD-CG 4.21Å; K7-W90 HydrophobicContact CD-CZ2 4.45Å; K7-W90 HydrophobicContact CD-CZ3 4.42Å; K7-W90 HydrophobicContact CG-CD2 4.39Å; K7-W90 HydrophobicContact CG-CE3 4.4Å; K7-W90 HydrophobicContact CG-CH2 4.16Å; K7-W90 HydrophobicContact CG-CZ2 4.16Å; K7-W90 HydrophobicContact CG-CZ3 4.29Å; K7-A93 HydrophobicContact CB-CB 4.16Å; K7-A93 HydrophobicContact CD-CB 3.77Å
8	E	93.5	Very high	74.2	Confident	79 Å²	79	69.3 Å²	69.3	37%	0.369	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	154.1	176	64.4	-159	152.7	0	0	110.5	R6 W25 F26 V27	R6-E8 IonicContact CZ-OE1 2.86Å; R6-E8 IonicContact CZ-OE2 3.59Å; R6-E8 IonicContact NH1-OE1 3.71Å; R6-E8 PolarHBondContact NH1-OE1 3.05Å; R6-E8 IonicContact NH1-OE2 2.82Å; R6-E8 PolarHBondContact NH1-OE2 2.94Å; R6-E8 IonicContact NH2-OE1 3.98Å; R6-E8 IonicContact NH2-OE2 3.59Å; R6-E8 PolarHBondContact NH2-OE2 3.12Å; E8-W25 HydrophobicContact CB-CZ2 4.35Å; E8-W25 HydrophobicContact CG-CZ2 4.14Å; E8-F26 CarbonylContact C-O 3.57Å; E8-F26 WeakPolarHBondContact CA-O 3.5Å; E8-V27 HydrophobicContact CB-CG2 4.24Å
9	G	92.8	Very high	73.5	Confident	9 Å²	9	69.4 Å²	69.4	9%	0.093	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.5	163.8	178.8	0	0	0	0	0	113.1	F26	G9-F26 PolarHBondContact N-O 3.11Å; G9-F26 PolarHBondContact O-N 2.87Å
10	E	92.7	Very high	72.9	Confident	66 Å²	66	66.4 Å²	66.4	31%	0.308	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	125.9	176.7	-168.6	-174.1	91	0	0	110.8	P23 R24 W25 R82	E10-P23 HydrophobicContact CG-CB 3.92Å; E10-R24 WeakPolarHBondContact CA-O 3.28Å; E10-W25 HydrophobicContact CB-CE3 3.91Å; E10-W25 HydrophobicContact CB-CZ3 4.09Å; E10-R82 IonicContact OE1-CZ 2.71Å; E10-R82 IonicContact OE1-NE 3.41Å; E10-R82 IonicContact OE1-NH2 3.47Å; E10-R82 PolarHBondContact OE1-NH2 2.91Å; E10-R82 IonicContact OE2-NH2 3.04Å
11	L	92.9	Very high	73	Confident	3 Å²	3	65.5 Å²	65.5	2%	0.016	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	157.8	168.2	-60.1	170.9	0	0	0	109.3	R24 F26 F67 I79 A81 W90	L11-R24 PolarHBondContact N-O 2.74Å; L11-R24 PolarHBondContact O-N 2.99Å; L11-R24 VanDerWaalsContact O-O 3.07Å; L11-F26 HydrophobicContact CB-CD2 3.6Å; L11-F26 HydrophobicContact CB-CE2 3.73Å; L11-F26 HydrophobicContact CD1-CB 4.25Å; L11-F26 HydrophobicContact CD1-CD2 3.88Å; L11-F26 HydrophobicContact CD1-CE2 4.36Å; L11-F26 HydrophobicContact CD1-CG 4.03Å; L11-F26 HydrophobicContact CG-CD2 4.04Å; L11-F67 HydrophobicContact CD1-CE1 4.36Å; L11-F67 HydrophobicContact CD1-CZ 3.93Å; L11-I79 HydrophobicContact CB-CG2 3.71Å; L11-I79 HydrophobicContact CD1-CG2 3.52Å; L11-I79 HydrophobicContact CG-CG2 4.17Å; L11-A81 HydrophobicContact CD2-CB 3.68Å; L11-W90 HydrophobicContact CD1-CD2 3.81Å; L11-W90 HydrophobicContact CD1-CE3 4.39Å; L11-W90 HydrophobicContact CD1-CG 4.05Å; L11-W90 HydrophobicContact CD1-CZ2 4.02Å; L11-W90 HydrophobicContact CG-CZ2 4.35Å
12	L	83.2	Confident	74.7	Confident	51 Å²	51	56.8 Å²	56.8	27%	0.267	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	126.3	169	-62.6	174.8	0	0	0	108.6	W21 Q22 P23 I79 R80	L12-W21 HydrophobicContact CB-CB 4.22Å; L12-W21 HydrophobicContact CB-CD2 4.38Å; L12-W21 HydrophobicContact CB-CE3 3.73Å; L12-W21 HydrophobicContact CD1-CB 4.41Å; L12-W21 WeakPolarHBondContact O-CZ3 3.35Å; L12-Q22 CarbonylContact C-O 3.59Å; L12-Q22 WeakPolarHBondContact CA-O 3.46Å; L12-P23 HydrophobicContact CD2-CB 4.29Å; L12-I79 CarbonylContact O-C 3.6Å; L12-I79 VanDerWaalsContact O-CA 3.31Å; L12-I79 WeakPolarHBondContact O-CA 3.35Å; L12-R80 HydrophobicContact CB-CB 4.25Å; L12-R80 PolarHBondContact N-O 3.19Å; L12-R80 PolarHBondContact O-N 3.45Å
13	K	82.1	Confident	75.8	Confident	22 Å²	22	52.2 Å²	52.2	10%	0.096	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	132.9	169.8	-176.3	-178.9	178.6	-68.6	0	108.9	T15 Q22 R24 F26 Y35 Y78	K13-T15 PolarHBondContact O-N 3.12Å; K13-Q22 PolarHBondContact N-O 2.91Å; K13-Q22 PolarHBondContact O-N 3.42Å; K13-R24 HydrophobicContact CB-CB 4.35Å; K13-R24 HydrophobicContact CB-CG 3.8Å; K13-R24 HydrophobicContact CD-CG 4.42Å; K13-F26 HydrophobicContact CB-CE2 4.23Å; K13-F26 HydrophobicContact CB-CZ 4.05Å; K13-F26 HydrophobicContact CD-CZ 4.27Å; K13-F26 HydrophobicContact CG-CZ 4.37Å; K13-Y35 HydrophobicContact CD-CD1 4.43Å; K13-Y35 HydrophobicContact CD-CD2 4.29Å; K13-Y35 HydrophobicContact CD-CE1 4.18Å; K13-Y35 HydrophobicContact CD-CE2 4.06Å; K13-Y35 HydrophobicContact CD-CG 4.49Å; K13-Y78 WeakPolarHBondContact CA-O 3.45Å
14	W	71	Confident	77.2	Confident	25 Å²	25	43.1 Å²	43.1	10%	0.095	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	121.5	167.4	-170.4	-105.9	0	0	0	109.4	Y17 W21 Y78 A158	W14-Y17 HydrophobicContact CZ2-CD1 4.09Å; W14-W21 HydrophobicContact CB-CD2 4.45Å; W14-W21 HydrophobicContact CB-CE3 4.21Å; W14-W21 HydrophobicContact CB-CH2 4.36Å; W14-W21 HydrophobicContact CB-CZ3 4.17Å; W14-W21 HydrophobicContact CE3-CB 4.46Å; W14-W21 AromaticContact CE3-CD1 3.5Å; W14-W21 AromaticContact CE3-CD2 3.85Å; W14-W21 HydrophobicContact CE3-CD2 3.85Å; W14-W21 AromaticContact CE3-CE2 3.73Å; W14-W21 AromaticContact CE3-CG 3.71Å; W14-W21 HydrophobicContact CE3-CG 3.71Å; W14-W21 HydrophobicContact CE3-CZ2 4.46Å; W14-W21 AromaticContact CE3-NE1 3.49Å; W14-W21 AromaticContact CZ3-CD1 3.52Å; W14-W21 HydrophobicContact CZ3-CG 4.12Å; W14-W21 AromaticContact CZ3-NE1 3.66Å; W14-Y78 HydrophobicContact CB-CD2 4.35Å; W14-Y78 HydrophobicContact CB-CG 4.47Å; W14-Y78 PolarHBondContact N-O 2.8Å; W14-A158 HydrophobicContact CE3-CB 3.99Å; W14-A158 HydrophobicContact CH2-CB 3.56Å; W14-A158 HydrophobicContact CZ2-CB 4.48Å; W14-A158 HydrophobicContact CZ3-CB 3.26Å
15	T	66.4	Low	78.2	Confident	43 Å²	43	40.8 Å²	40.8	26%	0.264	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-47.1	180	51.1	0	0	0	0	111.8	K13 I19 G20 Q22	K13-T15 PolarHBondContact O-N 3.12Å; T15-I19 WeakPolarHBondContact OG1-CB 3.28Å; T15-G20 PolarHBondContact N-O 3.43Å; T15-G20 PolarHBondContact OG1-O 3.26Å; T15-G20 VanDerWaalsContact OG1-O 3.06Å; T15-Q22 HydrophobicContact CG2-CB 3.86Å; T15-Q22 HydrophobicContact CG2-CG 3.85Å
16	N	59	Low	78.7	Confident	17 Å²	17	39.4 Å²	39.4	9%	0.091	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.8	174.4	175	54.1	14.5	0	0	0	109.3	L18 I19 G20 R307	N16-L18 PolarHBondContact O-N 3.25Å; N16-L18 PolarHBondContact OD1-N 3.38Å; N16-I19 VanDerWaalsContact OD1-CB 3.32Å; N16-I19 WeakPolarHBondContact OD1-CB 3.41Å; N16-I19 WeakPolarHBondContact OD1-CG1 3.45Å; N16-I19 PolarHBondContact OD1-N 3.27Å; N16-G20 VanDerWaalsContact O-CA 3.27Å; N16-G20 WeakPolarHBondContact O-CA 3.45Å; N16-G20 PolarHBondContact O-N 2.88Å; N16-R307 PolarHBondContact ND2-NH1 3.2Å
17	Y	53.9	Low	78.7	Confident	21 Å²	21	33.5 Å²	33.5	8%	0.082	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-28.2	174.1	-63.9	-74.9	0	0	0	112.9	W14 R122 F155 M159 L162 L262	W14-Y17 HydrophobicContact CZ2-CD1 4.09Å; Y17-R122 HydrophobicContact CE1-CG 4.27Å; Y17-R122 WeakPolarHBondContact OH-CD 3.3Å; Y17-R122 PolarHBondContact OH-NE 3Å; Y17-F155 WeakPolarHBondContact O-CE2 3.49Å; Y17-M159 HydrophobicContact CD1-SD 3.8Å; Y17-M159 HydrophobicContact CE1-CE 4.48Å; Y17-M159 HydrophobicContact CE1-SD 3.48Å; Y17-M159 WeakPolarHBondContact CE1-SD 3.41Å; Y17-L162 HydrophobicContact CE1-CD1 3.69Å; Y17-L262 HydrophobicContact CD2-CD1 4.42Å; Y17-L262 HydrophobicContact CG-CD2 4.34Å
18	L	53.6	Low	78.6	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-58.8	-177.8	-64.9	-163.5	0	0	0	112.5	N16 E263 H344 Q345 S346 L349	N16-L18 PolarHBondContact O-N 3.25Å; N16-L18 PolarHBondContact OD1-N 3.38Å; L18-E263 HydrophobicContact CD1-CG 3.97Å; L18-E263 VanDerWaalsContact CD1-OE1 3.25Å; L18-E263 WeakPolarHBondContact CD1-OE1 3.36Å; L18-E263 WeakPolarHBondContact CD1-OE2 3.45Å; L18-E263 HydrophobicContact CD2-CB 4.48Å; L18-E263 WeakPolarHBondContact CD2-OE2 3.44Å; L18-E263 WeakPolarHBondContact CG-OE2 2.98Å; L18-H344 WeakPolarHBondContact CB-O 3.2Å; L18-H344 HydrophobicContact CD1-CB 4.44Å; L18-Q345 HydrophobicContact CB-CG 4.49Å; L18-Q345 HydrophobicContact CD1-CG 3.79Å; L18-Q345 HydrophobicContact CD2-CG 3.79Å; L18-Q345 HydrophobicContact CG-CG 4.22Å; L18-S346 WeakPolarHBondContact O-CA 3.32Å; L18-S346 WeakPolarHBondContact O-CB 3.43Å; L18-S346 PolarHBondContact O-N 3.47Å; L18-S346 PolarHBondContact O-OG 3.13Å; L18-L349 HydrophobicContact CD2-CD1 3.32Å; L18-L349 HydrophobicContact CG-CD1 4.47Å
19	I	60.9	Low	78.3	Confident	72 Å²	72	32 Å²	32	37%	0.369	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-21.3	-170.1	-57.5	169.2	0	0	0	110.4	T15 N16 Q22 H344	T15-I19 WeakPolarHBondContact OG1-CB 3.28Å; N16-I19 VanDerWaalsContact OD1-CB 3.32Å; N16-I19 WeakPolarHBondContact OD1-CB 3.41Å; N16-I19 WeakPolarHBondContact OD1-CG1 3.45Å; N16-I19 PolarHBondContact OD1-N 3.27Å; I19-Q22 HydrophobicContact CG2-CG 3.37Å; I19-Q22 PolarHBondContact O-NE2 3.12Å; I19-Q22 VanDerWaalsContact O-NE2 3.07Å; I19-H344 WeakPolarHBondContact CG1-O 3.26Å
20	G	62.3	Low	78	Confident	9 Å²	9	32.5 Å²	32.5	9%	0.093	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	72.7	-138.7	177	0	0	0	0	0	113.7	T15 N16	T15-G20 PolarHBondContact N-O 3.43Å; T15-G20 PolarHBondContact OG1-O 3.26Å; T15-G20 VanDerWaalsContact OG1-O 3.06Å; N16-G20 VanDerWaalsContact O-CA 3.27Å; N16-G20 WeakPolarHBondContact O-CA 3.45Å; N16-G20 PolarHBondContact O-N 2.88Å
21	W	74.3	Confident	77.7	Confident	47 Å²	47	30.7 Å²	30.7	18%	0.178	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	124.5	175.8	-70.6	102.4	0	0	0	110.5	L12 W14 R66 Y78 R80 A158	L12-W21 HydrophobicContact CB-CB 4.22Å; L12-W21 HydrophobicContact CB-CD2 4.38Å; L12-W21 HydrophobicContact CB-CE3 3.73Å; L12-W21 HydrophobicContact CD1-CB 4.41Å; L12-W21 WeakPolarHBondContact O-CZ3 3.35Å; W14-W21 HydrophobicContact CB-CD2 4.45Å; W14-W21 HydrophobicContact CB-CE3 4.21Å; W14-W21 HydrophobicContact CB-CH2 4.36Å; W14-W21 HydrophobicContact CB-CZ3 4.17Å; W14-W21 HydrophobicContact CE3-CB 4.46Å; W14-W21 AromaticContact CE3-CD1 3.5Å; W14-W21 AromaticContact CE3-CD2 3.85Å; W14-W21 HydrophobicContact CE3-CD2 3.85Å; W14-W21 AromaticContact CE3-CE2 3.73Å; W14-W21 AromaticContact CE3-CG 3.71Å; W14-W21 HydrophobicContact CE3-CG 3.71Å; W14-W21 HydrophobicContact CE3-CZ2 4.46Å; W14-W21 AromaticContact CE3-NE1 3.49Å; W14-W21 AromaticContact CZ3-CD1 3.52Å; W14-W21 HydrophobicContact CZ3-CG 4.12Å; W14-W21 AromaticContact CZ3-NE1 3.66Å; W21-R66 HydrophobicContact CH2-CG 4.31Å; W21-Y78 VanDerWaalsContact CZ3-O 3.24Å; W21-Y78 WeakPolarHBondContact CZ3-O 3.31Å; W21-R80 HydrophobicContact CE3-CB 4.05Å; W21-R80 HydrophobicContact CH2-CB 3.85Å; W21-R80 HydrophobicContact CZ2-CB 4.4Å; W21-R80 HydrophobicContact CZ3-CB 3.64Å; W21-A158 VanDerWaalsContact NE1-CB 3.28Å
22	Q	77	Confident	77.3	Confident	59 Å²	59	33.6 Å²	33.6	28%	0.276	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	138.6	177.8	-67.3	-63.1	-53.7	0	0	111.1	L12 K13 T15 I19 R24	L12-Q22 CarbonylContact C-O 3.59Å; L12-Q22 WeakPolarHBondContact CA-O 3.46Å; K13-Q22 PolarHBondContact N-O 2.91Å; K13-Q22 PolarHBondContact O-N 3.42Å; T15-Q22 HydrophobicContact CG2-CB 3.86Å; T15-Q22 HydrophobicContact CG2-CG 3.85Å; I19-Q22 HydrophobicContact CG2-CG 3.37Å; I19-Q22 PolarHBondContact O-NE2 3.12Å; I19-Q22 VanDerWaalsContact O-NE2 3.07Å; Q22-R24 PolarHBondContact O-N 3.22Å
23	P	84.2	Confident	77.5	Confident	48 Å²	48	31.3 Å²	31.3	31%	0.312	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	133.9	171.5	27.4	-32.9	0	0	0	109.5	E10 L12	E10-P23 HydrophobicContact CG-CB 3.92Å; L12-P23 HydrophobicContact CD2-CB 4.29Å
24	R	88.2	Confident	77.6	Confident	34 Å²	34	31.2 Å²	31.2	13%	0.128	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	138.7	173.6	-65.4	-64.2	176	-114.7	4.6	108.1	E10 L11 K13 Q22 F26 Y35 C36	E10-R24 WeakPolarHBondContact CA-O 3.28Å; L11-R24 PolarHBondContact N-O 2.74Å; L11-R24 PolarHBondContact O-N 2.99Å; L11-R24 VanDerWaalsContact O-O 3.07Å; K13-R24 HydrophobicContact CB-CB 4.35Å; K13-R24 HydrophobicContact CB-CG 3.8Å; K13-R24 HydrophobicContact CD-CG 4.42Å; Q22-R24 PolarHBondContact O-N 3.22Å; R24-F26 HydrophobicContact CB-CD2 4.1Å; R24-F26 HydrophobicContact CB-CE2 3.66Å; R24-F26 HydrophobicContact CB-CZ 4.41Å; R24-F26 WeakPolarHBondContact O-CD2 3.4Å; R24-F26 PolarHBondContact O-N 3.27Å; R24-Y35 HydrophobicContact CB-CD2 4.32Å; R24-Y35 HydrophobicContact CG-CD2 4.13Å; R24-C36 CarbonylContact C-O 3.44Å; R24-C36 VanDerWaalsContact CA-O 3.31Å; R24-C36 WeakPolarHBondContact CA-O 3.39Å; R24-C36 WeakPolarHBondContact CB-O 3.32Å; R24-C36 VanDerWaalsContact CD-O 3.25Å; R24-C36 WeakPolarHBondContact CD-O 3.5Å
25	W	88.8	Confident	78.2	Confident	39 Å²	39	31 Å²	31	15%	0.148	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	109.2	173.8	-167.9	-98.1	0	0	0	109	E8 E10 Y35 C36 E39 V42	E8-W25 HydrophobicContact CB-CZ2 4.35Å; E8-W25 HydrophobicContact CG-CZ2 4.14Å; E10-W25 HydrophobicContact CB-CE3 3.91Å; E10-W25 HydrophobicContact CB-CZ3 4.09Å; W25-Y35 CarbonylContact O-C 3.59Å; W25-Y35 VanDerWaalsContact O-CA 3.23Å; W25-Y35 WeakPolarHBondContact O-CA 3.43Å; W25-C36 HydrophobicContact CB-CB 4.45Å; W25-C36 PolarHBondContact N-O 3.05Å; W25-C36 PolarHBondContact O-N 3.24Å; W25-E39 HydrophobicContact CD2-CB 3.68Å; W25-E39 HydrophobicContact CD2-CG 4.13Å; W25-E39 HydrophobicContact CE3-CB 3.87Å; W25-E39 HydrophobicContact CG-CB 4.09Å; W25-E39 HydrophobicContact CH2-CB 4.27Å; W25-E39 HydrophobicContact CH2-CG 4.13Å; W25-E39 HydrophobicContact CZ2-CB 4.13Å; W25-E39 HydrophobicContact CZ2-CG 3.72Å; W25-E39 HydrophobicContact CZ3-CB 4.16Å; W25-V42 VanDerWaalsContact CD1-CG2 3.48Å; W25-V42 HydrophobicContact CG-CG2 4.32Å
26	F	92.3	Very high	78.6	Confident	1 Å²	1	28.9 Å²	28.9	0%	0.004	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	139.8	177.7	-76.4	-99.3	0	0	0	110	E8 G9 L11 K13 R24 L33 S34 Y35 I79 W90	E8-F26 CarbonylContact C-O 3.57Å; E8-F26 WeakPolarHBondContact CA-O 3.5Å; G9-F26 PolarHBondContact N-O 3.11Å; G9-F26 PolarHBondContact O-N 2.87Å; L11-F26 HydrophobicContact CB-CD2 3.6Å; L11-F26 HydrophobicContact CB-CE2 3.73Å; L11-F26 HydrophobicContact CD1-CB 4.25Å; L11-F26 HydrophobicContact CD1-CD2 3.88Å; L11-F26 HydrophobicContact CD1-CE2 4.36Å; L11-F26 HydrophobicContact CD1-CG 4.03Å; L11-F26 HydrophobicContact CG-CD2 4.04Å; K13-F26 HydrophobicContact CB-CE2 4.23Å; K13-F26 HydrophobicContact CB-CZ 4.05Å; K13-F26 HydrophobicContact CD-CZ 4.27Å; K13-F26 HydrophobicContact CG-CZ 4.37Å; R24-F26 HydrophobicContact CB-CD2 4.1Å; R24-F26 HydrophobicContact CB-CE2 3.66Å; R24-F26 HydrophobicContact CB-CZ 4.41Å; R24-F26 WeakPolarHBondContact O-CD2 3.4Å; R24-F26 PolarHBondContact O-N 3.27Å; F26-L33 HydrophobicContact CB-CD1 4.46Å; F26-L33 HydrophobicContact CD1-CD1 4.11Å; F26-L33 HydrophobicContact CD1-CD2 4.16Å; F26-L33 HydrophobicContact CD1-CG 4.18Å; F26-L33 HydrophobicContact CE1-CD2 4.44Å; F26-S34 CarbonylContact C-O 3.57Å; F26-S34 WeakPolarHBondContact CA-O 3.39Å; F26-Y35 HydrophobicContact CE1-CD1 4.22Å; F26-Y35 HydrophobicContact CE1-CG 4.23Å; F26-Y35 HydrophobicContact CZ-CG 4.4Å; F26-I79 HydrophobicContact CD1-CD1 4.47Å; F26-I79 HydrophobicContact CE1-CD1 3.6Å; F26-I79 HydrophobicContact CE1-CG1 4.36Å; F26-I79 HydrophobicContact CE2-CG2 4.36Å; F26-I79 HydrophobicContact CZ-CD1 3.73Å; F26-I79 HydrophobicContact CZ-CG1 3.98Å; F26-I79 HydrophobicContact CZ-CG2 4.3Å; F26-W90 HydrophobicContact CB-CH2 3.52Å; F26-W90 HydrophobicContact CB-CZ2 3.97Å; F26-W90 HydrophobicContact CB-CZ3 4.16Å
27	V	90.1	Very high	79.2	Confident	15 Å²	15	31.2 Å²	31.2	9%	0.091	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	110.1	175.7	-174.6	0	0	0	0	107.4	E8 S34 V42	E8-V27 HydrophobicContact CB-CG2 4.24Å; V27-S34 PolarHBondContact N-O 3.25Å; V27-S34 PolarHBondContact O-N 2.89Å; V27-V42 HydrophobicContact CG2-CG1 4.44Å; V27-V42 HydrophobicContact CG2-CG2 4.27Å
28	L	91.4	Very high	80.2	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	121.7	165.2	175.2	60.5	0	0	0	107.8	I5 R6 K7 L33 L52 W90 A93 L94 A97	I5-L28 HydrophobicContact CG2-CD2 3.89Å; R6-L28 VanDerWaalsContact CA-O 3.24Å; R6-L28 WeakPolarHBondContact CA-O 3.43Å; K7-L28 HydrophobicContact CB-CB 4.42Å; K7-L28 PolarHBondContact N-O 3.28Å; K7-L28 PolarHBondContact O-N 3.4Å; L28-L33 HydrophobicContact CB-CD1 3.97Å; L28-L33 HydrophobicContact CD1-CB 4.48Å; L28-L52 HydrophobicContact CD1-CD1 3.45Å; L28-L52 VanDerWaalsContact CD1-CD1 3.45Å; L28-W90 HydrophobicContact CB-CZ3 4.1Å; L28-A93 HydrophobicContact CD2-CB 3.79Å; L28-L94 HydrophobicContact CD1-CD2 4.39Å; L28-L94 HydrophobicContact CD2-CD2 4.21Å; L28-A97 HydrophobicContact CD1-CB 4.1Å; L28-A97 HydrophobicContact CD2-CB 4.14Å
29	D	86.9	Confident	81.2	Confident	89 Å²	89	38 Å²	38	48%	0.476	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	109.1	173.4	-168.7	13	0	0	0	110.2	N31 V32	D29-N31 PolarHBondContact O-N 3.07Å; D29-N31 VanDerWaalsContact O-N 3.1Å; D29-V32 PolarHBondContact N-O 3.02Å; D29-V32 PolarHBondContact O-N 3.14Å; D29-V32 VanDerWaalsContact O-N 3.14Å
30	G	86.3	Confident	81.8	Confident	21 Å²	21	38.1 Å²	38.1	22%	0.216	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	-111.6	-171	0	0	0	0	0	110.7	I5 A97	I5-G30 PolarHBondContact O-N 2.89Å; G30-A97 WeakPolarHBondContact O-CB 3.32Å
31	N	86.3	Confident	81.9	Confident	28 Å²	28	41 Å²	41	15%	0.15	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	3.7	-178.6	-158.8	47.1	0	0	0	113.4	D29 N51 L52 S53 A97 S101	D29-N31 PolarHBondContact O-N 3.07Å; D29-N31 VanDerWaalsContact O-N 3.1Å; N31-N51 PolarHBondContact ND2-OD1 2.77Å; N31-L52 WeakPolarHBondContact O-CB 3.28Å; N31-L52 PolarHBondContact O-N 3.42Å; N31-S53 WeakPolarHBondContact ND2-CB 3.11Å; N31-S53 PolarHBondContact ND2-N 3.27Å; N31-S53 PolarHBondContact ND2-OG 3.23Å; N31-A97 PolarHBondContact OD1-O 3.32Å; N31-S101 PolarHBondContact ND2-OG 3.25Å
32	V	84.6	Confident	81.2	Confident	63 Å²	63	41.3 Å²	41.3	38%	0.382	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	123.4	179.6	-178.3	0	0	0	0	108.2	D29	D29-V32 PolarHBondContact N-O 3.02Å; D29-V32 PolarHBondContact O-N 3.14Å; D29-V32 VanDerWaalsContact O-N 3.14Å
33	L	88.7	Confident	80.2	Confident	4 Å²	4	43.3 Å²	43.3	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	118.3	169.1	-178.9	71.4	0	0	0	108.9	F26 L28 S49 V50 L52 I69 W90 L94	F26-L33 HydrophobicContact CB-CD1 4.46Å; F26-L33 HydrophobicContact CD1-CD1 4.11Å; F26-L33 HydrophobicContact CD1-CD2 4.16Å; F26-L33 HydrophobicContact CD1-CG 4.18Å; F26-L33 HydrophobicContact CE1-CD2 4.44Å; L28-L33 HydrophobicContact CB-CD1 3.97Å; L28-L33 HydrophobicContact CD1-CB 4.48Å; L33-S49 CarbonylContact O-C 3.58Å; L33-S49 VanDerWaalsContact O-CA 3.26Å; L33-S49 WeakPolarHBondContact O-CA 3.39Å; L33-V50 HydrophobicContact CB-CG2 4.12Å; L33-V50 PolarHBondContact N-O 3.21Å; L33-V50 PolarHBondContact O-N 3.04Å; L33-L52 HydrophobicContact CB-CD2 3.96Å; L33-L52 HydrophobicContact CB-CG 4.19Å; L33-L52 HydrophobicContact CD2-CD2 4.4Å; L33-I69 HydrophobicContact CD2-CD1 3.09Å; L33-W90 HydrophobicContact CD1-CZ3 3.97Å; L33-L94 HydrophobicContact CD1-CD2 4.12Å; L33-L94 HydrophobicContact CD2-CD2 3.98Å; L33-L94 HydrophobicContact CG-CD2 4.48Å
34	S	83.5	Confident	78.9	Confident	20 Å²	20	48.7 Å²	48.7	14%	0.14	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	155.5	176.5	-54.1	0	0	0	0	110.8	F26 V27 C46 G48 S49	F26-S34 CarbonylContact C-O 3.57Å; F26-S34 WeakPolarHBondContact CA-O 3.39Å; V27-S34 PolarHBondContact N-O 3.25Å; V27-S34 PolarHBondContact O-N 2.89Å; S34-C46 WeakPolarHBondContact CB-SG 3.48Å; S34-G48 CarbonylContact C-O 3.48Å; S34-G48 VanDerWaalsContact CA-O 3.26Å; S34-G48 WeakPolarHBondContact CA-O 3.26Å; S34-S49 VanDerWaalsContact OG-CB 3.27Å; S34-S49 WeakPolarHBondContact OG-CB 3.43Å
35	Y	82.6	Confident	77.3	Confident	19 Å²	19	49 Å²	49	8%	0.075	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	145	170.8	69.6	-93.9	0	0	0	111.7	K13 R24 W25 F26 C46 K47 G48 F77	K13-Y35 HydrophobicContact CD-CD1 4.43Å; K13-Y35 HydrophobicContact CD-CD2 4.29Å; K13-Y35 HydrophobicContact CD-CE1 4.18Å; K13-Y35 HydrophobicContact CD-CE2 4.06Å; K13-Y35 HydrophobicContact CD-CG 4.49Å; R24-Y35 HydrophobicContact CB-CD2 4.32Å; R24-Y35 HydrophobicContact CG-CD2 4.13Å; W25-Y35 CarbonylContact O-C 3.59Å; W25-Y35 VanDerWaalsContact O-CA 3.23Å; W25-Y35 WeakPolarHBondContact O-CA 3.43Å; F26-Y35 HydrophobicContact CE1-CD1 4.22Å; F26-Y35 HydrophobicContact CE1-CG 4.23Å; F26-Y35 HydrophobicContact CZ-CG 4.4Å; Y35-C46 CarbonylContact O-C 3.53Å; Y35-K47 HydrophobicContact CD2-CB 3.75Å; Y35-K47 HydrophobicContact CE2-CB 3.41Å; Y35-K47 VanDerWaalsContact CE2-CB 3.41Å; Y35-K47 WeakPolarHBondContact O-CA 3.39Å; Y35-K47 WeakPolarHBondContact O-CB 3.48Å; Y35-K47 PolarHBondContact O-N 3Å; Y35-G48 PolarHBondContact N-O 3.22Å; Y35-G48 PolarHBondContact O-N 3.46Å; Y35-F77 HydrophobicContact CE1-CE2 4.45Å; Y35-F77 HydrophobicContact CE1-CZ 4.25Å
36	C	75.2	Confident	75.9	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	169.4	177.7	-50.4	0	0	0	0	110.3	R24 W25 S38 V42 C46	R24-C36 CarbonylContact C-O 3.44Å; R24-C36 VanDerWaalsContact CA-O 3.31Å; R24-C36 WeakPolarHBondContact CA-O 3.39Å; R24-C36 WeakPolarHBondContact CB-O 3.32Å; R24-C36 VanDerWaalsContact CD-O 3.25Å; R24-C36 WeakPolarHBondContact CD-O 3.5Å; W25-C36 HydrophobicContact CB-CB 4.45Å; W25-C36 PolarHBondContact N-O 3.05Å; W25-C36 PolarHBondContact O-N 3.24Å; C36-S38 VanDerWaalsContact C-N 3.34Å; C36-S38 WeakPolarHBondContact CB-O 3.39Å; C36-V42 HydrophobicContact CB-CG2 4.27Å; C36-C46 VanDerWaalsContact SG-CA 3.6Å; C36-C46 PolarHBondContact SG-SG 3.04Å
37	I	71.9	Confident	74.6	Confident	65 Å²	65	51.9 Å²	51.9	33%	0.333	31%	0.306	S	S	.	.	S	Bend	trans	-62.9	-46.1	172.2	-55.7	-175.1	0	0	0	109.9	E41 K47	I37-E41 WeakPolarHBondContact CB-OE2 3.34Å; I37-E41 VanDerWaalsContact CD1-OE2 3.32Å; I37-E41 WeakPolarHBondContact CD1-OE2 3.23Å; I37-E41 VanDerWaalsContact CG1-OE2 3.31Å; I37-E41 WeakPolarHBondContact CG1-OE2 3.29Å; I37-K47 HydrophobicContact CG1-CD 4.07Å; I37-K47 VanDerWaalsContact CG1-CE 3.44Å; I37-K47 HydrophobicContact CG1-CG 3.79Å
38	S	74.4	Confident	73.5	Confident	44 Å²	44	51.6 Å²	51.6	31%	0.308	31%	0.306	S	S	.	.	S	Bend	trans	-146.4	168.4	-178.4	69.5	0	0	0	0	111.3	C36 A40 E41	C36-S38 VanDerWaalsContact C-N 3.34Å; C36-S38 WeakPolarHBondContact CB-O 3.39Å; S38-A40 VanDerWaalsContact C-N 3.28Å; S38-A40 PolarHBondContact O-N 3.26Å; S38-E41 PolarHBondContact O-N 3.06Å
39	E	76	Confident	72.8	Confident	121 Å²	121	54.6 Å²	54.6	57%	0.565	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-58.3	-39.1	174.7	-173.6	177.1	-166.6	0	0	112.1	W25 E41 V42	W25-E39 HydrophobicContact CD2-CB 3.68Å; W25-E39 HydrophobicContact CD2-CG 4.13Å; W25-E39 HydrophobicContact CE3-CB 3.87Å; W25-E39 HydrophobicContact CG-CB 4.09Å; W25-E39 HydrophobicContact CH2-CB 4.27Å; W25-E39 HydrophobicContact CH2-CG 4.13Å; W25-E39 HydrophobicContact CZ2-CB 4.13Å; W25-E39 HydrophobicContact CZ2-CG 3.72Å; W25-E39 HydrophobicContact CZ3-CB 4.16Å; E39-E41 PolarHBondContact O-N 2.87Å; E39-V42 WeakPolarHBondContact O-CB 3.43Å; E39-V42 WeakPolarHBondContact O-CG2 3.4Å; E39-V42 PolarHBondContact O-N 2.97Å
40	A	72.7	Confident	72.4	Confident	75 Å²	75	51.2 Å²	51.2	62%	0.62	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-66.2	-25.2	-179.3	0	0	0	0	0	113.5	S38 S43	S38-A40 VanDerWaalsContact C-N 3.28Å; S38-A40 PolarHBondContact O-N 3.26Å; A40-S43 PolarHBondContact O-OG 3.02Å
41	E	65.1	Low	72.2	Confident	70 Å²	70	53.4 Å²	53.4	33%	0.327	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-87.7	-5.3	179.3	-77.5	-177.6	-150	0	0	113.6	I37 S38 E39 S43 H44 G45	I37-E41 WeakPolarHBondContact CB-OE2 3.34Å; I37-E41 VanDerWaalsContact CD1-OE2 3.32Å; I37-E41 WeakPolarHBondContact CD1-OE2 3.23Å; I37-E41 VanDerWaalsContact CG1-OE2 3.31Å; I37-E41 WeakPolarHBondContact CG1-OE2 3.29Å; S38-E41 PolarHBondContact O-N 3.06Å; E39-E41 PolarHBondContact O-N 2.87Å; E41-S43 PolarHBondContact O-N 3.05Å; E41-S43 VanDerWaalsContact O-N 3.08Å; E41-H44 WeakPolarHBondContact O-CA 3.39Å; E41-H44 PolarHBondContact O-N 3.14Å; E41-G45 PolarHBondContact O-N 3.14Å
42	V	58.9	Low	72.1	Confident	52 Å²	52	52 Å²	52	32%	0.315	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-31.8	178.1	176.4	0	0	0	0	111.7	W25 V27 C36 E39	W25-V42 VanDerWaalsContact CD1-CG2 3.48Å; W25-V42 HydrophobicContact CG-CG2 4.32Å; V27-V42 HydrophobicContact CG2-CG1 4.44Å; V27-V42 HydrophobicContact CG2-CG2 4.27Å; C36-V42 HydrophobicContact CB-CG2 4.27Å; E39-V42 WeakPolarHBondContact O-CB 3.43Å; E39-V42 WeakPolarHBondContact O-CG2 3.4Å; E39-V42 PolarHBondContact O-N 2.97Å
43	S	56.2	Low	71.9	Confident	101 Å²	101	50.3 Å²	50.3	71%	0.706	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-21.6	175.3	57.3	0	0	0	0	114.7	A40 E41	A40-S43 PolarHBondContact O-OG 3.02Å; E41-S43 PolarHBondContact O-N 3.05Å; E41-S43 VanDerWaalsContact O-N 3.08Å
44	H	56.9	Low	71.4	Confident	161 Å²	161	54.9 Å²	54.9	75%	0.745	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-6.3	-176.9	-65.3	84.4	0	0	0	112.9	E41	E41-H44 WeakPolarHBondContact O-CA 3.39Å; E41-H44 PolarHBondContact O-N 3.14Å
45	G	54.1	Low	71.3	Confident	42 Å²	42	54 Å²	54	43%	0.433	32%	0.318	S	S	.	.			trans	117.1	144.6	-178.8	0	0	0	0	0	111.9	E41	E41-G45 PolarHBondContact O-N 3.14Å
46	C	59.4	Low	71.2	Confident	40 Å²	40	55 Å²	55	27%	0.27	32%	0.324	S	S	.	.			trans	-71.7	162.3	175.1	-60.6	0	0	0	0	110.6	S34 Y35 C36 P297	S34-C46 WeakPolarHBondContact CB-SG 3.48Å; Y35-C46 CarbonylContact O-C 3.53Å; C36-C46 VanDerWaalsContact SG-CA 3.6Å; C36-C46 PolarHBondContact SG-SG 3.04Å; C46-P297 WeakPolarHBondContact O-CB 3.25Å; C46-P297 WeakPolarHBondContact O-CG 3.39Å
47	K	64.7	Low	71.7	Confident	60 Å²	60	56.8 Å²	56.8	26%	0.261	33%	0.334	S	S	.	.	S	Bend	trans	-90.3	-17.1	170.2	-89.2	-109.9	177.9	-170.8	0	113.5	Y35 I37 P297	Y35-K47 HydrophobicContact CD2-CB 3.75Å; Y35-K47 HydrophobicContact CE2-CB 3.41Å; Y35-K47 VanDerWaalsContact CE2-CB 3.41Å; Y35-K47 WeakPolarHBondContact O-CA 3.39Å; Y35-K47 WeakPolarHBondContact O-CB 3.48Å; Y35-K47 PolarHBondContact O-N 3Å; I37-K47 HydrophobicContact CG1-CD 4.07Å; I37-K47 VanDerWaalsContact CG1-CE 3.44Å; I37-K47 HydrophobicContact CG1-CG 3.79Å; K47-P297 WeakPolarHBondContact O-CG 3.27Å
48	G	68.2	Low	72.1	Confident	8 Å²	8	57 Å²	57	8%	0.082	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.4	153.8	171.7	0	0	0	0	0	109.7	S34 Y35 P297	S34-G48 CarbonylContact C-O 3.48Å; S34-G48 VanDerWaalsContact CA-O 3.26Å; S34-G48 WeakPolarHBondContact CA-O 3.26Å; Y35-G48 PolarHBondContact N-O 3.22Å; Y35-G48 PolarHBondContact O-N 3.46Å; G48-P297 VanDerWaalsContact CA-CG 3.44Å
49	S	77.1	Confident	72.3	Confident	64 Å²	64	57.7 Å²	57.7	45%	0.448	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	148	168.1	62.3	0	0	0	0	110.2	L33 S34	L33-S49 CarbonylContact O-C 3.58Å; L33-S49 VanDerWaalsContact O-CA 3.26Å; L33-S49 WeakPolarHBondContact O-CA 3.39Å; S34-S49 VanDerWaalsContact OG-CB 3.27Å; S34-S49 WeakPolarHBondContact OG-CB 3.43Å
50	V	78.4	Confident	72	Confident	17 Å²	17	53 Å²	53	10%	0.103	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	146.5	176	-63.9	0	0	0	0	110.5	L33 I69 V71 F77	L33-V50 HydrophobicContact CB-CG2 4.12Å; L33-V50 PolarHBondContact N-O 3.21Å; L33-V50 PolarHBondContact O-N 3.04Å; V50-I69 HydrophobicContact CG2-CG2 4.4Å; V50-V71 HydrophobicContact CB-CG2 4.29Å; V50-V71 HydrophobicContact CG1-CG2 3.92Å; V50-F77 HydrophobicContact CB-CE2 4.35Å; V50-F77 HydrophobicContact CG1-CE2 3.39Å; V50-F77 HydrophobicContact CG1-CZ 3.7Å; V50-F77 HydrophobicContact CG2-CE2 4.02Å
51	N	80.3	Confident	71.7	Confident	67 Å²	67	53.3 Å²	53.3	36%	0.358	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	116.4	173.1	-172.6	-3.8	0	0	0	109.4	N31 S53 D54 C55	N31-N51 PolarHBondContact ND2-OD1 2.77Å; N51-S53 PolarHBondContact O-N 3.2Å; N51-S53 VanDerWaalsContact O-N 3.14Å; N51-S53 PolarHBondContact OD1-N 3.49Å; N51-D54 PolarHBondContact ND2-OD2 3.3Å; N51-D54 PolarHBondContact O-N 2.85Å; N51-C55 PolarHBondContact O-SG 2.74Å
52	L	85.4	Confident	71.5	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-65.2	-19	-176.1	-67.3	178.9	0	0	0	113.7	L28 N31 L33 D54 C55 L94 A97 K98	L28-L52 HydrophobicContact CD1-CD1 3.45Å; L28-L52 VanDerWaalsContact CD1-CD1 3.45Å; N31-L52 WeakPolarHBondContact O-CB 3.28Å; N31-L52 PolarHBondContact O-N 3.42Å; L33-L52 HydrophobicContact CB-CD2 3.96Å; L33-L52 HydrophobicContact CB-CG 4.19Å; L33-L52 HydrophobicContact CD2-CD2 4.4Å; L52-D54 PolarHBondContact O-N 3.13Å; L52-C55 HydrophobicContact CD2-CB 4.41Å; L52-C55 PolarHBondContact O-N 2.96Å; L52-L94 HydrophobicContact CD1-CD2 3.66Å; L52-L94 HydrophobicContact CD2-CD2 3.9Å; L52-L94 HydrophobicContact CG-CD2 4.44Å; L52-A97 HydrophobicContact CD1-CB 3.88Å; L52-K98 WeakPolarHBondContact O-CD 3.46Å
53	S	80.5	Confident	72.1	Confident	27 Å²	27	59 Å²	59	19%	0.189	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-58.4	-35.7	170.4	-80.4	0	0	0	0	112.7	N31 N51 S101	N31-S53 WeakPolarHBondContact ND2-CB 3.11Å; N31-S53 PolarHBondContact ND2-N 3.27Å; N31-S53 PolarHBondContact ND2-OG 3.23Å; N51-S53 PolarHBondContact O-N 3.2Å; N51-S53 VanDerWaalsContact O-N 3.14Å; N51-S53 PolarHBondContact OD1-N 3.49Å; S53-S101 VanDerWaalsContact OG-CB 3.24Å; S53-S101 WeakPolarHBondContact OG-CB 3.48Å; S53-S101 PolarHBondContact OG-OG 2.98Å
54	D	77.7	Confident	73.2	Confident	99 Å²	99	59.4 Å²	59.4	53%	0.529	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-97.2	4.4	-175.4	-52.6	-46.9	0	0	0	111.4	N51 L52 P72	N51-D54 PolarHBondContact ND2-OD2 3.3Å; N51-D54 PolarHBondContact O-N 2.85Å; L52-D54 PolarHBondContact O-N 3.13Å; D54-P72 WeakPolarHBondContact O-CD 3.48Å
55	C	80.6	Confident	74.4	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.014	30%	0.299	C	S	.	.			trans	-109.4	145.1	-176.8	-58.8	0	0	0	0	112.3	N51 L52 I69 V70 K98	N51-C55 PolarHBondContact O-SG 2.74Å; L52-C55 HydrophobicContact CD2-CB 4.41Å; L52-C55 PolarHBondContact O-N 2.96Å; C55-I69 HydrophobicContact CB-CG2 3.76Å; C55-V70 CarbonylContact C-O 3.58Å; C55-V70 VanDerWaalsContact CA-O 3.26Å; C55-V70 WeakPolarHBondContact CA-O 3.13Å; C55-K98 WeakPolarHBondContact O-CE 3.45Å; C55-K98 PolarHBondContact O-NZ 2.94Å
56	E	80.6	Confident	75.7	Confident	41 Å²	41	51 Å²	51	19%	0.192	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	135	161.6	-58.4	-178.5	168.6	0	0	109.5	I69 V70 P72	E56-I69 CarbonylContact O-C 3.47Å; E56-I69 WeakPolarHBondContact O-CA 3.35Å; E56-V70 HydrophobicContact CB-CB 4.31Å; E56-V70 PolarHBondContact N-O 3.04Å; E56-V70 PolarHBondContact O-N 2.83Å; E56-P72 HydrophobicContact CG-CG 4.17Å
57	V	85.8	Confident	76.8	Confident	37 Å²	37	49.1 Å²	49.1	22%	0.224	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	109.6	178.3	-177.1	0	0	0	0	108	F67 E68 I69 L91 L94	V57-F67 HydrophobicContact CG1-CD2 4.39Å; V57-E68 CarbonylContact C-O 3.58Å; V57-E68 WeakPolarHBondContact CA-O 3.17Å; V57-I69 HydrophobicContact CG2-CG1 4.47Å; V57-L91 HydrophobicContact CG1-CD2 3.61Å; V57-L94 HydrophobicContact CG1-CD1 4.07Å; V57-L94 HydrophobicContact CG2-CB 4.39Å
58	N	80.4	Confident	77.5	Confident	70 Å²	70	47.7 Å²	47.7	37%	0.374	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	118.1	-172.7	-64.8	-40.9	0	0	0	110.2	F67 E68	N58-F67 CarbonylContact O-C 3.59Å; N58-F67 VanDerWaalsContact O-CA 3.26Å; N58-F67 WeakPolarHBondContact O-CA 3.33Å; N58-F67 WeakPolarHBondContact O-CB 3.48Å; N58-E68 HydrophobicContact CB-CB 4.37Å; N58-E68 PolarHBondContact N-O 3.12Å; N58-E68 PolarHBondContact O-N 3.43Å
59	A	79.1	Confident	78.2	Confident	57 Å²	57	47.3 Å²	47.3	47%	0.471	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	126	175	0	0	0	0	0	109.4	R87 L91	A59-R87 VanDerWaalsContact CB-NH2 3.33Å; A59-L91 HydrophobicContact CB-CD1 3.78Å
60	D	70.4	Confident	78	Confident	23 Å²	23	45.2 Å²	45.2	12%	0.123	24%	0.242	C	C	.	.			trans	-66.7	140.6	175.5	-172.6	-138.2	0	0	0	112	D63 R66 R87	D60-D63 WeakPolarHBondContact OD1-CA 3.45Å; D60-D63 VanDerWaalsContact OD1-CB 3.31Å; D60-D63 WeakPolarHBondContact OD1-CB 3.48Å; D60-D63 PolarHBondContact OD1-N 3.34Å; D60-R66 HydrophobicContact CB-CB 3.99Å; D60-R66 HydrophobicContact CB-CG 4.35Å; D60-R66 VanDerWaalsContact CG-CZ 3.43Å; D60-R66 PolarHBondContact N-O 2.94Å; D60-R66 IonicContact OD1-CZ 2.6Å; D60-R66 IonicContact OD1-NE 2.77Å; D60-R66 PolarHBondContact OD1-NE 3.14Å; D60-R66 IonicContact OD1-NH2 3.4Å; D60-R66 PolarHBondContact OD1-NH2 3.06Å; D60-R66 IonicContact OD2-CZ 3.12Å; D60-R66 IonicContact OD2-NE 3.09Å; D60-R66 IonicContact OD2-NH2 2.91Å; D60-R66 PolarHBondContact OD2-NH2 3.41Å; D60-R87 VanDerWaalsContact N-NH2 3.15Å; D60-R87 PolarHBondContact O-NH2 3.2Å
61	S	66.4	Low	77.7	Confident	82 Å²	82	45 Å²	45	57%	0.573	24%	0.24	S	C	*	.	S	Bend	trans	-82.9	-24.6	-176.9	50.9	0	0	0	0	113.6
62	Y	59.9	Low	76.7	Confident	203 Å²	203	44.4 Å²	44.4	80%	0.796	24%	0.24	S	C	*	.	S	Bend	trans	-106.6	-48.2	-173.4	-60.2	-79.4	0	0	0	112.7	H64	Y62-H64 PolarHBondContact O-N 3.21Å
63	D	72	Confident	74.9	Confident	39 Å²	39	45.5 Å²	45.5	21%	0.209	25%	0.251	C	S	.	.			trans	-90.5	99.5	172	-174.3	-7.6	0	0	0	110.2	D60 C65 R66 R80	D60-D63 WeakPolarHBondContact OD1-CA 3.45Å; D60-D63 VanDerWaalsContact OD1-CB 3.31Å; D60-D63 WeakPolarHBondContact OD1-CB 3.48Å; D60-D63 PolarHBondContact OD1-N 3.34Å; D63-C65 PolarHBondContact O-N 3.21Å; D63-C65 VanDerWaalsContact O-N 3.1Å; D63-C65 WeakPolarHBondContact OD1-CB 3.24Å; D63-C65 PolarHBondContact OD1-N 3.32Å; D63-R66 HydrophobicContact CB-CB 3.78Å; D63-R66 WeakPolarHBondContact O-CB 3.45Å; D63-R66 PolarHBondContact O-N 2.78Å; D63-R80 IonicContact OD1-NE 2.8Å; D63-R80 IonicContact OD2-CZ 3.42Å; D63-R80 IonicContact OD2-NE 3.44Å; D63-R80 PolarHBondContact OD2-NE 2.87Å; D63-R80 IonicContact OD2-NH2 2.99Å
64	H	79.8	Confident	73.7	Confident	108 Å²	108	50.2 Å²	50.2	50%	0.5	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-9	179.6	-58.2	-45.3	0	0	0	114.5	Y62 T84 R87	Y62-H64 PolarHBondContact O-N 3.21Å; H64-T84 HydrophobicContact CB-CG2 3.82Å; H64-R87 WeakPolarHBondContact O-CD 3.42Å
65	C	81	Confident	72.9	Confident	18 Å²	18	49.1 Å²	49.1	12%	0.122	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-4.4	170.9	-67	0	0	0	0	112.8	D63 R80 A81 T83 T84	D63-C65 PolarHBondContact O-N 3.21Å; D63-C65 VanDerWaalsContact O-N 3.1Å; D63-C65 WeakPolarHBondContact OD1-CB 3.24Å; D63-C65 PolarHBondContact OD1-N 3.32Å; C65-R80 HydrophobicContact CB-CG 4.14Å; C65-R80 WeakPolarHBondContact O-CA 3.38Å; C65-A81 PolarHBondContact O-N 3.38Å; C65-T83 VanDerWaalsContact SG-C 3.53Å; C65-T84 PolarHBondContact SG-N 2.96Å; C65-T84 VanDerWaalsContact SG-N 3.36Å
66	R	82.6	Confident	72.3	Confident	8 Å²	8	51.1 Å²	51.1	3%	0.03	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	151.6	-169.5	-166.4	178.9	72.1	129.2	-11	113.4	W21 D60 D63 E68 I79 R87 A161	W21-R66 HydrophobicContact CH2-CG 4.31Å; D60-R66 HydrophobicContact CB-CB 3.99Å; D60-R66 HydrophobicContact CB-CG 4.35Å; D60-R66 VanDerWaalsContact CG-CZ 3.43Å; D60-R66 PolarHBondContact N-O 2.94Å; D60-R66 IonicContact OD1-CZ 2.6Å; D60-R66 IonicContact OD1-NE 2.77Å; D60-R66 PolarHBondContact OD1-NE 3.14Å; D60-R66 IonicContact OD1-NH2 3.4Å; D60-R66 PolarHBondContact OD1-NH2 3.06Å; D60-R66 IonicContact OD2-CZ 3.12Å; D60-R66 IonicContact OD2-NE 3.09Å; D60-R66 IonicContact OD2-NH2 2.91Å; D60-R66 PolarHBondContact OD2-NH2 3.41Å; D63-R66 HydrophobicContact CB-CB 3.78Å; D63-R66 WeakPolarHBondContact O-CB 3.45Å; D63-R66 PolarHBondContact O-N 2.78Å; R66-E68 IonicContact CZ-OE1 3.58Å; R66-E68 IonicContact NH1-OE1 2.68Å; R66-I79 WeakPolarHBondContact CA-O 3.3Å; R66-I79 WeakPolarHBondContact CG-O 3.39Å; R66-R87 PolarHBondContact O-NE 3.13Å; R66-R87 PolarHBondContact O-NH2 2.77Å; R66-A161 PolarHBondContact NH1-O 3.44Å; R66-A161 PolarHBondContact NH2-O 3.25Å
67	F	82.3	Confident	72.1	Confident	1 Å²	1	49.6 Å²	49.6	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	165.9	170.4	63.9	-79.8	0	0	0	110.3	L11 V57 N58 I69 I79 R87 W90 L91 L94	L11-F67 HydrophobicContact CD1-CE1 4.36Å; L11-F67 HydrophobicContact CD1-CZ 3.93Å; V57-F67 HydrophobicContact CG1-CD2 4.39Å; N58-F67 CarbonylContact O-C 3.59Å; N58-F67 VanDerWaalsContact O-CA 3.26Å; N58-F67 WeakPolarHBondContact O-CA 3.33Å; N58-F67 WeakPolarHBondContact O-CB 3.48Å; F67-I69 HydrophobicContact CD2-CG1 4.27Å; F67-I69 HydrophobicContact CE2-CD1 4.12Å; F67-I69 HydrophobicContact CE2-CG1 4.15Å; F67-I79 HydrophobicContact CD1-CB 4.5Å; F67-I79 HydrophobicContact CD2-CB 4.39Å; F67-I79 HydrophobicContact CE1-CB 4.12Å; F67-I79 HydrophobicContact CE1-CG2 3.74Å; F67-I79 HydrophobicContact CE2-CB 3.99Å; F67-I79 HydrophobicContact CE2-CD1 3.96Å; F67-I79 HydrophobicContact CE2-CG2 4.11Å; F67-I79 HydrophobicContact CZ-CB 3.86Å; F67-I79 HydrophobicContact CZ-CD1 4.31Å; F67-I79 HydrophobicContact CZ-CG2 3.5Å; F67-I79 VanDerWaalsContact CZ-CG2 3.5Å; F67-I79 PolarHBondContact N-O 3.19Å; F67-I79 PolarHBondContact O-N 2.88Å; F67-R87 HydrophobicContact CD1-CG 3.81Å; F67-R87 HydrophobicContact CE1-CG 4.44Å; F67-W90 HydrophobicContact CE1-CB 4.23Å; F67-W90 HydrophobicContact CZ-CB 4.05Å; F67-W90 HydrophobicContact CZ-CG 4.5Å; F67-L91 HydrophobicContact CB-CD2 3.84Å; F67-L91 HydrophobicContact CD2-CD2 4.15Å; F67-L91 HydrophobicContact CG-CD2 3.99Å; F67-L94 HydrophobicContact CD2-CD1 4.25Å; F67-L94 HydrophobicContact CE2-CD1 3.6Å; F67-L94 HydrophobicContact CZ-CD1 4.26Å
68	E	78.7	Confident	71.7	Confident	30 Å²	30	49.6 Å²	49.6	14%	0.14	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	143.5	-176.9	-62.2	173.7	-169.2	0	0	109.8	V57 N58 R66 V70 F77 Y78	V57-E68 CarbonylContact C-O 3.58Å; V57-E68 WeakPolarHBondContact CA-O 3.17Å; N58-E68 HydrophobicContact CB-CB 4.37Å; N58-E68 PolarHBondContact N-O 3.12Å; N58-E68 PolarHBondContact O-N 3.43Å; R66-E68 IonicContact CZ-OE1 3.58Å; R66-E68 IonicContact NH1-OE1 2.68Å; E68-V70 HydrophobicContact CB-CG2 4.49Å; E68-F77 CarbonylContact C-O 3.54Å; E68-F77 VanDerWaalsContact CA-O 3.27Å; E68-F77 WeakPolarHBondContact CA-O 3.34Å; E68-Y78 VanDerWaalsContact CD-CE1 3.47Å; E68-Y78 HydrophobicContact CG-CD1 3.63Å; E68-Y78 HydrophobicContact CG-CE1 4.03Å; E68-Y78 WeakPolarHBondContact OE1-CD1 3.2Å; E68-Y78 VanDerWaalsContact OE1-CE1 3.28Å; E68-Y78 WeakPolarHBondContact OE1-CE1 3.3Å
69	I	83.7	Confident	71.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	111.8	170.4	-57.6	-178.5	0	0	0	107.2	L33 V50 C55 E56 V57 F67 C76 F77 I79 L94	L33-I69 HydrophobicContact CD2-CD1 3.09Å; V50-I69 HydrophobicContact CG2-CG2 4.4Å; C55-I69 HydrophobicContact CB-CG2 3.76Å; E56-I69 CarbonylContact O-C 3.47Å; E56-I69 WeakPolarHBondContact O-CA 3.35Å; V57-I69 HydrophobicContact CG2-CG1 4.47Å; F67-I69 HydrophobicContact CD2-CG1 4.27Å; F67-I69 HydrophobicContact CE2-CD1 4.12Å; F67-I69 HydrophobicContact CE2-CG1 4.15Å; I69-C76 CarbonylContact O-C 3.52Å; I69-C76 WeakPolarHBondContact O-CA 3.3Å; I69-F77 HydrophobicContact CB-CB 4.32Å; I69-F77 HydrophobicContact CB-CD2 4.27Å; I69-F77 HydrophobicContact CG2-CD2 4.43Å; I69-F77 PolarHBondContact N-O 2.81Å; I69-F77 PolarHBondContact O-N 2.67Å; I69-I79 HydrophobicContact CD1-CD1 3.61Å; I69-I79 HydrophobicContact CG1-CD1 3.96Å; I69-L94 HydrophobicContact CD1-CD1 4.1Å; I69-L94 HydrophobicContact CD1-CD2 4.48Å
70	V	72.6	Confident	72.1	Confident	21 Å²	21	47.6 Å²	47.6	13%	0.127	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	117.8	-176.1	-175.4	0	0	0	0	108.2	C55 E56 E68 P72 C76	C55-V70 CarbonylContact C-O 3.58Å; C55-V70 VanDerWaalsContact CA-O 3.26Å; C55-V70 WeakPolarHBondContact CA-O 3.13Å; E56-V70 HydrophobicContact CB-CB 4.31Å; E56-V70 PolarHBondContact N-O 3.04Å; E56-V70 PolarHBondContact O-N 2.83Å; E68-V70 HydrophobicContact CB-CG2 4.49Å; V70-P72 WeakPolarHBondContact O-CD 3.38Å; V70-C76 HydrophobicContact CG2-CB 4.36Å
71	V	72.5	Confident	73	Confident	11 Å²	11	46.6 Å²	46.6	7%	0.067	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	109.8	162.2	-173.2	0	0	0	0	106.2	V50 G73 E74 Q75	V50-V71 HydrophobicContact CB-CG2 4.29Å; V50-V71 HydrophobicContact CG1-CG2 3.92Å; V71-G73 PolarHBondContact O-N 3.31Å; V71-G73 VanDerWaalsContact O-N 3.1Å; V71-E74 HydrophobicContact CB-CB 3.98Å; V71-E74 HydrophobicContact CG1-CB 3.74Å; V71-E74 HydrophobicContact CG1-CG 3.93Å; V71-E74 WeakPolarHBondContact CG1-OE2 3.4Å; V71-E74 PolarHBondContact O-N 3.23Å; V71-Q75 PolarHBondContact N-O 3.44Å; V71-Q75 PolarHBondContact O-N 3.47Å
72	P	58.4	Low	74	Confident	56 Å²	56	50.9 Å²	50.9	36%	0.364	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	119.2	-173.6	-26.3	36.6	0	0	0	111.3	D54 E56 V70 E74	D54-P72 WeakPolarHBondContact O-CD 3.48Å; E56-P72 HydrophobicContact CG-CG 4.17Å; V70-P72 WeakPolarHBondContact O-CD 3.38Å; P72-E74 VanDerWaalsContact C-N 3.34Å; P72-E74 PolarHBondContact O-N 3.19Å
73	G	47.2	Very low	75.2	Confident	22 Å²	22	44.5 Å²	44.5	23%	0.227	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	29	-176.3	0	0	0	0	0	114.2	V71 H277	V71-G73 PolarHBondContact O-N 3.31Å; V71-G73 VanDerWaalsContact O-N 3.1Å; G73-H277 WeakPolarHBondContact CA-CE1 3.32Å; G73-H277 WeakPolarHBondContact CA-NE2 3.48Å; G73-H277 PolarHBondContact O-CD2 3.16Å; G73-H277 PolarHBondContact O-CE1 3.25Å; G73-H277 PolarHBondContact O-ND1 2.91Å; G73-H277 PolarHBondContact O-NE2 3.4Å; G73-H277 VanDerWaalsContact O-NE2 3.08Å
74	E	55.9	Low	75.9	Confident	127 Å²	127	46.3 Å²	46.3	59%	0.593	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-135.2	-67.8	166.5	-64.7	-176.2	-178.2	0	0	110.2	V71 P72	V71-E74 HydrophobicContact CB-CB 3.98Å; V71-E74 HydrophobicContact CG1-CB 3.74Å; V71-E74 HydrophobicContact CG1-CG 3.93Å; V71-E74 WeakPolarHBondContact CG1-OE2 3.4Å; V71-E74 PolarHBondContact O-N 3.23Å; P72-E74 VanDerWaalsContact C-N 3.34Å; P72-E74 PolarHBondContact O-N 3.19Å
75	Q	60.4	Low	76.5	Confident	76 Å²	76	48.3 Å²	48.3	36%	0.355	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	150.5	-171.3	-64.1	-173.3	-12	0	0	111.7	V71 F77	V71-Q75 PolarHBondContact N-O 3.44Å; V71-Q75 PolarHBondContact O-N 3.47Å; Q75-F77 HydrophobicContact CB-CE1 4.01Å; Q75-F77 HydrophobicContact CB-CZ 4.47Å; Q75-F77 VanDerWaalsContact OE1-CE1 3.28Å
76	C	67.6	Low	77.2	Confident	43 Å²	43	49.3 Å²	49.3	29%	0.291	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.3	168.9	176.5	0	0	0	0	109.3	I69 V70 Y78	I69-C76 CarbonylContact O-C 3.52Å; I69-C76 WeakPolarHBondContact O-CA 3.3Å; V70-C76 HydrophobicContact CG2-CB 4.36Å; C76-Y78 HydrophobicContact CB-CE2 4.49Å
77	F	77.9	Confident	77.6	Confident	9 Å²	9	49.9 Å²	49.9	4%	0.039	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	111.9	173.1	-53.8	-32.9	0	0	0	109.8	Y35 V50 E68 I69 Q75 I79	Y35-F77 HydrophobicContact CE1-CE2 4.45Å; Y35-F77 HydrophobicContact CE1-CZ 4.25Å; V50-F77 HydrophobicContact CB-CE2 4.35Å; V50-F77 HydrophobicContact CG1-CE2 3.39Å; V50-F77 HydrophobicContact CG1-CZ 3.7Å; V50-F77 HydrophobicContact CG2-CE2 4.02Å; E68-F77 CarbonylContact C-O 3.54Å; E68-F77 VanDerWaalsContact CA-O 3.27Å; E68-F77 WeakPolarHBondContact CA-O 3.34Å; I69-F77 HydrophobicContact CB-CB 4.32Å; I69-F77 HydrophobicContact CB-CD2 4.27Å; I69-F77 HydrophobicContact CG2-CD2 4.43Å; I69-F77 PolarHBondContact N-O 2.81Å; I69-F77 PolarHBondContact O-N 2.67Å; Q75-F77 HydrophobicContact CB-CE1 4.01Å; Q75-F77 HydrophobicContact CB-CZ 4.47Å; Q75-F77 VanDerWaalsContact OE1-CE1 3.28Å; F77-I79 HydrophobicContact CB-CD1 4.05Å; F77-I79 HydrophobicContact CB-CG1 4.04Å
78	Y	75.9	Confident	78.2	Confident	37 Å²	37	54 Å²	54	15%	0.145	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	122.7	165.8	-53.8	-87.7	0	0	0	108.6	K13 W14 W21 E68 C76 L162	K13-Y78 WeakPolarHBondContact CA-O 3.45Å; W14-Y78 HydrophobicContact CB-CD2 4.35Å; W14-Y78 HydrophobicContact CB-CG 4.47Å; W14-Y78 PolarHBondContact N-O 2.8Å; W21-Y78 VanDerWaalsContact CZ3-O 3.24Å; W21-Y78 WeakPolarHBondContact CZ3-O 3.31Å; E68-Y78 VanDerWaalsContact CD-CE1 3.47Å; E68-Y78 HydrophobicContact CG-CD1 3.63Å; E68-Y78 HydrophobicContact CG-CE1 4.03Å; E68-Y78 WeakPolarHBondContact OE1-CD1 3.2Å; E68-Y78 VanDerWaalsContact OE1-CE1 3.28Å; E68-Y78 WeakPolarHBondContact OE1-CE1 3.3Å; C76-Y78 HydrophobicContact CB-CE2 4.49Å; Y78-L162 HydrophobicContact CD2-CD2 4.47Å; Y78-L162 HydrophobicContact CE1-CD2 3.92Å; Y78-L162 HydrophobicContact CE2-CD2 3.87Å
79	I	86.4	Confident	79	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	138	-173.5	-56	173.9	0	0	0	109.6	L11 L12 F26 R66 F67 I69 F77	L11-I79 HydrophobicContact CB-CG2 3.71Å; L11-I79 HydrophobicContact CD1-CG2 3.52Å; L11-I79 HydrophobicContact CG-CG2 4.17Å; L12-I79 CarbonylContact O-C 3.6Å; L12-I79 VanDerWaalsContact O-CA 3.31Å; L12-I79 WeakPolarHBondContact O-CA 3.35Å; F26-I79 HydrophobicContact CD1-CD1 4.47Å; F26-I79 HydrophobicContact CE1-CD1 3.6Å; F26-I79 HydrophobicContact CE1-CG1 4.36Å; F26-I79 HydrophobicContact CE2-CG2 4.36Å; F26-I79 HydrophobicContact CZ-CD1 3.73Å; F26-I79 HydrophobicContact CZ-CG1 3.98Å; F26-I79 HydrophobicContact CZ-CG2 4.3Å; R66-I79 WeakPolarHBondContact CA-O 3.3Å; R66-I79 WeakPolarHBondContact CG-O 3.39Å; F67-I79 HydrophobicContact CD1-CB 4.5Å; F67-I79 HydrophobicContact CD2-CB 4.39Å; F67-I79 HydrophobicContact CE1-CB 4.12Å; F67-I79 HydrophobicContact CE1-CG2 3.74Å; F67-I79 HydrophobicContact CE2-CB 3.99Å; F67-I79 HydrophobicContact CE2-CD1 3.96Å; F67-I79 HydrophobicContact CE2-CG2 4.11Å; F67-I79 HydrophobicContact CZ-CB 3.86Å; F67-I79 HydrophobicContact CZ-CD1 4.31Å; F67-I79 HydrophobicContact CZ-CG2 3.5Å; F67-I79 VanDerWaalsContact CZ-CG2 3.5Å; F67-I79 PolarHBondContact N-O 3.19Å; F67-I79 PolarHBondContact O-N 2.88Å; I69-I79 HydrophobicContact CD1-CD1 3.61Å; I69-I79 HydrophobicContact CG1-CD1 3.96Å; F77-I79 HydrophobicContact CB-CD1 4.05Å; F77-I79 HydrophobicContact CB-CG1 4.04Å
80	R	83.5	Confident	79.6	Confident	85 Å²	85	56.4 Å²	56.4	32%	0.321	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	126.8	179.8	-170.3	175.5	-169.3	-110.3	-5	110.8	L12 W21 D63 C65	L12-R80 HydrophobicContact CB-CB 4.25Å; L12-R80 PolarHBondContact N-O 3.19Å; L12-R80 PolarHBondContact O-N 3.45Å; W21-R80 HydrophobicContact CE3-CB 4.05Å; W21-R80 HydrophobicContact CH2-CB 3.85Å; W21-R80 HydrophobicContact CZ2-CB 4.4Å; W21-R80 HydrophobicContact CZ3-CB 3.64Å; D63-R80 IonicContact OD1-NE 2.8Å; D63-R80 IonicContact OD2-CZ 3.42Å; D63-R80 IonicContact OD2-NE 3.44Å; D63-R80 PolarHBondContact OD2-NE 2.87Å; D63-R80 IonicContact OD2-NH2 2.99Å; C65-R80 HydrophobicContact CB-CG 4.14Å; C65-R80 WeakPolarHBondContact O-CA 3.38Å
81	A	88.7	Confident	80.6	Confident	2 Å²	2	56.8 Å²	56.8	2%	0.017	28%	0.277	C	S	.	.			trans	-84.4	165	173.1	0	0	0	0	0	111.3	L11 C65 T83 E86 R87	L11-A81 HydrophobicContact CD2-CB 3.68Å; C65-A81 PolarHBondContact O-N 3.38Å; A81-T83 VanDerWaalsContact C-N 3.29Å; A81-T83 PolarHBondContact O-N 3.2Å; A81-E86 HydrophobicContact CB-CB 4.02Å; A81-E86 HydrophobicContact CB-CG 3.92Å; A81-R87 HydrophobicContact CB-CB 3.78Å
82	R	86.1	Confident	81.6	Confident	172 Å²	172	61 Å²	61	65%	0.649	30%	0.298	S	S	*	.	S	Bend	trans	-70.9	-29.6	176.6	-61.6	177.7	173.9	-169.4	-0.1	111.7	E10 E86	E10-R82 IonicContact OE1-CZ 2.71Å; E10-R82 IonicContact OE1-NE 3.41Å; E10-R82 IonicContact OE1-NH2 3.47Å; E10-R82 PolarHBondContact OE1-NH2 2.91Å; E10-R82 IonicContact OE2-NH2 3.04Å; R82-E86 VanDerWaalsContact CB-OE2 3.29Å; R82-E86 WeakPolarHBondContact CB-OE2 3.4Å; R82-E86 PolarHBondContact N-OE2 3.26Å
83	T	86.5	Confident	83.2	Confident	70 Å²	70	59 Å²	59	43%	0.429	29%	0.286	S	S	.	.	S	Bend	trans	-139.4	154.8	-178.3	68	0	0	0	0	112	C65 A81 K85 E86 R87	C65-T83 VanDerWaalsContact SG-C 3.53Å; A81-T83 VanDerWaalsContact C-N 3.29Å; A81-T83 PolarHBondContact O-N 3.2Å; T83-K85 PolarHBondContact O-N 3.15Å; T83-E86 PolarHBondContact O-N 3.39Å; T83-E86 WeakPolarHBondContact OG1-CB 3.35Å; T83-E86 PolarHBondContact OG1-N 3.3Å; T83-R87 PolarHBondContact O-N 3.13Å
84	T	86.4	Confident	85.4	Confident	76 Å²	76	57.9 Å²	57.9	47%	0.466	28%	0.275	S	S	.	.	H	α-helix	trans	-55.3	-36.8	172	-51.2	0	0	0	0	112	H64 C65 Q88	H64-T84 HydrophobicContact CB-CG2 3.82Å; C65-T84 PolarHBondContact SG-N 2.96Å; C65-T84 VanDerWaalsContact SG-N 3.36Å; T84-Q88 WeakPolarHBondContact O-CB 3.45Å; T84-Q88 PolarHBondContact O-N 3.3Å
85	K	92.4	Very high	87.1	Confident	151 Å²	151	53.4 Å²	53.4	66%	0.657	26%	0.263	S	S	*	.	H	α-helix	trans	-63.6	-51.6	177.2	-177.3	-174.9	173.4	-169.6	0	111	T83 R87 Q88 E89	T83-K85 PolarHBondContact O-N 3.15Å; K85-R87 VanDerWaalsContact C-N 3.31Å; K85-R87 PolarHBondContact O-N 3.22Å; K85-Q88 WeakPolarHBondContact O-CB 3.41Å; K85-Q88 PolarHBondContact O-N 2.9Å; K85-Q88 VanDerWaalsContact O-N 3.1Å; K85-E89 VanDerWaalsContact CE-OE1 3.28Å; K85-E89 WeakPolarHBondContact CE-OE1 3.44Å; K85-E89 WeakPolarHBondContact O-CG 3.27Å; K85-E89 PolarHBondContact O-N 3.29Å
86	E	95.1	Very high	88.4	Confident	38 Å²	38	52.7 Å²	52.7	18%	0.178	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-42.4	178.6	-179.9	178.7	-136.8	0	0	111.3	A81 R82 T83 Q88 E89 W90	A81-E86 HydrophobicContact CB-CB 4.02Å; A81-E86 HydrophobicContact CB-CG 3.92Å; R82-E86 VanDerWaalsContact CB-OE2 3.29Å; R82-E86 WeakPolarHBondContact CB-OE2 3.4Å; R82-E86 PolarHBondContact N-OE2 3.26Å; T83-E86 PolarHBondContact O-N 3.39Å; T83-E86 WeakPolarHBondContact OG1-CB 3.35Å; T83-E86 PolarHBondContact OG1-N 3.3Å; E86-Q88 VanDerWaalsContact C-N 3.32Å; E86-Q88 PolarHBondContact O-N 3.32Å; E86-E89 WeakPolarHBondContact O-CB 3.36Å; E86-E89 PolarHBondContact O-N 3.21Å; E86-W90 VanDerWaalsContact O-CD1 3.26Å; E86-W90 PolarHBondContact O-N 3.06Å
87	R	92.5	Very high	89.4	Confident	20 Å²	20	50.7 Å²	50.7	8%	0.075	25%	0.25	C	S	.	.	H	α-helix	trans	-56.1	-46.2	172.6	179.3	-93.6	-157.1	164.4	15.8	111.9	A59 D60 H64 R66 F67 A81 T83 K85 E89 W90 L91	A59-R87 VanDerWaalsContact CB-NH2 3.33Å; D60-R87 VanDerWaalsContact N-NH2 3.15Å; D60-R87 PolarHBondContact O-NH2 3.2Å; H64-R87 WeakPolarHBondContact O-CD 3.42Å; R66-R87 PolarHBondContact O-NE 3.13Å; R66-R87 PolarHBondContact O-NH2 2.77Å; F67-R87 HydrophobicContact CD1-CG 3.81Å; F67-R87 HydrophobicContact CE1-CG 4.44Å; A81-R87 HydrophobicContact CB-CB 3.78Å; T83-R87 PolarHBondContact O-N 3.13Å; K85-R87 VanDerWaalsContact C-N 3.31Å; K85-R87 PolarHBondContact O-N 3.22Å; R87-E89 VanDerWaalsContact C-N 3.35Å; R87-E89 PolarHBondContact O-N 2.63Å; R87-W90 PolarHBondContact O-N 3.05Å; R87-L91 WeakPolarHBondContact O-CG 3.38Å; R87-L91 PolarHBondContact O-N 2.99Å
88	Q	94.2	Very high	89.8	Confident	89 Å²	89	52.6 Å²	52.6	42%	0.416	26%	0.259	S	S	.	.	H	α-helix	trans	-64.4	-39.8	179.1	-170.6	58.8	36.6	0	0	112	T84 K85 E86 W90 L91 I92	T84-Q88 WeakPolarHBondContact O-CB 3.45Å; T84-Q88 PolarHBondContact O-N 3.3Å; K85-Q88 WeakPolarHBondContact O-CB 3.41Å; K85-Q88 PolarHBondContact O-N 2.9Å; K85-Q88 VanDerWaalsContact O-N 3.1Å; E86-Q88 VanDerWaalsContact C-N 3.32Å; E86-Q88 PolarHBondContact O-N 3.32Å; Q88-W90 VanDerWaalsContact C-N 3.33Å; Q88-W90 PolarHBondContact O-N 3.43Å; Q88-L91 PolarHBondContact O-N 3.41Å; Q88-I92 HydrophobicContact CG-CD1 4.07Å; Q88-I92 WeakPolarHBondContact O-CD1 3.41Å; Q88-I92 VanDerWaalsContact O-CG1 3.25Å; Q88-I92 WeakPolarHBondContact O-CG1 3.48Å; Q88-I92 PolarHBondContact O-N 3.43Å
89	E	95.3	Very high	90.1	Very high	78 Å²	78	55.7 Å²	55.7	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-61.4	-40.9	174.3	-67.8	172.6	-170.8	0	0	112.1	K7 K85 E86 R87 A93	K7-E89 IonicContact NZ-OE2 3.82Å; K7-E89 PolarHBondContact NZ-OE2 3.38Å; K85-E89 VanDerWaalsContact CE-OE1 3.28Å; K85-E89 WeakPolarHBondContact CE-OE1 3.44Å; K85-E89 WeakPolarHBondContact O-CG 3.27Å; K85-E89 PolarHBondContact O-N 3.29Å; E86-E89 WeakPolarHBondContact O-CB 3.36Å; E86-E89 PolarHBondContact O-N 3.21Å; R87-E89 VanDerWaalsContact C-N 3.35Å; R87-E89 PolarHBondContact O-N 2.63Å; E89-A93 WeakPolarHBondContact O-CB 3.22Å; E89-A93 PolarHBondContact O-N 3.21Å
90	W	96.2	Very high	89.7	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.008	31%	0.308	C	S	.	.	H	α-helix	trans	-64.5	-47.1	174.6	-84.1	103.7	0	0	0	112	K7 L11 F26 L28 L33 F67 E86 R87 Q88 I92 A93 L94	K7-W90 HydrophobicContact CB-CZ3 4.4Å; K7-W90 HydrophobicContact CD-CD2 3.83Å; K7-W90 HydrophobicContact CD-CE3 4.04Å; K7-W90 HydrophobicContact CD-CG 4.21Å; K7-W90 HydrophobicContact CD-CZ2 4.45Å; K7-W90 HydrophobicContact CD-CZ3 4.42Å; K7-W90 HydrophobicContact CG-CD2 4.39Å; K7-W90 HydrophobicContact CG-CE3 4.4Å; K7-W90 HydrophobicContact CG-CH2 4.16Å; K7-W90 HydrophobicContact CG-CZ2 4.16Å; K7-W90 HydrophobicContact CG-CZ3 4.29Å; L11-W90 HydrophobicContact CD1-CD2 3.81Å; L11-W90 HydrophobicContact CD1-CE3 4.39Å; L11-W90 HydrophobicContact CD1-CG 4.05Å; L11-W90 HydrophobicContact CD1-CZ2 4.02Å; L11-W90 HydrophobicContact CG-CZ2 4.35Å; F26-W90 HydrophobicContact CB-CH2 3.52Å; F26-W90 HydrophobicContact CB-CZ2 3.97Å; F26-W90 HydrophobicContact CB-CZ3 4.16Å; L28-W90 HydrophobicContact CB-CZ3 4.1Å; L33-W90 HydrophobicContact CD1-CZ3 3.97Å; F67-W90 HydrophobicContact CE1-CB 4.23Å; F67-W90 HydrophobicContact CZ-CB 4.05Å; F67-W90 HydrophobicContact CZ-CG 4.5Å; E86-W90 VanDerWaalsContact O-CD1 3.26Å; E86-W90 PolarHBondContact O-N 3.06Å; R87-W90 PolarHBondContact O-N 3.05Å; Q88-W90 VanDerWaalsContact C-N 3.33Å; Q88-W90 PolarHBondContact O-N 3.43Å; W90-I92 VanDerWaalsContact C-N 3.3Å; W90-I92 PolarHBondContact O-N 3.05Å; W90-A93 PolarHBondContact O-N 3.42Å; W90-A93 VanDerWaalsContact O-N 3.17Å; W90-L94 WeakPolarHBondContact O-CB 3.32Å; W90-L94 WeakPolarHBondContact O-CG 3.37Å; W90-L94 PolarHBondContact O-N 2.77Å
91	L	93.2	Very high	88.9	Confident	29 Å²	29	58.1 Å²	58.1	15%	0.152	31%	0.305	C	S	.	.	H	α-helix	trans	-58.5	-41.5	176.9	-72.5	-177.7	0	0	0	112.6	V57 A59 F67 R87 Q88 G95	V57-L91 HydrophobicContact CG1-CD2 3.61Å; A59-L91 HydrophobicContact CB-CD1 3.78Å; F67-L91 HydrophobicContact CB-CD2 3.84Å; F67-L91 HydrophobicContact CD2-CD2 4.15Å; F67-L91 HydrophobicContact CG-CD2 3.99Å; R87-L91 WeakPolarHBondContact O-CG 3.38Å; R87-L91 PolarHBondContact O-N 2.99Å; Q88-L91 PolarHBondContact O-N 3.41Å; L91-G95 PolarHBondContact O-N 3.11Å
92	I	93.1	Very high	86.9	Confident	98 Å²	98	63.8 Å²	63.8	50%	0.503	34%	0.344	S	S	.	.	H	α-helix	trans	-63.2	-48.1	176.2	-68.2	164.6	0	0	0	110	Q88 W90 L94 G95 T96	Q88-I92 HydrophobicContact CG-CD1 4.07Å; Q88-I92 WeakPolarHBondContact O-CD1 3.41Å; Q88-I92 VanDerWaalsContact O-CG1 3.25Å; Q88-I92 WeakPolarHBondContact O-CG1 3.48Å; Q88-I92 PolarHBondContact O-N 3.43Å; W90-I92 VanDerWaalsContact C-N 3.3Å; W90-I92 PolarHBondContact O-N 3.05Å; I92-L94 PolarHBondContact O-N 2.89Å; I92-G95 PolarHBondContact O-N 3.12Å; I92-T96 VanDerWaalsContact O-CB 3.32Å; I92-T96 WeakPolarHBondContact O-CB 3.29Å; I92-T96 PolarHBondContact O-N 3.22Å; I92-T96 PolarHBondContact O-OG1 3.24Å
93	A	93.2	Very high	84.7	Confident	14 Å²	14	66.3 Å²	66.3	12%	0.116	35%	0.353	C	S	.	.	H	α-helix	trans	-61.6	-46.6	-179.5	0	0	0	0	0	111.8	I5 K7 L28 E89 W90 T96 A97	I5-A93 HydrophobicContact CG2-CB 4.35Å; K7-A93 HydrophobicContact CB-CB 4.16Å; K7-A93 HydrophobicContact CD-CB 3.77Å; L28-A93 HydrophobicContact CD2-CB 3.79Å; E89-A93 WeakPolarHBondContact O-CB 3.22Å; E89-A93 PolarHBondContact O-N 3.21Å; W90-A93 PolarHBondContact O-N 3.42Å; W90-A93 VanDerWaalsContact O-N 3.17Å; A93-T96 PolarHBondContact O-N 2.96Å; A93-A97 VanDerWaalsContact O-CB 3.31Å; A93-A97 WeakPolarHBondContact O-CB 3.44Å; A93-A97 PolarHBondContact O-N 3.44Å
94	L	93.4	Very high	82.1	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-63.6	-45.8	178.2	-66	170.1	0	0	0	112.1	L28 L33 L52 V57 F67 I69 W90 I92 A97 K98	L28-L94 HydrophobicContact CD1-CD2 4.39Å; L28-L94 HydrophobicContact CD2-CD2 4.21Å; L33-L94 HydrophobicContact CD1-CD2 4.12Å; L33-L94 HydrophobicContact CD2-CD2 3.98Å; L33-L94 HydrophobicContact CG-CD2 4.48Å; L52-L94 HydrophobicContact CD1-CD2 3.66Å; L52-L94 HydrophobicContact CD2-CD2 3.9Å; L52-L94 HydrophobicContact CG-CD2 4.44Å; V57-L94 HydrophobicContact CG1-CD1 4.07Å; V57-L94 HydrophobicContact CG2-CB 4.39Å; F67-L94 HydrophobicContact CD2-CD1 4.25Å; F67-L94 HydrophobicContact CE2-CD1 3.6Å; F67-L94 HydrophobicContact CZ-CD1 4.26Å; I69-L94 HydrophobicContact CD1-CD1 4.1Å; I69-L94 HydrophobicContact CD1-CD2 4.48Å; W90-L94 WeakPolarHBondContact O-CB 3.32Å; W90-L94 WeakPolarHBondContact O-CG 3.37Å; W90-L94 PolarHBondContact O-N 2.77Å; I92-L94 PolarHBondContact O-N 2.89Å; L94-A97 PolarHBondContact O-N 3.06Å; L94-K98 WeakPolarHBondContact O-CB 3.2Å; L94-K98 PolarHBondContact O-N 3.4Å
95	G	90.1	Very high	79.4	Confident	33 Å²	33	67.1 Å²	67.1	34%	0.34	37%	0.371	S	S	.	.	H	α-helix	trans	-65.4	-38.3	178.2	0	0	0	0	0	112.8	L91 I92 S99	L91-G95 PolarHBondContact O-N 3.11Å; I92-G95 PolarHBondContact O-N 3.12Å; G95-S99 WeakPolarHBondContact O-CB 3.48Å; G95-S99 PolarHBondContact O-N 2.93Å; G95-S99 PolarHBondContact O-OG 3.36Å
96	T	89.4	Confident	76.1	Confident	61 Å²	61	65 Å²	65	37%	0.374	37%	0.374	S	S	.	.	H	α-helix	trans	-69.6	-43	177.2	-47.1	0	0	0	0	110.7	I5 I92 A93 K98 S99 Q100	I5-T96 VanDerWaalsContact CD1-C 3.42Å; I5-T96 HydrophobicContact CD1-CG2 3.39Å; I5-T96 HydrophobicContact CG1-CG2 4.47Å; I92-T96 VanDerWaalsContact O-CB 3.32Å; I92-T96 WeakPolarHBondContact O-CB 3.29Å; I92-T96 PolarHBondContact O-N 3.22Å; I92-T96 PolarHBondContact O-OG1 3.24Å; A93-T96 PolarHBondContact O-N 2.96Å; T96-K98 PolarHBondContact O-N 2.91Å; T96-S99 PolarHBondContact O-N 3.41Å; T96-Q100 WeakPolarHBondContact O-CG 3.23Å; T96-Q100 PolarHBondContact O-N 3.4Å
97	A	88.3	Confident	72.7	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.008	40%	0.4	C	S	.	.	H	α-helix	trans	-57.6	-48.9	174.6	0	0	0	0	0	111.6	I5 L28 G30 N31 L52 A93 L94 S99 Q100 S101	I5-A97 HydrophobicContact CD1-CB 4.26Å; I5-A97 VanDerWaalsContact CD1-N 3.31Å; L28-A97 HydrophobicContact CD1-CB 4.1Å; L28-A97 HydrophobicContact CD2-CB 4.14Å; G30-A97 WeakPolarHBondContact O-CB 3.32Å; N31-A97 PolarHBondContact OD1-O 3.32Å; L52-A97 HydrophobicContact CD1-CB 3.88Å; A93-A97 VanDerWaalsContact O-CB 3.31Å; A93-A97 WeakPolarHBondContact O-CB 3.44Å; A93-A97 PolarHBondContact O-N 3.44Å; L94-A97 PolarHBondContact O-N 3.06Å; A97-S99 VanDerWaalsContact C-N 3.32Å; A97-S99 PolarHBondContact O-N 2.9Å; A97-Q100 PolarHBondContact O-N 2.95Å; A97-S101 PolarHBondContact O-N 2.9Å
98	K	85.8	Confident	69.4	Low	49 Å²	49	76.6 Å²	76.6	21%	0.213	43%	0.43	C	S	.	.	H	α-helix	trans	-61.1	-39.6	177.6	-171.6	174.4	179.4	179.8	0	112.5	L52 C55 L94 T96 S101	L52-K98 WeakPolarHBondContact O-CD 3.46Å; C55-K98 WeakPolarHBondContact O-CE 3.45Å; C55-K98 PolarHBondContact O-NZ 2.94Å; L94-K98 WeakPolarHBondContact O-CB 3.2Å; L94-K98 PolarHBondContact O-N 3.4Å; T96-K98 PolarHBondContact O-N 2.91Å; K98-S101 WeakPolarHBondContact O-CB 3.27Å; K98-S101 PolarHBondContact O-N 3.44Å
99	S	81.4	Confident	66	Low	102 Å²	102	77.7 Å²	77.7	71%	0.713	45%	0.445	S	S	*	.	H	α-helix	trans	-71.8	-27.7	-179.3	-57.6	0	0	0	0	113.6	G95 T96 A97	G95-S99 WeakPolarHBondContact O-CB 3.48Å; G95-S99 PolarHBondContact O-N 2.93Å; G95-S99 PolarHBondContact O-OG 3.36Å; T96-S99 PolarHBondContact O-N 3.41Å; A97-S99 VanDerWaalsContact C-N 3.32Å; A97-S99 PolarHBondContact O-N 2.9Å
100	Q	78.7	Confident	62.7	Low	100 Å²	100	76.6 Å²	76.6	47%	0.467	45%	0.446	S	S	.	.	H	α-helix	trans	-73.7	-18.2	173.5	-72.5	-179.1	-3.3	0	0	112.4	I5 T96 A97	I5-Q100 HydrophobicContact CD1-CG 4.4Å; T96-Q100 WeakPolarHBondContact O-CG 3.23Å; T96-Q100 PolarHBondContact O-N 3.4Å; A97-Q100 PolarHBondContact O-N 2.95Å
101	S	66.4	Low	59.3	Low	36 Å²	36	81.8 Å²	81.8	25%	0.252	48%	0.478	S	S	.	.	S	Bend	trans	-82.5	120.9	175.2	-161.9	0	0	0	0	110.7	N31 S53 A97 K98 R103	N31-S101 PolarHBondContact ND2-OG 3.25Å; S53-S101 VanDerWaalsContact OG-CB 3.24Å; S53-S101 WeakPolarHBondContact OG-CB 3.48Å; S53-S101 PolarHBondContact OG-OG 2.98Å; A97-S101 PolarHBondContact O-N 2.9Å; K98-S101 WeakPolarHBondContact O-CB 3.27Å; K98-S101 PolarHBondContact O-N 3.44Å; S101-R103 VanDerWaalsContact C-N 3.28Å; S101-R103 PolarHBondContact O-N 3.41Å
102	S	47.5	Very low	56.6	Low	120 Å²	120	84.7 Å²	84.7	84%	0.839	50%	0.5	S	S	*	.	S	Bend	trans	-75.2	72.6	-176.4	50.4	0	0	0	0	112.5
103	R	39.4	Very low	53.8	Low	226 Å²	226	84.2 Å²	84.2	85%	0.853	51%	0.506	S	S	*	.			trans	-167.9	121.4	154.4	-121.7	172.1	173.3	135.2	-3.5	111.2	S101	S101-R103 VanDerWaalsContact C-N 3.28Å; S101-R103 PolarHBondContact O-N 3.41Å
104	A	32.5	Very low	51.4	Low	97 Å²	97	85.9 Å²	85.9	80%	0.802	52%	0.515	S	S	*	.			trans	-72.4	139.6	176.7	0	0	0	0	0	112
105	S	28.5	Very low	49.5	Very low	66 Å²	66	87.2 Å²	87.2	46%	0.462	52%	0.523	S	S	.	.			trans	-44	135.3	177.6	-128.3	0	0	0	0	114.2
106	C	24.1	Very low	47.9	Very low	106 Å²	106	93.1 Å²	93.1	72%	0.716	54%	0.542	S	S	*	.			trans	-94.7	116.7	153.9	-71.2	0	0	0	0	108.1	F108	C106-F108 PolarHBondContact O-N 3.44Å
107	I	23.1	Very low	46.6	Very low	141 Å²	141	93.4 Å²	93.4	72%	0.723	54%	0.541	S	S	*	.			trans	-77.3	112	175.3	-60.7	166	0	0	0	107.2
108	F	24.2	Very low	45.3	Very low	160 Å²	160	93.5 Å²	93.5	70%	0.702	54%	0.542	S	S	*	.			trans	-131	123	156.3	-75.9	-74.5	0	0	0	107.4	C106 S110	C106-F108 PolarHBondContact O-N 3.44Å; F108-S110 PolarHBondContact O-N 2.99Å
109	P	22.6	Very low	44.4	Very low	113 Å²	113	92 Å²	92	73%	0.734	54%	0.536	S	S	*	.			trans	-69.9	95.9	-179.9	28.4	-30.3	0	0	0	108.2	T111	P109-T111 PolarHBondContact O-N 3.49Å; P109-T111 VanDerWaalsContact O-N 3.07Å
110	S	24.8	Very low	44.1	Very low	55 Å²	55	90.2 Å²	90.2	39%	0.385	52%	0.524	S	S	.	.			trans	-79.7	90.6	171.3	55.7	0	0	0	0	108.6	F108 S112	F108-S110 PolarHBondContact O-N 2.99Å; S110-S112 PolarHBondContact O-N 2.96Å
111	T	25.6	Very low	44.1	Very low	111 Å²	111	86.5 Å²	86.5	68%	0.681	51%	0.507	S	S	*	.			trans	-61	110.1	162.8	51.1	0	0	0	0	108.3	P109 S113	P109-T111 PolarHBondContact O-N 3.49Å; P109-T111 VanDerWaalsContact O-N 3.07Å; T111-S113 VanDerWaalsContact C-N 3.29Å; T111-S113 PolarHBondContact O-N 3.27Å
112	S	35.8	Very low	44.8	Very low	89 Å²	89	86.1 Å²	86.1	62%	0.622	50%	0.5	S	S	*	.			trans	-67.6	97.7	158.7	57.8	0	0	0	0	106.7	S110 T114	S110-S112 PolarHBondContact O-N 2.96Å; S112-T114 VanDerWaalsContact C-N 3.33Å; S112-T114 PolarHBondContact O-N 3.06Å
113	S	34.7	Very low	46.3	Very low	88 Å²	88	85.9 Å²	85.9	62%	0.615	48%	0.483	S	S	*	.			trans	-66.3	97.8	169.3	59.6	0	0	0	0	107.2	T111 C115	T111-S113 VanDerWaalsContact C-N 3.29Å; T111-S113 PolarHBondContact O-N 3.27Å; S113-C115 PolarHBondContact O-N 3.05Å
114	T	42.4	Very low	48.5	Very low	50 Å²	50	78.2 Å²	78.2	31%	0.307	46%	0.459	S	S	.	.			trans	-60.6	129	170.3	-45	0	0	0	0	107.9	S112 V118 L119	S112-T114 VanDerWaalsContact C-N 3.33Å; S112-T114 PolarHBondContact O-N 3.06Å; T114-V118 HydrophobicContact CG2-CB 4.19Å; T114-V118 HydrophobicContact CG2-CG1 4.26Å; T114-L119 HydrophobicContact CG2-CD2 3.5Å; T114-L119 HydrophobicContact CG2-CG 3.77Å
115	C	53.2	Low	51	Low	27 Å²	27	73.6 Å²	73.6	18%	0.182	42%	0.421	C	S	.	.			trans	-60.7	137.8	178.6	175.7	0	0	0	0	111.1	S113 D117 V118 L119 R272	S113-C115 PolarHBondContact O-N 3.05Å; C115-D117 PolarHBondContact O-N 3.37Å; C115-D117 VanDerWaalsContact O-N 3.17Å; C115-D117 PolarHBondContact SG-OD2 2.89Å; C115-V118 HydrophobicContact CB-CG2 4.2Å; C115-V118 PolarHBondContact O-N 3.18Å; C115-L119 PolarHBondContact O-N 2.77Å; C115-L119 VanDerWaalsContact O-N 3.15Å; C115-R272 PolarHBondContact SG-NH1 2.95Å
116	E	57.5	Low	53.7	Low	157 Å²	157	71.7 Å²	71.7	73%	0.734	41%	0.406	S	S	*	.	H	α-helix	trans	-53.7	-34.6	180	-68.7	-174	161.1	0	0	112.8	L119 S120	E116-L119 PolarHBondContact O-N 3.33Å; E116-S120 WeakPolarHBondContact O-CB 3.41Å; E116-S120 PolarHBondContact O-N 3.15Å; E116-S120 PolarHBondContact O-OG 2.8Å
117	D	61.3	Low	56.7	Low	67 Å²	67	72.5 Å²	72.5	36%	0.358	40%	0.399	S	S	.	.	H	α-helix	trans	-60.7	-46.9	176.5	-58.3	-32	0	0	0	111.4	C115 S120 H121 R272	C115-D117 PolarHBondContact O-N 3.37Å; C115-D117 VanDerWaalsContact O-N 3.17Å; C115-D117 PolarHBondContact SG-OD2 2.89Å; D117-S120 PolarHBondContact O-N 3.48Å; D117-H121 PolarHBondContact O-N 3.02Å; D117-H121 PolarHBondContact O-ND1 3.06Å; D117-R272 IonicContact OD2-NH2 3.69Å
118	V	61.9	Low	59.7	Low	3 Å²	3	67 Å²	67	2%	0.018	37%	0.371	C	S	.	.	H	α-helix	trans	-65.1	-44.1	179.7	-176.8	0	0	0	0	110.1	T114 C115 S120 H121 R122 A265 Q269	T114-V118 HydrophobicContact CG2-CB 4.19Å; T114-V118 HydrophobicContact CG2-CG1 4.26Å; C115-V118 HydrophobicContact CB-CG2 4.2Å; C115-V118 PolarHBondContact O-N 3.18Å; V118-S120 VanDerWaalsContact C-N 3.28Å; V118-S120 PolarHBondContact O-N 3.25Å; V118-H121 PolarHBondContact O-N 3.44Å; V118-R122 WeakPolarHBondContact O-CB 3.4Å; V118-R122 PolarHBondContact O-N 3.3Å; V118-A265 HydrophobicContact CB-CB 4.36Å; V118-A265 HydrophobicContact CG2-CB 3.82Å; V118-A265 VanDerWaalsContact CG2-O 3.24Å; V118-A265 WeakPolarHBondContact CG2-O 3.34Å; V118-Q269 HydrophobicContact CG2-CB 3.97Å
119	L	66.4	Low	62.6	Low	17 Å²	17	59.3 Å²	59.3	9%	0.089	34%	0.337	C	S	.	.	H	α-helix	trans	-60.8	-39.7	179.4	-66.8	179.7	0	0	0	111.8	T114 C115 E116 K123 D165	T114-L119 HydrophobicContact CG2-CD2 3.5Å; T114-L119 HydrophobicContact CG2-CG 3.77Å; C115-L119 PolarHBondContact O-N 2.77Å; C115-L119 VanDerWaalsContact O-N 3.15Å; E116-L119 PolarHBondContact O-N 3.33Å; L119-K123 VanDerWaalsContact O-CG 3.29Å; L119-K123 WeakPolarHBondContact O-CG 3.27Å; L119-K123 PolarHBondContact O-N 3.23Å; L119-D165 WeakPolarHBondContact CD2-OD1 3.29Å
120	S	75.1	Confident	65.6	Low	66 Å²	66	56.9 Å²	56.9	46%	0.462	32%	0.317	S	S	.	.	H	α-helix	trans	-65.2	-52.5	179.5	-60	0	0	0	0	111.5	E116 D117 V118 R122 K123 L124	E116-S120 WeakPolarHBondContact O-CB 3.41Å; E116-S120 PolarHBondContact O-N 3.15Å; E116-S120 PolarHBondContact O-OG 2.8Å; D117-S120 PolarHBondContact O-N 3.48Å; V118-S120 VanDerWaalsContact C-N 3.28Å; V118-S120 PolarHBondContact O-N 3.25Å; S120-R122 VanDerWaalsContact C-N 3.31Å; S120-R122 PolarHBondContact O-N 2.94Å; S120-K123 PolarHBondContact O-N 3.1Å; S120-L124 WeakPolarHBondContact O-CG 3.08Å; S120-L124 PolarHBondContact O-N 2.95Å
121	H	79.6	Confident	68.6	Low	22 Å²	22	56.8 Å²	56.8	10%	0.102	32%	0.32	C	S	.	.	H	α-helix	trans	-64.8	-36.2	178	-63.8	98.6	0	0	0	112.2	D117 V118 L124 V125 K261 L262	D117-H121 PolarHBondContact O-N 3.02Å; D117-H121 PolarHBondContact O-ND1 3.06Å; V118-H121 PolarHBondContact O-N 3.44Å; H121-L124 PolarHBondContact O-N 3.38Å; H121-V125 WeakPolarHBondContact O-CG2 3.29Å; H121-V125 PolarHBondContact O-N 3.31Å; H121-K261 WeakPolarHBondContact CD2-CB 3.44Å; H121-L262 HydrophobicContact CB-CB 4.19Å; H121-L262 HydrophobicContact CB-CD1 4.34Å
122	R	79.9	Confident	71.4	Confident	28 Å²	28	52.6 Å²	52.6	11%	0.106	29%	0.293	C	S	.	.	H	α-helix	trans	-59.7	-48.6	175.1	179.9	-178.1	178.2	-138.7	-19.1	111.4	Y17 V118 S120 L124 V125 V126 M159 L162 L262	Y17-R122 HydrophobicContact CE1-CG 4.27Å; Y17-R122 WeakPolarHBondContact OH-CD 3.3Å; Y17-R122 PolarHBondContact OH-NE 3Å; V118-R122 WeakPolarHBondContact O-CB 3.4Å; V118-R122 PolarHBondContact O-N 3.3Å; S120-R122 VanDerWaalsContact C-N 3.31Å; S120-R122 PolarHBondContact O-N 2.94Å; R122-L124 VanDerWaalsContact C-N 3.31Å; R122-L124 PolarHBondContact O-N 3.26Å; R122-V125 PolarHBondContact O-N 3.12Å; R122-V126 WeakPolarHBondContact O-CG2 3.05Å; R122-V126 PolarHBondContact O-N 3.46Å; R122-M159 HydrophobicContact CG-CE 3.36Å; R122-M159 HydrophobicContact CG-SD 4.3Å; R122-M159 PolarHBondContact NE-SD 2.94Å; R122-M159 PolarHBondContact NH2-O 3.45Å; R122-M159 VanDerWaalsContact NH2-O 3.09Å; R122-L162 VanDerWaalsContact CZ-CD1 3.47Å; R122-L262 HydrophobicContact CB-CD1 4.09Å
123	K	80.8	Confident	73.8	Confident	114 Å²	114	51 Å²	51	50%	0.496	27%	0.274	S	S	.	.	H	α-helix	trans	-58.9	-42.6	177.7	-76.2	170.5	-176.4	173.3	0	111.8	L119 S120 V126 Q127 D165	L119-K123 VanDerWaalsContact O-CG 3.29Å; L119-K123 WeakPolarHBondContact O-CG 3.27Å; L119-K123 PolarHBondContact O-N 3.23Å; S120-K123 PolarHBondContact O-N 3.1Å; K123-V126 PolarHBondContact O-N 3.19Å; K123-Q127 WeakPolarHBondContact O-CG 3.44Å; K123-Q127 PolarHBondContact O-N 3.05Å; K123-D165 VanDerWaalsContact CE-OD2 3.3Å; K123-D165 WeakPolarHBondContact CE-OD2 3.23Å; K123-D165 IonicContact NZ-OD2 3.43Å; K123-D165 PolarHBondContact NZ-OD2 2.89Å
124	L	84.6	Confident	76.4	Confident	65 Å²	65	49.7 Å²	49.7	34%	0.34	26%	0.26	S	S	.	.	H	α-helix	trans	-65	-45.8	179.1	-66.4	172.1	0	0	0	112.5	S120 H121 R122 V126 Q127 Q128 N258	S120-L124 WeakPolarHBondContact O-CG 3.08Å; S120-L124 PolarHBondContact O-N 2.95Å; H121-L124 PolarHBondContact O-N 3.38Å; R122-L124 VanDerWaalsContact C-N 3.31Å; R122-L124 PolarHBondContact O-N 3.26Å; L124-V126 VanDerWaalsContact C-N 3.32Å; L124-V126 PolarHBondContact O-N 3.47Å; L124-Q127 PolarHBondContact O-N 2.93Å; L124-Q128 WeakPolarHBondContact O-CG 3.49Å; L124-Q128 PolarHBondContact O-N 3.46Å; L124-N258 WeakPolarHBondContact CB-ND2 3.38Å
125	V	84.9	Confident	78.4	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.1	-39.1	177.9	171.8	0	0	0	0	111.3	H121 R122 Q128 I129 F155 N258 V259 L262 L349	H121-V125 WeakPolarHBondContact O-CG2 3.29Å; H121-V125 PolarHBondContact O-N 3.31Å; R122-V125 PolarHBondContact O-N 3.12Å; V125-Q128 PolarHBondContact O-N 2.99Å; V125-I129 HydrophobicContact CG1-CD1 3.82Å; V125-I129 HydrophobicContact CG1-CG1 4.47Å; V125-I129 VanDerWaalsContact O-CG1 3.29Å; V125-I129 WeakPolarHBondContact O-CG1 3.38Å; V125-I129 PolarHBondContact O-N 2.9Å; V125-F155 HydrophobicContact CG1-CZ 4.4Å; V125-N258 HydrophobicContact CG2-CB 3.94Å; V125-V259 HydrophobicContact CG2-CG2 4.34Å; V125-L262 HydrophobicContact CB-CD2 4.15Å; V125-L262 HydrophobicContact CG1-CD2 4.18Å; V125-L262 HydrophobicContact CG2-CB 4.21Å; V125-L262 HydrophobicContact CG2-CD2 3.94Å; V125-L349 HydrophobicContact CG1-CD2 3.62Å
126	V	85.3	Confident	79.8	Confident	27 Å²	27	50.3 Å²	50.3	16%	0.164	26%	0.262	C	S	.	.	H	α-helix	trans	-61.1	-46.3	174.7	172.4	0	0	0	0	111.8	R122 K123 L124 Q128 I129 I130 F155 L156 M159	R122-V126 WeakPolarHBondContact O-CG2 3.05Å; R122-V126 PolarHBondContact O-N 3.46Å; K123-V126 PolarHBondContact O-N 3.19Å; L124-V126 VanDerWaalsContact C-N 3.32Å; L124-V126 PolarHBondContact O-N 3.47Å; V126-Q128 VanDerWaalsContact C-N 3.31Å; V126-Q128 PolarHBondContact O-N 3.38Å; V126-I129 PolarHBondContact O-N 3.36Å; V126-I130 HydrophobicContact CG1-CD1 3.79Å; V126-I130 HydrophobicContact CG1-CG1 4.4Å; V126-I130 WeakPolarHBondContact O-CG1 3.38Å; V126-I130 PolarHBondContact O-N 3.09Å; V126-F155 HydrophobicContact CG2-CE1 4.41Å; V126-L156 HydrophobicContact CG1-CD2 3.94Å; V126-M159 HydrophobicContact CG2-CE 3.05Å; V126-M159 HydrophobicContact CG2-CG 4.27Å; V126-M159 HydrophobicContact CG2-SD 4.39Å
127	Q	86	Confident	81.1	Confident	122 Å²	122	47.9 Å²	47.9	57%	0.57	25%	0.253	S	S	*	.	H	α-helix	trans	-61.4	-40.9	178	-73.7	173.8	-11.1	0	0	111.4	K123 L124 I130 A131	K123-Q127 WeakPolarHBondContact O-CG 3.44Å; K123-Q127 PolarHBondContact O-N 3.05Å; L124-Q127 PolarHBondContact O-N 2.93Å; Q127-I130 PolarHBondContact O-N 3.47Å; Q127-A131 WeakPolarHBondContact O-CB 3.37Å; Q127-A131 PolarHBondContact O-N 3.27Å
128	Q	86.1	Confident	82.3	Confident	25 Å²	25	53.2 Å²	53.2	12%	0.117	27%	0.273	C	S	.	.	H	α-helix	trans	-62.2	-42.8	174.7	-72.1	173.5	-63.2	0	0	111.9	L124 V125 V126 A131 L132 M255 N258 V352 S356	L124-Q128 WeakPolarHBondContact O-CG 3.49Å; L124-Q128 PolarHBondContact O-N 3.46Å; V125-Q128 PolarHBondContact O-N 2.99Å; V126-Q128 VanDerWaalsContact C-N 3.31Å; V126-Q128 PolarHBondContact O-N 3.38Å; Q128-A131 PolarHBondContact O-N 3.32Å; Q128-L132 VanDerWaalsContact O-CB 3.3Å; Q128-L132 WeakPolarHBondContact O-CB 3.22Å; Q128-L132 PolarHBondContact O-N 3.33Å; Q128-M255 PolarHBondContact NE2-O 3.47Å; Q128-M255 VanDerWaalsContact NE2-O 3.13Å; Q128-N258 PolarHBondContact OE1-ND2 3.2Å; Q128-V352 HydrophobicContact CB-CG1 3.86Å; Q128-S356 PolarHBondContact NE2-OG 2.99Å
129	I	85.2	Confident	83.3	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.4	-42.5	177.9	-68.7	166.3	0	0	0	111.4	V125 V126 L132 R133 C152 F155 L156 V348 L349 V352	V125-I129 HydrophobicContact CG1-CD1 3.82Å; V125-I129 HydrophobicContact CG1-CG1 4.47Å; V125-I129 VanDerWaalsContact O-CG1 3.29Å; V125-I129 WeakPolarHBondContact O-CG1 3.38Å; V125-I129 PolarHBondContact O-N 2.9Å; V126-I129 PolarHBondContact O-N 3.36Å; I129-L132 PolarHBondContact O-N 3.47Å; I129-R133 VanDerWaalsContact O-CB 3.27Å; I129-R133 WeakPolarHBondContact O-CB 3.48Å; I129-R133 PolarHBondContact O-N 2.92Å; I129-C152 HydrophobicContact CG2-CB 4.05Å; I129-F155 HydrophobicContact CD1-CD1 3.34Å; I129-F155 HydrophobicContact CD1-CD2 4.41Å; I129-F155 HydrophobicContact CD1-CE1 3.23Å; I129-F155 HydrophobicContact CD1-CE2 4.32Å; I129-F155 HydrophobicContact CD1-CG 3.96Å; I129-F155 HydrophobicContact CD1-CZ 3.77Å; I129-L156 HydrophobicContact CB-CD2 4.42Å; I129-L156 HydrophobicContact CG2-CD1 4.13Å; I129-L156 HydrophobicContact CG2-CD2 3.99Å; I129-L156 HydrophobicContact CG2-CG 3.92Å; I129-V348 HydrophobicContact CD1-CG1 3.7Å; I129-V348 HydrophobicContact CG1-CG1 3.91Å; I129-V348 HydrophobicContact CG2-CG1 4.23Å; I129-L349 HydrophobicContact CD1-CD2 4.27Å; I129-V352 HydrophobicContact CD1-CG2 4.25Å; I129-V352 HydrophobicContact CG1-CG2 3.39Å
130	I	87.1	Confident	83.5	Confident	61 Å²	61	62.6 Å²	62.6	31%	0.313	33%	0.333	S	S	.	.	H	α-helix	trans	-60.6	-49.6	175.8	-70.3	169.5	0	0	0	110.1	V126 Q127 L132 R133 D134 L156	V126-I130 HydrophobicContact CG1-CD1 3.79Å; V126-I130 HydrophobicContact CG1-CG1 4.4Å; V126-I130 WeakPolarHBondContact O-CG1 3.38Å; V126-I130 PolarHBondContact O-N 3.09Å; Q127-I130 PolarHBondContact O-N 3.47Å; I130-L132 VanDerWaalsContact C-N 3.33Å; I130-L132 PolarHBondContact O-N 3.49Å; I130-R133 PolarHBondContact O-N 3.45Å; I130-D134 WeakPolarHBondContact O-CB 3.29Å; I130-D134 PolarHBondContact O-N 3.07Å; I130-L156 HydrophobicContact CD1-CD2 4.34Å; I130-L156 HydrophobicContact CG1-CD1 3.93Å; I130-L156 HydrophobicContact CG1-CD2 3.8Å
131	A	87	Confident	83.4	Confident	54 Å²	54	62 Å²	62	45%	0.446	33%	0.326	S	S	.	.	H	α-helix	trans	-60.5	-42	179.9	0	0	0	0	0	112.2	Q127 Q128 D134 T135	Q127-A131 WeakPolarHBondContact O-CB 3.37Å; Q127-A131 PolarHBondContact O-N 3.27Å; Q128-A131 PolarHBondContact O-N 3.32Å; A131-D134 PolarHBondContact O-N 3.44Å; A131-T135 WeakPolarHBondContact O-CB 3.45Å; A131-T135 PolarHBondContact O-N 3.46Å; A131-T135 PolarHBondContact O-OG1 2.81Å
132	L	84.4	Confident	83.2	Confident	22 Å²	22	66 Å²	66	12%	0.115	35%	0.345	C	S	.	.	H	α-helix	trans	-67.2	-46.3	178.2	-179	55.9	0	0	0	111.9	Q128 I129 I130 D134 T135 L136 F148 V352 E355	Q128-L132 VanDerWaalsContact O-CB 3.3Å; Q128-L132 WeakPolarHBondContact O-CB 3.22Å; Q128-L132 PolarHBondContact O-N 3.33Å; I129-L132 PolarHBondContact O-N 3.47Å; I130-L132 VanDerWaalsContact C-N 3.33Å; I130-L132 PolarHBondContact O-N 3.49Å; L132-D134 VanDerWaalsContact C-N 3.34Å; L132-D134 PolarHBondContact O-N 3.39Å; L132-T135 PolarHBondContact O-N 3.31Å; L132-L136 PolarHBondContact O-N 3.21Å; L132-F148 HydrophobicContact CD2-CE1 3.69Å; L132-F148 HydrophobicContact CD2-CZ 3.44Å; L132-F148 VanDerWaalsContact CD2-CZ 3.44Å; L132-F148 HydrophobicContact CG-CE1 3.86Å; L132-F148 HydrophobicContact CG-CZ 4.12Å; L132-V352 HydrophobicContact CD2-CG2 4.42Å; L132-E355 HydrophobicContact CD1-CG 3.82Å; L132-E355 HydrophobicContact CD2-CG 4.08Å
133	R	86.8	Confident	82.7	Confident	56 Å²	56	68.8 Å²	68.8	21%	0.211	37%	0.374	C	S	.	.	H	α-helix	trans	-56.2	-48.6	174.1	-179.5	-158.8	67	-167.3	-3.8	111.1	I129 I130 T135 L136 L137 L149 C152 N153 L156	I129-R133 VanDerWaalsContact O-CB 3.27Å; I129-R133 WeakPolarHBondContact O-CB 3.48Å; I129-R133 PolarHBondContact O-N 2.92Å; I130-R133 PolarHBondContact O-N 3.45Å; R133-T135 VanDerWaalsContact C-N 3.28Å; R133-T135 PolarHBondContact O-N 3.17Å; R133-L136 PolarHBondContact O-N 3.18Å; R133-L137 HydrophobicContact CG-CD1 4.12Å; R133-L137 WeakPolarHBondContact O-CG 3.26Å; R133-L137 PolarHBondContact O-N 3.15Å; R133-L149 HydrophobicContact CG-CD2 3.84Å; R133-C152 HydrophobicContact CB-CB 4.37Å; R133-C152 HydrophobicContact CG-CB 4.49Å; R133-N153 WeakPolarHBondContact CD-OD1 3.42Å; R133-L156 VanDerWaalsContact NH1-CD1 3.29Å
134	D	88.5	Confident	82	Confident	60 Å²	60	69.2 Å²	69.2	32%	0.321	38%	0.376	S	S	.	.	H	α-helix	trans	-67.4	-31.3	-177.5	-68.3	-3.7	0	0	0	111.9	I130 A131 L132 K138	I130-D134 WeakPolarHBondContact O-CB 3.29Å; I130-D134 PolarHBondContact O-N 3.07Å; A131-D134 PolarHBondContact O-N 3.44Å; L132-D134 VanDerWaalsContact C-N 3.34Å; L132-D134 PolarHBondContact O-N 3.39Å; D134-K138 WeakPolarHBondContact O-CG 3.39Å; D134-K138 PolarHBondContact O-N 3.02Å
135	T	85.6	Confident	81.7	Confident	68 Å²	68	67 Å²	67	42%	0.417	37%	0.365	S	S	.	.	H	α-helix	trans	-67.8	-45.7	173.3	-59.8	0	0	0	0	111.3	A131 L132 R133 L137 K138	A131-T135 WeakPolarHBondContact O-CB 3.45Å; A131-T135 PolarHBondContact O-N 3.46Å; A131-T135 PolarHBondContact O-OG1 2.81Å; L132-T135 PolarHBondContact O-N 3.31Å; R133-T135 VanDerWaalsContact C-N 3.28Å; R133-T135 PolarHBondContact O-N 3.17Å; T135-L137 PolarHBondContact O-N 3.36Å; T135-K138 WeakPolarHBondContact O-CB 3.31Å; T135-K138 PolarHBondContact O-N 2.73Å
136	L	82.5	Confident	81.3	Confident	23 Å²	23	73.7 Å²	73.7	12%	0.12	39%	0.394	C	S	.	.	H	α-helix	trans	-65.2	-37.5	177.3	-74.5	172	0	0	0	113	L132 R133 K138 Q139 F148 L149	L132-L136 PolarHBondContact O-N 3.21Å; R133-L136 PolarHBondContact O-N 3.18Å; L136-K138 PolarHBondContact O-N 3.17Å; L136-Q139 PolarHBondContact O-N 2.94Å; L136-F148 HydrophobicContact CD1-CD1 3.26Å; L136-F148 HydrophobicContact CD1-CE1 3.42Å; L136-F148 VanDerWaalsContact CD1-CE1 3.42Å; L136-L149 HydrophobicContact CB-CD2 4Å; L136-L149 HydrophobicContact CB-CG 4.49Å; L136-L149 HydrophobicContact CD1-CD2 4.39Å
137	L	85.3	Confident	80.6	Confident	105 Å²	105	75.7 Å²	75.7	55%	0.55	41%	0.413	S	S	.	.	H	α-helix	trans	-64.9	-22.3	176.2	-74.1	173.4	0	0	0	113.4	R133 T135 Q139 L149	R133-L137 HydrophobicContact CG-CD1 4.12Å; R133-L137 WeakPolarHBondContact O-CG 3.26Å; R133-L137 PolarHBondContact O-N 3.15Å; T135-L137 PolarHBondContact O-N 3.36Å; L137-Q139 VanDerWaalsContact C-N 3.33Å; L137-L149 HydrophobicContact CD2-CD1 4.16Å; L137-L149 HydrophobicContact CD2-CD2 4.21Å; L137-L149 HydrophobicContact CG-CD2 4.1Å
138	K	85.6	Confident	80.1	Confident	179 Å²	179	70 Å²	70	78%	0.778	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-11.8	174.4	-69.5	168.6	-174.6	174.6	0	113	D134 T135 L136	D134-K138 WeakPolarHBondContact O-CG 3.39Å; D134-K138 PolarHBondContact O-N 3.02Å; T135-K138 WeakPolarHBondContact O-CB 3.31Å; T135-K138 PolarHBondContact O-N 2.73Å; L136-K138 PolarHBondContact O-N 3.17Å
139	Q	83	Confident	79.8	Confident	120 Å²	120	69.5 Å²	69.5	56%	0.561	39%	0.385	S	S	*	.	S	Bend	trans	-105	165.6	-178.8	-62.5	179.7	6.7	0	0	111.2	L136 L137 V141	L136-Q139 PolarHBondContact O-N 2.94Å; L137-Q139 VanDerWaalsContact C-N 3.33Å; Q139-V141 PolarHBondContact O-N 2.85Å
140	A	70.8	Confident	79.3	Confident	98 Å²	98	72.3 Å²	72.3	81%	0.81	40%	0.404	S	S	*	.			trans	-71.1	102.1	174.3	0	0	0	0	0	109.6	E142	A140-E142 PolarHBondContact O-N 3.37Å
141	V	71.8	Confident	78.6	Confident	52 Å²	52	70.4 Å²	70.4	32%	0.315	40%	0.397	S	S	.	.			trans	-64.5	111.7	-173.2	-177.3	0	0	0	0	111.4	Q139 D145 K146 L149	Q139-V141 PolarHBondContact O-N 2.85Å; V141-D145 HydrophobicContact CG1-CB 3.71Å; V141-K146 HydrophobicContact CG1-CG 3.68Å; V141-L149 HydrophobicContact CB-CD1 4.5Å; V141-L149 HydrophobicContact CG1-CD1 3.64Å; V141-L149 HydrophobicContact CG2-CD1 3.93Å
142	E	75.7	Confident	78.2	Confident	107 Å²	107	67.8 Å²	67.8	50%	0.5	38%	0.376	S	S	.	.			trans	-74.1	167.1	171.7	-62.9	-178.4	178.8	0	0	111.2	A140 K144 D145 K146	A140-E142 PolarHBondContact O-N 3.37Å; E142-K144 HydrophobicContact CB-CG 4.27Å; E142-K144 PolarHBondContact O-N 3.37Å; E142-K144 WeakPolarHBondContact OE2-CD 3.46Å; E142-K144 WeakPolarHBondContact OE2-CE 3.26Å; E142-K144 IonicContact OE2-NZ 3.7Å; E142-K144 PolarHBondContact OE2-NZ 3.33Å; E142-D145 WeakPolarHBondContact CB-OD2 3.48Å; E142-D145 PolarHBondContact N-OD2 3.47Å; E142-D145 WeakPolarHBondContact O-CB 3.31Å; E142-D145 PolarHBondContact O-N 3.49Å; E142-K146 PolarHBondContact O-N 3.39Å
143	A	69.3	Low	78	Confident	87 Å²	87	69.7 Å²	69.7	72%	0.719	39%	0.386	S	S	*	.	H	α-helix	trans	-58.5	-36.2	178.5	0	0	0	0	0	112.9	D145 K146	A143-D145 VanDerWaalsContact C-N 3.3Å; A143-D145 PolarHBondContact O-N 2.87Å; A143-K146 PolarHBondContact O-N 2.98Å
144	K	67.7	Low	77.3	Confident	122 Å²	122	70.7 Å²	70.7	53%	0.53	40%	0.396	S	S	.	.	H	α-helix	trans	-64.5	-36.5	176.2	77	-165.9	-171.3	-150.7	0	111.7	E142 K146 A147 F148	E142-K144 HydrophobicContact CB-CG 4.27Å; E142-K144 PolarHBondContact O-N 3.37Å; E142-K144 WeakPolarHBondContact OE2-CD 3.46Å; E142-K144 WeakPolarHBondContact OE2-CE 3.26Å; E142-K144 IonicContact OE2-NZ 3.7Å; E142-K144 PolarHBondContact OE2-NZ 3.33Å; K144-K146 VanDerWaalsContact C-N 3.33Å; K144-K146 PolarHBondContact O-N 2.82Å; K144-A147 PolarHBondContact O-N 3.46Å; K144-F148 PolarHBondContact O-N 3.02Å
145	D	77.5	Confident	76.6	Confident	19 Å²	19	68.3 Å²	68.3	10%	0.102	38%	0.382	C	S	.	.	H	α-helix	trans	-73.2	-27.8	-178.2	-53.5	-31.9	0	0	0	111.4	V141 E142 A143 F148 L149	V141-D145 HydrophobicContact CG1-CB 3.71Å; E142-D145 WeakPolarHBondContact CB-OD2 3.48Å; E142-D145 PolarHBondContact N-OD2 3.47Å; E142-D145 WeakPolarHBondContact O-CB 3.31Å; E142-D145 PolarHBondContact O-N 3.49Å; A143-D145 VanDerWaalsContact C-N 3.3Å; A143-D145 PolarHBondContact O-N 2.87Å; D145-F148 PolarHBondContact O-N 3.34Å; D145-L149 VanDerWaalsContact O-CB 3.31Å; D145-L149 WeakPolarHBondContact O-CB 3.34Å; D145-L149 VanDerWaalsContact O-CG 3.26Å; D145-L149 WeakPolarHBondContact O-CG 3.15Å; D145-L149 PolarHBondContact O-N 2.87Å
146	K	76.3	Confident	76.3	Confident	141 Å²	141	65.6 Å²	65.6	61%	0.613	37%	0.365	S	S	*	.	H	α-helix	trans	-62.6	-44.7	175.6	-69.3	-174.4	-179	179.3	0	112.7	V141 E142 A143 K144 F148 L149 S150	V141-K146 HydrophobicContact CG1-CG 3.68Å; E142-K146 PolarHBondContact O-N 3.39Å; A143-K146 PolarHBondContact O-N 2.98Å; K144-K146 VanDerWaalsContact C-N 3.33Å; K144-K146 PolarHBondContact O-N 2.82Å; K146-F148 VanDerWaalsContact C-N 3.29Å; K146-L149 PolarHBondContact O-N 3.16Å; K146-S150 PolarHBondContact O-N 2.97Å
147	A	70.9	Confident	75.8	Confident	68 Å²	68	70.9 Å²	70.9	56%	0.562	39%	0.387	S	S	*	.	H	α-helix	trans	-63.3	-41.9	177.7	0	0	0	0	0	110.5	K144 S150 A151	K144-A147 PolarHBondContact O-N 3.46Å; A147-S150 WeakPolarHBondContact O-CB 3.46Å; A147-S150 PolarHBondContact O-N 3.4Å; A147-A151 WeakPolarHBondContact O-CB 3.44Å; A147-A151 PolarHBondContact O-N 2.87Å
148	F	74.8	Confident	74.8	Confident	3 Å²	3	66.2 Å²	66.2	1%	0.013	36%	0.364	C	S	.	.	H	α-helix	trans	-66.5	-43.8	177.4	-179.1	-106.2	0	0	0	113.2	L132 L136 K144 D145 K146 S150 A151 C152 Y351	L132-F148 HydrophobicContact CD2-CE1 3.69Å; L132-F148 HydrophobicContact CD2-CZ 3.44Å; L132-F148 VanDerWaalsContact CD2-CZ 3.44Å; L132-F148 HydrophobicContact CG-CE1 3.86Å; L132-F148 HydrophobicContact CG-CZ 4.12Å; L136-F148 HydrophobicContact CD1-CD1 3.26Å; L136-F148 HydrophobicContact CD1-CE1 3.42Å; L136-F148 VanDerWaalsContact CD1-CE1 3.42Å; K144-F148 PolarHBondContact O-N 3.02Å; D145-F148 PolarHBondContact O-N 3.34Å; K146-F148 VanDerWaalsContact C-N 3.29Å; F148-S150 VanDerWaalsContact C-N 3.32Å; F148-S150 PolarHBondContact O-N 3.34Å; F148-A151 PolarHBondContact O-N 2.95Å; F148-A151 VanDerWaalsContact O-N 3.17Å; F148-C152 WeakPolarHBondContact CE1-SG 3.39Å; F148-C152 WeakPolarHBondContact CZ-SG 3.42Å; F148-C152 PolarHBondContact O-N 2.99Å; F148-C152 PolarHBondContact O-SG 2.91Å; F148-Y351 HydrophobicContact CD1-CD1 4.33Å; F148-Y351 AromaticContact CD2-CD1 3.95Å; F148-Y351 HydrophobicContact CD2-CD1 3.95Å; F148-Y351 AromaticContact CD2-CD2 3.45Å; F148-Y351 HydrophobicContact CD2-CD2 3.45Å; F148-Y351 VanDerWaalsContact CD2-CD2 3.45Å; F148-Y351 HydrophobicContact CD2-CE1 4.29Å; F148-Y351 AromaticContact CD2-CE2 3.82Å; F148-Y351 HydrophobicContact CD2-CE2 3.82Å; F148-Y351 AromaticContact CD2-CG 3.5Å; F148-Y351 HydrophobicContact CD2-CG 3.5Å; F148-Y351 HydrophobicContact CE1-CD1 4.27Å; F148-Y351 HydrophobicContact CE1-CG 4.4Å; F148-Y351 AromaticContact CE2-CD1 3.92Å; F148-Y351 HydrophobicContact CE2-CD1 3.92Å; F148-Y351 AromaticContact CE2-CD2 3.59Å; F148-Y351 HydrophobicContact CE2-CD2 3.59Å; F148-Y351 HydrophobicContact CE2-CE2 4.41Å; F148-Y351 AromaticContact CE2-CG 3.28Å; F148-Y351 HydrophobicContact CE2-CG 3.28Å; F148-Y351 HydrophobicContact CG-CD1 4.16Å; F148-Y351 HydrophobicContact CG-CD2 4.3Å; F148-Y351 HydrophobicContact CG-CE1 4.24Å; F148-Y351 HydrophobicContact CG-CE2 4.36Å; F148-Y351 HydrophobicContact CG-CG 4.18Å; F148-Y351 VanDerWaalsContact CZ-CB 3.41Å; F148-Y351 HydrophobicContact CZ-CD1 4.07Å; F148-Y351 HydrophobicContact CZ-CD2 4.49Å; F148-Y351 AromaticContact CZ-CG 3.77Å; F148-Y351 HydrophobicContact CZ-CG 3.77Å
149	L	80.2	Confident	73.9	Confident	15 Å²	15	58.2 Å²	58.2	8%	0.079	33%	0.33	C	S	.	.	H	α-helix	trans	-60.1	-41.3	173.7	-78.3	170.8	0	0	0	111.8	R133 L136 L137 V141 D145 K146 C152 N153	R133-L149 HydrophobicContact CG-CD2 3.84Å; L136-L149 HydrophobicContact CB-CD2 4Å; L136-L149 HydrophobicContact CB-CG 4.49Å; L136-L149 HydrophobicContact CD1-CD2 4.39Å; L137-L149 HydrophobicContact CD2-CD1 4.16Å; L137-L149 HydrophobicContact CD2-CD2 4.21Å; L137-L149 HydrophobicContact CG-CD2 4.1Å; V141-L149 HydrophobicContact CB-CD1 4.5Å; V141-L149 HydrophobicContact CG1-CD1 3.64Å; V141-L149 HydrophobicContact CG2-CD1 3.93Å; D145-L149 VanDerWaalsContact O-CB 3.31Å; D145-L149 WeakPolarHBondContact O-CB 3.34Å; D145-L149 VanDerWaalsContact O-CG 3.26Å; D145-L149 WeakPolarHBondContact O-CG 3.15Å; D145-L149 PolarHBondContact O-N 2.87Å; K146-L149 PolarHBondContact O-N 3.16Å; L149-C152 PolarHBondContact O-N 3Å; L149-N153 VanDerWaalsContact O-CG 3.26Å; L149-N153 PolarHBondContact O-N 3.37Å; L149-N153 PolarHBondContact O-ND2 3.26Å
150	S	75	Confident	73.2	Confident	59 Å²	59	59.1 Å²	59.1	41%	0.413	34%	0.338	S	S	.	.	H	α-helix	trans	-59.2	-49.1	173.2	-168	0	0	0	0	110.6	K146 A147 F148 C152 N153 D154	K146-S150 PolarHBondContact O-N 2.97Å; A147-S150 WeakPolarHBondContact O-CB 3.46Å; A147-S150 PolarHBondContact O-N 3.4Å; F148-S150 VanDerWaalsContact C-N 3.32Å; F148-S150 PolarHBondContact O-N 3.34Å; S150-C152 VanDerWaalsContact C-N 3.34Å; S150-C152 PolarHBondContact O-N 2.84Å; S150-N153 PolarHBondContact O-N 3.05Å; S150-N153 VanDerWaalsContact O-N 3.11Å; S150-D154 PolarHBondContact O-N 2.87Å
151	A	73.1	Confident	72.5	Confident	20 Å²	20	55.1 Å²	55.1	17%	0.165	31%	0.305	C	S	.	.	H	α-helix	trans	-61.6	-40.9	179.9	0	0	0	0	0	111.9	A147 F148 N153 D154 F155 I347 V348	A147-A151 WeakPolarHBondContact O-CB 3.44Å; A147-A151 PolarHBondContact O-N 2.87Å; F148-A151 PolarHBondContact O-N 2.95Å; F148-A151 VanDerWaalsContact O-N 3.17Å; A151-N153 PolarHBondContact O-N 3.38Å; A151-D154 PolarHBondContact O-N 3Å; A151-F155 WeakPolarHBondContact O-CB 3.43Å; A151-F155 PolarHBondContact O-N 3.29Å; A151-I347 HydrophobicContact CB-CG2 3.74Å; A151-V348 HydrophobicContact CB-CG2 3.35Å; A151-V348 VanDerWaalsContact O-CG2 3.3Å; A151-V348 WeakPolarHBondContact O-CG2 3.35Å
152	C	78.5	Confident	71.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-58.6	-46.9	172.6	-69.6	0	0	0	0	111.5	I129 R133 F148 L149 S150 D154 F155 L156	I129-C152 HydrophobicContact CG2-CB 4.05Å; R133-C152 HydrophobicContact CB-CB 4.37Å; R133-C152 HydrophobicContact CG-CB 4.49Å; F148-C152 WeakPolarHBondContact CE1-SG 3.39Å; F148-C152 WeakPolarHBondContact CZ-SG 3.42Å; F148-C152 PolarHBondContact O-N 2.99Å; F148-C152 PolarHBondContact O-SG 2.91Å; L149-C152 PolarHBondContact O-N 3Å; S150-C152 VanDerWaalsContact C-N 3.34Å; S150-C152 PolarHBondContact O-N 2.84Å; C152-D154 VanDerWaalsContact C-N 3.35Å; C152-D154 PolarHBondContact O-N 3.08Å; C152-F155 PolarHBondContact O-N 2.96Å; C152-L156 WeakPolarHBondContact O-CB 3.3Å; C152-L156 VanDerWaalsContact O-CG 3.26Å; C152-L156 WeakPolarHBondContact O-CG 3.3Å; C152-L156 PolarHBondContact O-N 2.72Å
153	N	80.2	Confident	70.4	Confident	61 Å²	61	51.7 Å²	51.7	33%	0.326	29%	0.292	S	S	.	.	H	α-helix	trans	-65.7	-38.4	179.1	-70.4	-37.2	0	0	0	112.1	R133 L149 S150 A151 L156 K157	R133-N153 WeakPolarHBondContact CD-OD1 3.42Å; L149-N153 VanDerWaalsContact O-CG 3.26Å; L149-N153 PolarHBondContact O-N 3.37Å; L149-N153 PolarHBondContact O-ND2 3.26Å; S150-N153 PolarHBondContact O-N 3.05Å; S150-N153 VanDerWaalsContact O-N 3.11Å; A151-N153 PolarHBondContact O-N 3.38Å; N153-L156 PolarHBondContact O-N 3.06Å; N153-K157 VanDerWaalsContact O-CB 3.31Å; N153-K157 WeakPolarHBondContact O-CB 3.37Å; N153-K157 WeakPolarHBondContact O-CG 3.27Å; N153-K157 PolarHBondContact O-N 3.28Å
154	D	70.6	Confident	69.2	Low	77 Å²	77	53 Å²	53	41%	0.412	29%	0.294	S	S	.	.	H	α-helix	trans	-67.8	-39.5	177.3	-66	-28.7	0	0	0	111.2	S150 A151 C152 A158	S150-D154 PolarHBondContact O-N 2.87Å; A151-D154 PolarHBondContact O-N 3Å; C152-D154 VanDerWaalsContact C-N 3.35Å; C152-D154 PolarHBondContact O-N 3.08Å; D154-A158 WeakPolarHBondContact O-CB 3.36Å; D154-A158 PolarHBondContact O-N 3.34Å
155	F	74.7	Confident	68.2	Low	10 Å²	10	49.4 Å²	49.4	4%	0.044	28%	0.28	C	S	.	.	H	α-helix	trans	-62.1	-51.4	172.4	-175.7	-83.4	0	0	0	111.4	Y17 V125 V126 I129 A151 C152 K157 A158 M159 V348 L349	Y17-F155 WeakPolarHBondContact O-CE2 3.49Å; V125-F155 HydrophobicContact CG1-CZ 4.4Å; V126-F155 HydrophobicContact CG2-CE1 4.41Å; I129-F155 HydrophobicContact CD1-CD1 3.34Å; I129-F155 HydrophobicContact CD1-CD2 4.41Å; I129-F155 HydrophobicContact CD1-CE1 3.23Å; I129-F155 HydrophobicContact CD1-CE2 4.32Å; I129-F155 HydrophobicContact CD1-CG 3.96Å; I129-F155 HydrophobicContact CD1-CZ 3.77Å; A151-F155 WeakPolarHBondContact O-CB 3.43Å; A151-F155 PolarHBondContact O-N 3.29Å; C152-F155 PolarHBondContact O-N 2.96Å; F155-K157 PolarHBondContact O-N 3.04Å; F155-A158 WeakPolarHBondContact O-CB 3.41Å; F155-A158 PolarHBondContact O-N 2.78Å; F155-M159 HydrophobicContact CD1-CG 3.78Å; F155-M159 HydrophobicContact CE1-CG 3.48Å; F155-M159 VanDerWaalsContact CE1-CG 3.48Å; F155-M159 HydrophobicContact CE1-SD 4.16Å; F155-M159 HydrophobicContact CZ-CG 4.08Å; F155-M159 HydrophobicContact CZ-SD 4.26Å; F155-M159 WeakPolarHBondContact O-CB 3.39Å; F155-M159 WeakPolarHBondContact O-CG 3.43Å; F155-M159 PolarHBondContact O-N 2.83Å; F155-V348 HydrophobicContact CB-CG1 4.33Å; F155-V348 HydrophobicContact CB-CG2 4.32Å; F155-V348 HydrophobicContact CG-CG1 4.4Å; F155-L349 HydrophobicContact CE2-CD2 4.22Å; F155-L349 HydrophobicContact CZ-CD2 4.41Å
156	L	78.9	Confident	66.2	Low	11 Å²	11	57.7 Å²	57.7	6%	0.058	32%	0.315	C	S	.	.	H	α-helix	trans	-64	-40.2	-178.8	-68.6	173.8	0	0	0	112.1	V126 I129 I130 R133 C152 N153 A158 M159 D160	V126-L156 HydrophobicContact CG1-CD2 3.94Å; I129-L156 HydrophobicContact CB-CD2 4.42Å; I129-L156 HydrophobicContact CG2-CD1 4.13Å; I129-L156 HydrophobicContact CG2-CD2 3.99Å; I129-L156 HydrophobicContact CG2-CG 3.92Å; I130-L156 HydrophobicContact CD1-CD2 4.34Å; I130-L156 HydrophobicContact CG1-CD1 3.93Å; I130-L156 HydrophobicContact CG1-CD2 3.8Å; R133-L156 VanDerWaalsContact NH1-CD1 3.29Å; C152-L156 WeakPolarHBondContact O-CB 3.3Å; C152-L156 VanDerWaalsContact O-CG 3.26Å; C152-L156 WeakPolarHBondContact O-CG 3.3Å; C152-L156 PolarHBondContact O-N 2.72Å; N153-L156 PolarHBondContact O-N 3.06Å; L156-A158 VanDerWaalsContact C-N 3.35Å; L156-A158 PolarHBondContact O-N 2.89Å; L156-M159 WeakPolarHBondContact O-CB 3.25Å; L156-M159 PolarHBondContact O-N 3.36Å; L156-M159 VanDerWaalsContact O-N 3.13Å; L156-D160 PolarHBondContact O-N 2.89Å
157	K	71.5	Confident	64.2	Low	134 Å²	134	55.1 Å²	55.1	58%	0.583	32%	0.32	S	S	*	.	H	α-helix	trans	-60.8	-44.2	172.7	-76.3	170.9	-174.5	172.1	0	111.7	N153 F155 M159 D160 A161	N153-K157 VanDerWaalsContact O-CB 3.31Å; N153-K157 WeakPolarHBondContact O-CB 3.37Å; N153-K157 WeakPolarHBondContact O-CG 3.27Å; N153-K157 PolarHBondContact O-N 3.28Å; F155-K157 PolarHBondContact O-N 3.04Å; K157-M159 PolarHBondContact O-N 2.89Å; K157-D160 PolarHBondContact O-N 3.33Å; K157-A161 VanDerWaalsContact O-CB 3.3Å; K157-A161 WeakPolarHBondContact O-CB 3.45Å; K157-A161 PolarHBondContact O-N 2.9Å; K157-A161 VanDerWaalsContact O-N 3.08Å
158	A	65.1	Low	62.3	Low	7 Å²	7	56 Å²	56	6%	0.058	32%	0.322	C	S	.	.	H	α-helix	trans	-61.7	-33.9	176.2	0	0	0	0	0	112.1	W14 W21 D154 F155 L156 A161 L162	W14-A158 HydrophobicContact CE3-CB 3.99Å; W14-A158 HydrophobicContact CH2-CB 3.56Å; W14-A158 HydrophobicContact CZ2-CB 4.48Å; W14-A158 HydrophobicContact CZ3-CB 3.26Å; W21-A158 VanDerWaalsContact NE1-CB 3.28Å; D154-A158 WeakPolarHBondContact O-CB 3.36Å; D154-A158 PolarHBondContact O-N 3.34Å; F155-A158 WeakPolarHBondContact O-CB 3.41Å; F155-A158 PolarHBondContact O-N 2.78Å; L156-A158 VanDerWaalsContact C-N 3.35Å; L156-A158 PolarHBondContact O-N 2.89Å; A158-A161 WeakPolarHBondContact O-CB 3.44Å; A158-A161 PolarHBondContact O-N 2.7Å; A158-L162 PolarHBondContact O-N 2.86Å
159	M	67.4	Low	60.2	Low	12 Å²	12	61.6 Å²	61.6	6%	0.059	36%	0.356	C	S	.	.	H	α-helix	trans	-71.5	-42.6	178.5	-76	-67.6	-64.4	0	0	113.7	Y17 R122 V126 F155 L156 K157 A161 L162	Y17-M159 HydrophobicContact CD1-SD 3.8Å; Y17-M159 HydrophobicContact CE1-CE 4.48Å; Y17-M159 HydrophobicContact CE1-SD 3.48Å; Y17-M159 WeakPolarHBondContact CE1-SD 3.41Å; R122-M159 HydrophobicContact CG-CE 3.36Å; R122-M159 HydrophobicContact CG-SD 4.3Å; R122-M159 PolarHBondContact NE-SD 2.94Å; R122-M159 PolarHBondContact NH2-O 3.45Å; R122-M159 VanDerWaalsContact NH2-O 3.09Å; V126-M159 HydrophobicContact CG2-CE 3.05Å; V126-M159 HydrophobicContact CG2-CG 4.27Å; V126-M159 HydrophobicContact CG2-SD 4.39Å; F155-M159 HydrophobicContact CD1-CG 3.78Å; F155-M159 HydrophobicContact CE1-CG 3.48Å; F155-M159 VanDerWaalsContact CE1-CG 3.48Å; F155-M159 HydrophobicContact CE1-SD 4.16Å; F155-M159 HydrophobicContact CZ-CG 4.08Å; F155-M159 HydrophobicContact CZ-SD 4.26Å; F155-M159 WeakPolarHBondContact O-CB 3.39Å; F155-M159 WeakPolarHBondContact O-CG 3.43Å; F155-M159 PolarHBondContact O-N 2.83Å; L156-M159 WeakPolarHBondContact O-CB 3.25Å; L156-M159 PolarHBondContact O-N 3.36Å; L156-M159 VanDerWaalsContact O-N 3.13Å; K157-M159 PolarHBondContact O-N 2.89Å; M159-A161 PolarHBondContact O-N 3.33Å; M159-L162 PolarHBondContact O-N 3.43Å; M159-L162 HydrophobicContact SD-CD1 3.97Å
160	D	68	Low	57.8	Low	139 Å²	139	68.9 Å²	68.9	74%	0.743	40%	0.395	S	S	*	.	H	α-helix	trans	-65.6	-24	172.6	-68.9	-23.2	0	0	0	111.6	L156 K157	L156-D160 PolarHBondContact O-N 2.89Å; K157-D160 PolarHBondContact O-N 3.33Å
161	A	55.2	Low	55.6	Low	14 Å²	14	71.5 Å²	71.5	12%	0.116	41%	0.409	C	S	.	.	H	α-helix	trans	-76.3	-27.2	177.9	0	0	0	0	0	112.3	R66 K157 A158 M159	R66-A161 PolarHBondContact NH1-O 3.44Å; R66-A161 PolarHBondContact NH2-O 3.25Å; K157-A161 VanDerWaalsContact O-CB 3.3Å; K157-A161 WeakPolarHBondContact O-CB 3.45Å; K157-A161 PolarHBondContact O-N 2.9Å; K157-A161 VanDerWaalsContact O-N 3.08Å; A158-A161 WeakPolarHBondContact O-CB 3.44Å; A158-A161 PolarHBondContact O-N 2.7Å; M159-A161 PolarHBondContact O-N 3.33Å
162	L	53.7	Low	53.3	Low	17 Å²	17	78.7 Å²	78.7	9%	0.089	44%	0.439	C	S	.	.	S	Bend	trans	-64.9	136.8	174.7	-73.4	163.5	0	0	0	109.3	Y17 Y78 R122 A158 M159	Y17-L162 HydrophobicContact CE1-CD1 3.69Å; Y78-L162 HydrophobicContact CD2-CD2 4.47Å; Y78-L162 HydrophobicContact CE1-CD2 3.92Å; Y78-L162 HydrophobicContact CE2-CD2 3.87Å; R122-L162 VanDerWaalsContact CZ-CD1 3.47Å; A158-L162 PolarHBondContact O-N 2.86Å; M159-L162 PolarHBondContact O-N 3.43Å; M159-L162 HydrophobicContact SD-CD1 3.97Å
163	P	49	Very low	51	Low	70 Å²	70	87.3 Å²	87.3	46%	0.455	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-51.7	136.3	-175.3	17.1	-29.8	0	0	0	110.8	D165	P163-D165 PolarHBondContact O-N 3.22Å
164	P	45	Very low	48.4	Very low	115 Å²	115	88.6 Å²	88.6	75%	0.747	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-58.4	135.1	-179	21.3	-30.9	0	0	0	110.2	K166	P164-K166 PolarHBondContact O-N 2.88Å
165	D	45.8	Very low	46.3	Very low	45 Å²	45	90.7 Å²	90.7	24%	0.241	51%	0.508	C	S	.	.			trans	-50	103	-179.9	-81.2	-14.6	0	0	0	110.2	L119 K123 P163 A167	L119-D165 WeakPolarHBondContact CD2-OD1 3.29Å; K123-D165 VanDerWaalsContact CE-OD2 3.3Å; K123-D165 WeakPolarHBondContact CE-OD2 3.23Å; K123-D165 IonicContact NZ-OD2 3.43Å; K123-D165 PolarHBondContact NZ-OD2 2.89Å; P163-D165 PolarHBondContact O-N 3.22Å; D165-A167 PolarHBondContact O-N 2.86Å
166	K	35.7	Very low	44.1	Very low	194 Å²	194	98.5 Å²	98.5	84%	0.843	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	38.1	172.4	-74.8	-165.6	177.6	-176.4	0	112.7	P164	P164-K166 PolarHBondContact O-N 2.88Å
167	A	35.4	Very low	41.8	Very low	86 Å²	86	103.7 Å²	103.7	71%	0.711	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	6.2	171.4	0	0	0	0	0	113.1	D165	D165-A167 PolarHBondContact O-N 2.86Å
168	S	30.5	Very low	39.7	Very low	87 Å²	87	103.8 Å²	103.8	61%	0.608	59%	0.589	S	S	*	*	S	Bend	trans	-130.3	5.5	-175.2	62.4	0	0	0	0	117	D170	S168-D170 VanDerWaalsContact C-N 3.27Å; S168-D170 PolarHBondContact O-N 3.39Å
169	V	31.1	Very low	37.9	Very low	120 Å²	120	107.4 Å²	107.4	73%	0.727	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-10.6	-177.9	-171.8	0	0	0	0	113.6
170	D	29.3	Very low	36	Very low	168 Å²	168	113.6 Å²	113.6	90%	0.898	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	12.1	176.2	-78.7	-25.1	0	0	0	115.4	S168	S168-D170 VanDerWaalsContact C-N 3.27Å; S168-D170 PolarHBondContact O-N 3.39Å
171	V	28.8	Very low	34.3	Very low	115 Å²	115	110.1 Å²	110.1	70%	0.697	65%	0.652	S	S	*	*	S	Bend	trans	-113.9	78.6	165.8	-169.7	0	0	0	0	109.1	E173	V171-E173 PolarHBondContact O-N 3.02Å; V171-E173 VanDerWaalsContact O-N 3.11Å
172	Q	25.6	Very low	33	Very low	171 Å²	171	118.1 Å²	118.1	80%	0.799	69%	0.692	S	S	*	*			trans	-54.1	111.9	166.5	-164	152.5	-14.2	0	0	109.8	S174	Q172-S174 PolarHBondContact O-N 2.88Å
173	E	28.7	Very low	31.9	Very low	180 Å²	180	125.7 Å²	125.7	84%	0.841	73%	0.731	S	S	*	*	S	Bend	trans	54.2	60.6	141	-148.9	169.5	-158.2	0	0	116.7	V171	V171-E173 PolarHBondContact O-N 3.02Å; V171-E173 VanDerWaalsContact O-N 3.11Å
174	S	26.3	Very low	31	Very low	89 Å²	89	125.6 Å²	125.6	62%	0.622	74%	0.737	S	S	*	*			trans	-155.3	149	147	58.4	0	0	0	0	108.7	Q172	Q172-S174 PolarHBondContact O-N 2.88Å
175	V	27.4	Very low	30.2	Very low	120 Å²	120	126.6 Å²	126.6	73%	0.727	74%	0.736	S	S	*	*			trans	84.9	37.8	-178.7	-150.6	0	0	0	0	116
176	L	28.1	Very low	29.3	Very low	175 Å²	175	130.3 Å²	130.3	92%	0.916	77%	0.765	S	S	*	*			trans	-94.5	82.9	145.6	-84.7	162.9	0	0	0	108
177	T	29.4	Very low	28.9	Very low	120 Å²	120	128.4 Å²	128.4	74%	0.736	76%	0.762	S	S	*	*	S	Bend	trans	-163.1	-12.3	160.5	12.5	0	0	0	0	115.8
178	N	28.2	Very low	28.4	Very low	136 Å²	136	132.2 Å²	132.2	73%	0.727	77%	0.766	S	S	*	*			trans	-113.6	33.9	-173.1	-68.7	-3.8	0	0	0	115.1	T180	N178-T180 VanDerWaalsContact C-N 3.27Å; N178-T180 PolarHBondContact O-N 3.47Å
179	G	26.7	Very low	28.1	Very low	83 Å²	83	133.8 Å²	133.8	86%	0.856	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	5.5	-178.4	0	0	0	0	0	116.8
180	T	28.9	Very low	27.9	Very low	141 Å²	141	134.2 Å²	134.2	87%	0.865	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	10.3	-173.8	16.6	0	0	0	0	116.1	N178	N178-T180 VanDerWaalsContact C-N 3.27Å; N178-T180 PolarHBondContact O-N 3.47Å
181	S	30.7	Very low	27.7	Very low	67 Å²	67	130.7 Å²	130.7	47%	0.469	77%	0.768	S	S	.	*			trans	-112.7	-2	-175.6	-158.5	0	0	0	0	117.3	L183	S181-L183 VanDerWaalsContact C-N 3.31Å; S181-L183 PolarHBondContact O-N 3.32Å
182	L	29.6	Very low	27.6	Very low	181 Å²	181	132.9 Å²	132.9	95%	0.948	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	1.1	-179.1	-74.2	174.5	0	0	0	115.2
183	L	28.7	Very low	27.7	Very low	176 Å²	176	133.3 Å²	133.3	92%	0.921	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-1.8	171.9	-78.5	167.1	0	0	0	114	S181	S181-L183 VanDerWaalsContact C-N 3.31Å; S181-L183 PolarHBondContact O-N 3.32Å
184	A	30.1	Very low	27.5	Very low	69 Å²	69	130.7 Å²	130.7	57%	0.57	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-18.3	-174.5	0	0	0	0	0	115.5	S186	A184-S186 PolarHBondContact O-N 3.46Å
185	D	28.6	Very low	27.5	Very low	136 Å²	136	130 Å²	130	73%	0.727	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	10.7	-169.5	-74.9	-13.8	0	0	0	115.9
186	S	27.8	Very low	27.4	Very low	123 Å²	123	129.1 Å²	129.1	86%	0.86	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	11.7	177.5	-84.4	0	0	0	0	115.7	A184	A184-S186 PolarHBondContact O-N 3.46Å
187	I	26	Very low	27.4	Very low	153 Å²	153	129.8 Å²	129.8	79%	0.785	79%	0.788	S	S	*	*			trans	-116.4	71.9	170.3	-48.1	178.8	0	0	0	109.6
188	Q	25.7	Very low	27.2	Very low	167 Å²	167	130.2 Å²	130.2	78%	0.78	80%	0.796	S	S	*	*			trans	-122.3	75.5	157.6	-147.5	157.6	3.8	0	0	108.7	N190	Q188-N190 VanDerWaalsContact C-N 3.26Å; Q188-N190 PolarHBondContact O-N 2.96Å
189	C	23.6	Very low	27.1	Very low	119 Å²	119	127 Å²	127	80%	0.804	80%	0.795	S	S	*	*			trans	-60	92.9	159.9	-71.8	0	0	0	0	107.8	A191	C189-A191 VanDerWaalsContact C-N 3.31Å; C189-A191 PolarHBondContact O-N 3.47Å
190	N	27.6	Very low	27.2	Very low	129 Å²	129	131.3 Å²	131.3	69%	0.69	80%	0.798	S	S	*	*			trans	-68.5	96	166.4	-76.4	-19.7	0	0	0	107.9	Q188 I192	Q188-N190 VanDerWaalsContact C-N 3.26Å; Q188-N190 PolarHBondContact O-N 2.96Å; N190-I192 PolarHBondContact O-N 2.78Å
191	A	24.4	Very low	27	Very low	94 Å²	94	133.9 Å²	133.9	78%	0.777	80%	0.8	S	S	*	*			trans	-61.5	100	161.9	0	0	0	0	0	107.7	C189 E193	C189-A191 VanDerWaalsContact C-N 3.31Å; C189-A191 PolarHBondContact O-N 3.47Å; A191-E193 PolarHBondContact O-N 3.28Å
192	I	26.9	Very low	26.8	Very low	161 Å²	161	138.5 Å²	138.5	83%	0.826	82%	0.815	S	S	*	*			trans	-80.7	110.7	168.7	-62.8	176.8	0	0	0	106.2	N190	N190-I192 PolarHBondContact O-N 2.78Å
193	E	27.5	Very low	27	Very low	180 Å²	180	136.2 Å²	136.2	84%	0.841	81%	0.811	S	S	*	*			trans	-59.1	138.5	180	-70.1	177.8	148	0	0	112.3	A191 G195	A191-E193 PolarHBondContact O-N 3.28Å; E193-G195 PolarHBondContact O-N 3.39Å
194	S	26.1	Very low	27.1	Very low	126 Å²	126	136.9 Å²	136.9	88%	0.881	81%	0.806	S	S	*	*			trans	-62.4	92.4	175.9	-56.2	0	0	0	0	111.8	A196	S194-A196 PolarHBondContact O-N 3.12Å
195	G	26	Very low	27.2	Very low	74 Å²	74	138.7 Å²	138.7	76%	0.763	82%	0.815	S	S	*	*			trans	-82.5	94.2	163.4	0	0	0	0	0	110.5	E193 Q197	E193-G195 PolarHBondContact O-N 3.39Å; G195-Q197 PolarHBondContact O-N 3.45Å
196	A	25.4	Very low	27.6	Very low	101 Å²	101	136.6 Å²	136.6	84%	0.835	81%	0.811	S	S	*	*			trans	-66.7	110.4	170.3	0	0	0	0	0	110.1	S194	S194-A196 PolarHBondContact O-N 3.12Å
197	Q	27.1	Very low	28.2	Very low	190 Å²	190	133.8 Å²	133.8	89%	0.888	80%	0.795	S	S	*	*			trans	-128.8	105.6	161	-76.1	-171.5	-9.2	0	0	109.3	G195	G195-Q197 PolarHBondContact O-N 3.45Å
198	S	26	Very low	29.3	Very low	129 Å²	129	131.5 Å²	131.5	90%	0.902	78%	0.784	S	S	*	*			trans	-61.1	123.8	163.8	47.9	0	0	0	0	110.2
199	G	26.6	Very low	30.5	Very low	69 Å²	69	125 Å²	125	71%	0.711	76%	0.755	S	S	*	*			trans	-164.8	129.6	170.9	0	0	0	0	0	109.5
200	D	27.6	Very low	31.9	Very low	172 Å²	172	121.7 Å²	121.7	92%	0.92	73%	0.733	S	S	*	*			trans	-54.4	139.2	-159	-71.8	-60.4	0	0	0	117
201	Q	25.1	Very low	33.3	Very low	195 Å²	195	126 Å²	126	91%	0.911	74%	0.74	S	S	*	*			trans	-73	118.6	177.8	-67.1	171	-14.7	0	0	110.9
202	Q	26.2	Very low	35.4	Very low	165 Å²	165	124.2 Å²	124.2	77%	0.771	72%	0.715	S	S	*	*			trans	-113.9	137.6	148.7	-89	-177.4	-57.5	0	0	108.9	F204	Q202-F204 WeakPolarHBondContact O-CD2 3.46Å; Q202-F204 PolarHBondContact O-N 3.12Å; Q202-F204 VanDerWaalsContact O-N 3.12Å
203	P	33.9	Very low	37.9	Very low	133 Å²	133	120.3 Å²	120.3	86%	0.864	70%	0.701	S	S	*	*			trans	-76.8	105.5	-162.8	30.4	-34.7	0	0	0	111.1
204	F	30.1	Very low	41	Very low	189 Å²	189	111.9 Å²	111.9	83%	0.829	66%	0.661	S	S	*	*			trans	-73.7	125.4	171.4	-80.1	-86.4	0	0	0	110.5	Q202 S206	Q202-F204 WeakPolarHBondContact O-CD2 3.46Å; Q202-F204 PolarHBondContact O-N 3.12Å; Q202-F204 VanDerWaalsContact O-N 3.12Å; F204-S206 PolarHBondContact O-N 3.42Å
205	S	32.5	Very low	44.2	Very low	107 Å²	107	107 Å²	107	75%	0.748	63%	0.625	S	S	*	*			trans	-59.4	126.8	179.4	56.8	0	0	0	0	111.8	A207	S205-A207 PolarHBondContact O-N 3.02Å; S205-A207 VanDerWaalsContact O-N 3.13Å
206	S	37.2	Very low	47.6	Very low	93 Å²	93	103.5 Å²	103.5	65%	0.65	59%	0.589	S	S	*	*			trans	-56	112.1	173.5	53.1	0	0	0	0	110.9	F204 D208	F204-S206 PolarHBondContact O-N 3.42Å; S206-D208 PolarHBondContact O-N 3.23Å
207	A	41.9	Very low	50.9	Low	63 Å²	63	101.7 Å²	101.7	52%	0.521	56%	0.563	S	S	.	*			trans	-67.4	118.8	172.3	0	0	0	0	0	109.3	S205 L209	S205-A207 PolarHBondContact O-N 3.02Å; S205-A207 VanDerWaalsContact O-N 3.13Å; A207-L209 PolarHBondContact O-N 3.39Å
208	D	48.5	Very low	54.2	Low	105 Å²	105	95.3 Å²	95.3	56%	0.561	53%	0.534	S	S	*	.			trans	-73	94.2	176.4	-170.1	-2.5	0	0	0	109.3	S206 S210	S206-D208 PolarHBondContact O-N 3.23Å; D208-S210 VanDerWaalsContact CG-OG 3.28Å; D208-S210 PolarHBondContact O-N 3.24Å; D208-S210 PolarHBondContact OD1-OG 2.94Å
209	L	50.6	Low	57.6	Low	30 Å²	30	89.2 Å²	89.2	16%	0.157	49%	0.491	C	S	.	.	G	3₁₀ helix	trans	-70.8	-6	-174.3	-75.8	158.6	0	0	0	114.1	A207 R211 Q212 I371 P383	A207-L209 PolarHBondContact O-N 3.39Å; L209-R211 PolarHBondContact O-N 2.73Å; L209-Q212 HydrophobicContact CD2-CB 4.48Å; L209-Q212 HydrophobicContact CD2-CG 3.79Å; L209-Q212 PolarHBondContact O-N 2.89Å; L209-I371 HydrophobicContact CD2-CD1 4.48Å; L209-P383 VanDerWaalsContact CD1-CA 3.47Å; L209-P383 HydrophobicContact CD1-CB 3.74Å
210	S	52.9	Low	60.9	Low	50 Å²	50	86.1 Å²	86.1	35%	0.35	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-55.7	-14.1	171.1	60.6	0	0	0	0	113.3	D208	D208-S210 VanDerWaalsContact CG-OG 3.28Å; D208-S210 PolarHBondContact O-N 3.24Å; D208-S210 PolarHBondContact OD1-OG 2.94Å
211	R	57.9	Low	64.2	Low	220 Å²	220	82.2 Å²	82.2	83%	0.83	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-94.6	-4.1	176.2	-67.1	-177.1	179.4	174.9	0.7	115.4	L209	L209-R211 PolarHBondContact O-N 2.73Å
212	Q	66.8	Low	67.6	Low	56 Å²	56	76.4 Å²	76.4	26%	0.262	41%	0.405	S	S	.	.	S	Bend	trans	-85.5	132.5	179.9	-69.6	-158.8	-7.5	0	0	111.1	L209 N214 I371	L209-Q212 HydrophobicContact CD2-CB 4.48Å; L209-Q212 HydrophobicContact CD2-CG 3.79Å; L209-Q212 PolarHBondContact O-N 2.89Å; Q212-N214 PolarHBondContact O-N 3.12Å; Q212-I371 HydrophobicContact CB-CG2 3.85Å
213	P	81.1	Confident	71	Confident	80 Å²	80	68.6 Å²	68.6	52%	0.519	37%	0.369	S	S	.	.			trans	-61.4	130.7	180	26.4	-33.4	0	0	0	109.3	H372	P213-H372 VanDerWaalsContact C-ND1 3.33Å; P213-H372 PolarHBondContact O-N 3.43Å; P213-H372 VanDerWaalsContact O-N 3.13Å; P213-H372 PolarHBondContact O-ND1 2.6Å
214	N	91	Very high	73.9	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.011	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-120.9	162.5	178	65.5	75.3	0	0	0	111.3	Q212 V216 E217 E218 L370 H372 L389	Q212-N214 PolarHBondContact O-N 3.12Å; N214-V216 PolarHBondContact O-N 3.33Å; N214-V216 WeakPolarHBondContact OD1-CB 3.31Å; N214-V216 PolarHBondContact OD1-N 3.27Å; N214-V216 VanDerWaalsContact OD1-N 3.1Å; N214-E217 WeakPolarHBondContact ND2-CG 3.2Å; N214-E217 PolarHBondContact ND2-OE1 3.42Å; N214-E217 VanDerWaalsContact ND2-OE1 3.15Å; N214-E217 PolarHBondContact ND2-OE2 2.9Å; N214-E217 PolarHBondContact O-N 3.04Å; N214-E217 PolarHBondContact OD1-N 2.84Å; N214-E218 PolarHBondContact O-N 3.31Å; N214-L370 CarbonylContact C-O 3.47Å; N214-L370 VanDerWaalsContact CA-O 3.23Å; N214-L370 WeakPolarHBondContact CA-O 3.37Å; N214-L370 VanDerWaalsContact CB-O 3.29Å; N214-L370 WeakPolarHBondContact CB-O 3.48Å; N214-H372 VanDerWaalsContact C-CE1 3.47Å; N214-L389 HydrophobicContact CB-CD1 4Å
215	L	94.7	Very high	77	Confident	24 Å²	24	60.9 Å²	60.9	13%	0.126	32%	0.322	C	S	.	.	H	α-helix	trans	-58.9	-33.2	-177.2	-68.8	171.5	0	0	0	113	E218 F219 L244 I248 V251 L370	L215-E218 PolarHBondContact O-N 2.92Å; L215-F219 WeakPolarHBondContact O-CB 3.34Å; L215-F219 PolarHBondContact O-N 3.27Å; L215-L244 HydrophobicContact CD2-CD2 4.22Å; L215-I248 HydrophobicContact CB-CG1 3.83Å; L215-V251 HydrophobicContact CD1-CG2 3.79Å; L215-L370 PolarHBondContact N-O 3.31Å
216	V	96.4	Very high	80	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-72.5	-39.4	-179.5	-175	0	0	0	0	111.1	N214 F219 G220 I248 F319 L370 C393 T396 L397	N214-V216 PolarHBondContact O-N 3.33Å; N214-V216 WeakPolarHBondContact OD1-CB 3.31Å; N214-V216 PolarHBondContact OD1-N 3.27Å; N214-V216 VanDerWaalsContact OD1-N 3.1Å; V216-F219 WeakPolarHBondContact O-CB 3.43Å; V216-F219 PolarHBondContact O-N 3.42Å; V216-G220 PolarHBondContact O-N 2.83Å; V216-I248 HydrophobicContact CB-CD1 4.48Å; V216-I248 HydrophobicContact CG2-CD1 4Å; V216-I248 HydrophobicContact CG2-CG1 4.2Å; V216-I248 HydrophobicContact CG2-CG2 4.39Å; V216-F319 HydrophobicContact CG2-CE2 4.02Å; V216-F319 HydrophobicContact CG2-CZ 4.16Å; V216-L370 HydrophobicContact CG2-CD2 4.18Å; V216-C393 HydrophobicContact CB-CB 4.17Å; V216-C393 HydrophobicContact CG1-CB 3.96Å; V216-C393 HydrophobicContact CG2-CB 4.14Å; V216-T396 HydrophobicContact CG1-CG2 4.34Å; V216-T396 WeakPolarHBondContact O-CG2 3.33Å; V216-L397 HydrophobicContact CG1-CD1 3.91Å; V216-L397 HydrophobicContact CG1-CD2 4.19Å; V216-L397 HydrophobicContact CG1-CG 3.72Å
217	E	94.6	Very high	82.7	Confident	64 Å²	64	53.3 Å²	53.3	30%	0.299	27%	0.266	S	S	.	.	H	α-helix	trans	-64.8	-41.7	172	-77.6	174.5	-174.3	0	0	112.2	N214 F219 G220 Q221	N214-E217 WeakPolarHBondContact ND2-CG 3.2Å; N214-E217 PolarHBondContact ND2-OE1 3.42Å; N214-E217 VanDerWaalsContact ND2-OE1 3.15Å; N214-E217 PolarHBondContact ND2-OE2 2.9Å; N214-E217 PolarHBondContact O-N 3.04Å; N214-E217 PolarHBondContact OD1-N 2.84Å; E217-F219 VanDerWaalsContact C-N 3.34Å; E217-G220 PolarHBondContact O-N 3.03Å; E217-Q221 WeakPolarHBondContact O-CB 3.48Å; E217-Q221 PolarHBondContact O-N 3.39Å
218	E	95.9	Very high	84.9	Confident	56 Å²	56	55.8 Å²	55.8	26%	0.262	27%	0.27	S	S	.	.	H	α-helix	trans	-62.9	-43.2	174.4	-169.2	-179.7	170.4	0	0	111	N214 L215 G220 Q221 R222 L244 H372	N214-E218 PolarHBondContact O-N 3.31Å; L215-E218 PolarHBondContact O-N 2.92Å; E218-G220 VanDerWaalsContact C-N 3.32Å; E218-G220 PolarHBondContact O-N 3.32Å; E218-Q221 PolarHBondContact O-N 3.44Å; E218-R222 HydrophobicContact CG-CG 4.48Å; E218-R222 WeakPolarHBondContact O-CG 3.28Å; E218-R222 PolarHBondContact O-N 2.96Å; E218-R222 IonicContact OE1-CZ 3.34Å; E218-R222 IonicContact OE1-NH1 3.37Å; E218-R222 PolarHBondContact OE1-NH1 2.9Å; E218-R222 IonicContact OE1-NH2 2.77Å; E218-R222 PolarHBondContact OE1-NH2 2.89Å; E218-L244 HydrophobicContact CB-CD1 4.21Å; E218-L244 HydrophobicContact CG-CD1 3.74Å; E218-L244 HydrophobicContact CG-CD2 4.39Å; E218-H372 IonicContact OE2-CE1 3.43Å; E218-H372 PolarHBondContact OE2-CE1 3.43Å; E218-H372 IonicContact OE2-NE2 3.12Å; E218-H372 PolarHBondContact OE2-NE2 3.02Å; E218-H372 VanDerWaalsContact OE2-NE2 3.12Å
219	F	97.6	Very high	86.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-55.4	-48.6	172.5	163.6	-105.3	0	0	0	111.1	L215 V216 E217 Q221 R222 M223 S241 L244 I245 I248 V312 L397 C400	L215-F219 WeakPolarHBondContact O-CB 3.34Å; L215-F219 PolarHBondContact O-N 3.27Å; V216-F219 WeakPolarHBondContact O-CB 3.43Å; V216-F219 PolarHBondContact O-N 3.42Å; E217-F219 VanDerWaalsContact C-N 3.34Å; F219-Q221 VanDerWaalsContact C-N 3.34Å; F219-Q221 PolarHBondContact O-N 2.88Å; F219-R222 PolarHBondContact O-N 3.29Å; F219-M223 HydrophobicContact CD2-CG 3.97Å; F219-M223 HydrophobicContact CE1-CG 4.11Å; F219-M223 HydrophobicContact CE2-CG 3.36Å; F219-M223 HydrophobicContact CE2-SD 3.99Å; F219-M223 HydrophobicContact CZ-CG 3.45Å; F219-M223 VanDerWaalsContact CZ-CG 3.45Å; F219-M223 HydrophobicContact CZ-SD 4.24Å; F219-M223 WeakPolarHBondContact O-CB 3.24Å; F219-M223 WeakPolarHBondContact O-CG 3.35Å; F219-M223 PolarHBondContact O-N 3.41Å; F219-S241 VanDerWaalsContact CD2-O 3.3Å; F219-S241 WeakPolarHBondContact CD2-O 3.42Å; F219-L244 HydrophobicContact CB-CB 4.07Å; F219-L244 HydrophobicContact CB-CD1 4.48Å; F219-L244 HydrophobicContact CD2-CB 4.48Å; F219-I245 HydrophobicContact CD2-CD1 4.44Å; F219-I245 HydrophobicContact CD2-CG1 3.76Å; F219-I245 HydrophobicContact CE2-CD1 3.61Å; F219-I245 HydrophobicContact CE2-CG1 3.41Å; F219-I245 VanDerWaalsContact CE2-CG1 3.41Å; F219-I245 HydrophobicContact CZ-CD1 4Å; F219-I245 HydrophobicContact CZ-CG1 4.02Å; F219-I248 HydrophobicContact CB-CD1 3.86Å; F219-I248 HydrophobicContact CG-CD1 4.25Å; F219-V312 HydrophobicContact CE1-CG1 4.33Å; F219-V312 HydrophobicContact CE1-CG2 4.49Å; F219-V312 HydrophobicContact CZ-CG1 4.42Å; F219-V312 HydrophobicContact CZ-CG2 3.83Å; F219-L397 HydrophobicContact CD1-CD2 4.07Å; F219-L397 HydrophobicContact CE1-CD2 3.79Å; F219-C400 HydrophobicContact CE1-CB 3.89Å; F219-C400 VanDerWaalsContact CE1-SG 3.54Å; F219-C400 HydrophobicContact CZ-CB 4.3Å
220	G	97.3	Very high	87.9	Confident	5 Å²	5	62 Å²	62	5%	0.052	30%	0.296	C	S	.	.	H	α-helix	trans	-60.8	-41.3	178.1	0	0	0	0	0	113.1	V216 E217 E218 M223 K224 W403	V216-G220 PolarHBondContact O-N 2.83Å; E217-G220 PolarHBondContact O-N 3.03Å; E218-G220 VanDerWaalsContact C-N 3.32Å; E218-G220 PolarHBondContact O-N 3.32Å; G220-M223 PolarHBondContact O-N 3.28Å; G220-K224 WeakPolarHBondContact O-CB 3.43Å; G220-K224 PolarHBondContact O-N 3.09Å; G220-W403 WeakPolarHBondContact O-CZ3 3.49Å
221	Q	96.1	Very high	89.2	Confident	89 Å²	89	60.5 Å²	60.5	42%	0.416	29%	0.288	S	S	.	.	H	α-helix	trans	-66.4	-43.9	177.3	-178.1	57.1	29	0	0	111.7	E217 E218 F219 K224 E225	E217-Q221 WeakPolarHBondContact O-CB 3.48Å; E217-Q221 PolarHBondContact O-N 3.39Å; E218-Q221 PolarHBondContact O-N 3.44Å; F219-Q221 VanDerWaalsContact C-N 3.34Å; F219-Q221 PolarHBondContact O-N 2.88Å; Q221-K224 WeakPolarHBondContact O-CB 3.31Å; Q221-K224 PolarHBondContact O-N 3.47Å; Q221-E225 PolarHBondContact NE2-OE1 2.91Å; Q221-E225 WeakPolarHBondContact O-CG 3.42Å; Q221-E225 PolarHBondContact O-N 3.49Å
222	R	96.6	Very high	90.2	Very high	74 Å²	74	54.9 Å²	54.9	28%	0.279	28%	0.281	S	S	.	.	H	α-helix	trans	-66.3	-38.3	175.9	-67.9	-69.8	167.3	65	20.9	112.2	E218 F219 E225 A226 S240 L244	E218-R222 HydrophobicContact CG-CG 4.48Å; E218-R222 WeakPolarHBondContact O-CG 3.28Å; E218-R222 PolarHBondContact O-N 2.96Å; E218-R222 IonicContact OE1-CZ 3.34Å; E218-R222 IonicContact OE1-NH1 3.37Å; E218-R222 PolarHBondContact OE1-NH1 2.9Å; E218-R222 IonicContact OE1-NH2 2.77Å; E218-R222 PolarHBondContact OE1-NH2 2.89Å; F219-R222 PolarHBondContact O-N 3.29Å; R222-E225 IonicContact NE-OE2 3.94Å; R222-E225 PolarHBondContact O-N 3.33Å; R222-A226 WeakPolarHBondContact O-CB 3.48Å; R222-A226 PolarHBondContact O-N 2.94Å; R222-S240 PolarHBondContact NH1-OG 3.42Å; R222-L244 HydrophobicContact CB-CD1 4.32Å; R222-L244 HydrophobicContact CG-CD1 3.84Å
223	M	97	Very high	91.2	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-62.2	-44.1	171.6	-79.7	-59.1	-67.2	0	0	111.6	F219 G220 E225 A226 M227 F238 S241 W403 L404	F219-M223 HydrophobicContact CD2-CG 3.97Å; F219-M223 HydrophobicContact CE1-CG 4.11Å; F219-M223 HydrophobicContact CE2-CG 3.36Å; F219-M223 HydrophobicContact CE2-SD 3.99Å; F219-M223 HydrophobicContact CZ-CG 3.45Å; F219-M223 VanDerWaalsContact CZ-CG 3.45Å; F219-M223 HydrophobicContact CZ-SD 4.24Å; F219-M223 WeakPolarHBondContact O-CB 3.24Å; F219-M223 WeakPolarHBondContact O-CG 3.35Å; F219-M223 PolarHBondContact O-N 3.41Å; G220-M223 PolarHBondContact O-N 3.28Å; M223-E225 PolarHBondContact O-N 3.23Å; M223-A226 WeakPolarHBondContact O-CB 3.36Å; M223-A226 PolarHBondContact O-N 2.98Å; M223-M227 HydrophobicContact CE-CE 3.94Å; M223-M227 WeakPolarHBondContact O-CB 3.31Å; M223-M227 WeakPolarHBondContact O-CG 3.45Å; M223-M227 PolarHBondContact O-N 3.27Å; M223-F238 HydrophobicContact CE-CE2 4.42Å; M223-F238 HydrophobicContact SD-CD2 4.11Å; M223-F238 HydrophobicContact SD-CE2 4.26Å; M223-S241 PolarHBondContact SD-OG 3.09Å; M223-W403 HydrophobicContact CB-CE3 4.04Å; M223-W403 HydrophobicContact CB-CZ3 4.04Å; M223-L404 HydrophobicContact CE-CD1 4.3Å; M223-L404 HydrophobicContact CE-CD2 3.84Å; M223-L404 HydrophobicContact CE-CG 3.99Å
224	K	95.5	Very high	91.8	Very high	92 Å²	92	54 Å²	54	40%	0.4	27%	0.273	S	S	.	.	H	α-helix	trans	-59.3	-47.2	176.3	-173.6	178.3	174.7	-176.5	0	111.6	G220 Q221 A226 M227 L228 W403	G220-K224 WeakPolarHBondContact O-CB 3.43Å; G220-K224 PolarHBondContact O-N 3.09Å; Q221-K224 WeakPolarHBondContact O-CB 3.31Å; Q221-K224 PolarHBondContact O-N 3.47Å; K224-A226 VanDerWaalsContact C-N 3.34Å; K224-A226 PolarHBondContact O-N 3.32Å; K224-M227 PolarHBondContact O-N 3.1Å; K224-L228 HydrophobicContact CD-CD1 4.4Å; K224-L228 HydrophobicContact CG-CD1 3.62Å; K224-L228 HydrophobicContact CG-CG 4.31Å; K224-L228 WeakPolarHBondContact O-CB 3.42Å; K224-L228 WeakPolarHBondContact O-CG 3.34Å; K224-L228 PolarHBondContact O-N 3.39Å; K224-W403 HydrophobicContact CB-CH2 3.48Å; K224-W403 VanDerWaalsContact CB-CH2 3.48Å; K224-W403 HydrophobicContact CB-CZ2 4.03Å; K224-W403 HydrophobicContact CB-CZ3 3.79Å; K224-W403 HydrophobicContact CD-CH2 4.2Å; K224-W403 HydrophobicContact CD-CZ2 4.31Å; K224-W403 HydrophobicContact CG-CH2 3.88Å; K224-W403 HydrophobicContact CG-CZ2 3.94Å
225	E	95.3	Very high	91.8	Very high	67 Å²	67	55.2 Å²	55.2	31%	0.313	28%	0.278	S	S	.	.	H	α-helix	trans	-59.2	-45.7	176.4	-74.5	166.8	-164.7	0	0	111.2	Q221 R222 M223 M227 T229 A237	Q221-E225 PolarHBondContact NE2-OE1 2.91Å; Q221-E225 WeakPolarHBondContact O-CG 3.42Å; Q221-E225 PolarHBondContact O-N 3.49Å; R222-E225 IonicContact NE-OE2 3.94Å; R222-E225 PolarHBondContact O-N 3.33Å; M223-E225 PolarHBondContact O-N 3.23Å; E225-M227 VanDerWaalsContact C-N 3.29Å; E225-M227 PolarHBondContact O-N 3.46Å; E225-T229 WeakPolarHBondContact O-CB 3.37Å; E225-T229 PolarHBondContact O-N 2.59Å; E225-T229 PolarHBondContact O-OG1 3.45Å; E225-A237 HydrophobicContact CB-CB 4.04Å
226	A	95.2	Very high	91.7	Very high	6 Å²	6	57.7 Å²	57.7	5%	0.05	30%	0.298	C	S	.	.	H	α-helix	trans	-60.4	-35.7	177.3	0	0	0	0	0	113.8	R222 M223 K224 A237 F238	R222-A226 WeakPolarHBondContact O-CB 3.48Å; R222-A226 PolarHBondContact O-N 2.94Å; M223-A226 WeakPolarHBondContact O-CB 3.36Å; M223-A226 PolarHBondContact O-N 2.98Å; K224-A226 VanDerWaalsContact C-N 3.34Å; K224-A226 PolarHBondContact O-N 3.32Å; A226-A237 HydrophobicContact CB-CB 4.06Å; A226-F238 HydrophobicContact CB-CB 3.77Å; A226-F238 HydrophobicContact CB-CD2 4.44Å
227	M	92.8	Very high	91.6	Very high	35 Å²	35	58.2 Å²	58.2	17%	0.172	30%	0.302	C	S	.	.	H	α-helix	trans	-89.3	-25.7	-174.9	-62.2	-64.3	126.4	0	0	113.4	M223 K224 E225 F238 L285 W403 I407	M223-M227 HydrophobicContact CE-CE 3.94Å; M223-M227 WeakPolarHBondContact O-CB 3.31Å; M223-M227 WeakPolarHBondContact O-CG 3.45Å; M223-M227 PolarHBondContact O-N 3.27Å; K224-M227 PolarHBondContact O-N 3.1Å; E225-M227 VanDerWaalsContact C-N 3.29Å; E225-M227 PolarHBondContact O-N 3.46Å; M227-F238 HydrophobicContact CE-CD2 3.9Å; M227-F238 HydrophobicContact CE-CE2 4.24Å; M227-L285 HydrophobicContact CE-CD2 3.94Å; M227-W403 HydrophobicContact CG-CB 3.97Å; M227-W403 HydrophobicContact CG-CG 4.42Å; M227-I407 HydrophobicContact SD-CD1 4.18Å
228	L	88.3	Confident	91.7	Very high	116 Å²	116	55.2 Å²	55.2	61%	0.607	29%	0.288	S	S	*	.	H	α-helix	trans	-107.9	-23.2	-174	-59.7	-177	0	0	0	114	K224	K224-L228 HydrophobicContact CD-CD1 4.4Å; K224-L228 HydrophobicContact CG-CD1 3.62Å; K224-L228 HydrophobicContact CG-CG 4.31Å; K224-L228 WeakPolarHBondContact O-CB 3.42Å; K224-L228 WeakPolarHBondContact O-CG 3.34Å; K224-L228 PolarHBondContact O-N 3.39Å
229	T	84.1	Confident	91.6	Very high	63 Å²	63	53.4 Å²	53.4	39%	0.387	28%	0.28	S	S	.	.			trans	-84.3	143.9	-179.5	-43.9	0	0	0	0	110.1	E225 A234	E225-T229 WeakPolarHBondContact O-CB 3.37Å; E225-T229 PolarHBondContact O-N 2.59Å; E225-T229 PolarHBondContact O-OG1 3.45Å; T229-A234 WeakPolarHBondContact O-CB 3.28Å
230	K	78.1	Confident	91.5	Very high	202 Å²	202	55 Å²	55	88%	0.878	29%	0.291	S	S	*	.			trans	-103.4	143.5	171.8	-65.3	-173	178.5	-174.2	0	109.9
231	G	81.8	Confident	91.5	Very high	18 Å²	18	54.7 Å²	54.7	19%	0.186	29%	0.288	C	S	.	.	S	Bend	trans	106.2	-172.4	175.8	0	0	0	0	0	113.9	D233 A234 S283	G231-D233 PolarHBondContact O-N 3.45Å; G231-D233 VanDerWaalsContact O-N 3.16Å; G231-A234 VanDerWaalsContact O-CB 3.29Å; G231-A234 WeakPolarHBondContact O-CB 3.21Å; G231-A234 PolarHBondContact O-N 3.43Å; G231-S283 WeakPolarHBondContact CA-OG 3.32Å
232	P	78	Confident	91.5	Very high	103 Å²	103	50.5 Å²	50.5	67%	0.669	27%	0.269	S	S	*	.	H	α-helix	trans	-63	-26.7	-167.5	25.9	-35	0	0	0	113.7	A234	P232-A234 PolarHBondContact O-N 3.04Å
233	D	88.6	Confident	91.5	Very high	116 Å²	116	49.7 Å²	49.7	62%	0.62	27%	0.272	S	S	*	.	H	α-helix	trans	-68	-24.4	179.1	-59.3	-27.8	0	0	0	112	G231 S236 A237	G231-D233 PolarHBondContact O-N 3.45Å; G231-D233 VanDerWaalsContact O-N 3.16Å; D233-S236 PolarHBondContact O-N 3.31Å; D233-A237 VanDerWaalsContact O-CB 3.31Å; D233-A237 WeakPolarHBondContact O-CB 3.32Å; D233-A237 PolarHBondContact O-N 2.54Å
234	A	92.9	Very high	91.5	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.008	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-46.4	-179.7	0	0	0	0	0	111.9	T229 G231 P232 A237 F238	T229-A234 WeakPolarHBondContact O-CB 3.28Å; G231-A234 VanDerWaalsContact O-CB 3.29Å; G231-A234 WeakPolarHBondContact O-CB 3.21Å; G231-A234 PolarHBondContact O-N 3.43Å; P232-A234 PolarHBondContact O-N 3.04Å; A234-A237 PolarHBondContact O-N 3.42Å; A234-F238 PolarHBondContact O-N 2.69Å
235	F	91.3	Very high	91.6	Very high	27 Å²	27	45.8 Å²	45.8	12%	0.118	26%	0.256	C	S	.	.	H	α-helix	trans	-66.3	-39.4	175.5	-175.2	-97.3	0	0	0	112	F238 M239 F271 K275 S283 M288	F235-F238 PolarHBondContact O-N 2.71Å; F235-M239 HydrophobicContact CD1-CG 3.99Å; F235-M239 HydrophobicContact CE1-CG 3.53Å; F235-M239 HydrophobicContact CE1-SD 4.22Å; F235-M239 HydrophobicContact CE2-CG 4.34Å; F235-M239 HydrophobicContact CE2-SD 4.34Å; F235-M239 HydrophobicContact CZ-CG 3.72Å; F235-M239 HydrophobicContact CZ-SD 3.81Å; F235-M239 WeakPolarHBondContact O-CG 3.28Å; F235-M239 PolarHBondContact O-N 3.27Å; F235-F271 HydrophobicContact CE2-CB 4.14Å; F235-F271 HydrophobicContact CZ-CB 4.29Å; F235-K275 HydrophobicContact CD1-CD 4.36Å; F235-K275 HydrophobicContact CD1-CG 3.96Å; F235-K275 HydrophobicContact CD2-CB 4.46Å; F235-K275 HydrophobicContact CD2-CD 4.36Å; F235-K275 HydrophobicContact CD2-CG 4.41Å; F235-K275 HydrophobicContact CE1-CB 3.89Å; F235-K275 HydrophobicContact CE1-CG 3.7Å; F235-K275 HydrophobicContact CE2-CB 3.81Å; F235-K275 HydrophobicContact CE2-CG 4.18Å; F235-K275 HydrophobicContact CG-CD 4.28Å; F235-K275 HydrophobicContact CG-CG 4.31Å; F235-K275 HydrophobicContact CZ-CB 3.49Å; F235-K275 VanDerWaalsContact CZ-CB 3.49Å; F235-K275 HydrophobicContact CZ-CG 3.83Å; F235-S283 VanDerWaalsContact CB-O 3.28Å; F235-S283 WeakPolarHBondContact CB-O 3.28Å; F235-S283 PolarHBondContact N-O 3.18Å; F235-M288 HydrophobicContact CD2-SD 3.8Å; F235-M288 HydrophobicContact CE2-CE 4.22Å; F235-M288 HydrophobicContact CE2-SD 3.59Å; F235-M288 VanDerWaalsContact CE2-SD 3.59Å
236	S	91.9	Very high	91.6	Very high	76 Å²	76	43.3 Å²	43.3	53%	0.531	24%	0.244	S	C	.	.	H	α-helix	trans	-63	-44.3	176.6	-171.4	0	0	0	0	111.7	D233 F238 M239 S240	D233-S236 PolarHBondContact O-N 3.31Å; S236-F238 VanDerWaalsContact C-N 3.31Å; S236-F238 PolarHBondContact O-N 3.47Å; S236-M239 PolarHBondContact O-N 3.47Å; S236-S240 WeakPolarHBondContact O-CB 3.3Å; S236-S240 PolarHBondContact O-N 3.33Å
237	A	95.5	Very high	91.6	Very high	11 Å²	11	45.9 Å²	45.9	9%	0.091	26%	0.257	C	S	.	.	H	α-helix	trans	-61.4	-39.9	175	0	0	0	0	0	111.6	E225 A226 D233 A234 S240 S241	E225-A237 HydrophobicContact CB-CB 4.04Å; A226-A237 HydrophobicContact CB-CB 4.06Å; D233-A237 VanDerWaalsContact O-CB 3.31Å; D233-A237 WeakPolarHBondContact O-CB 3.32Å; D233-A237 PolarHBondContact O-N 2.54Å; A234-A237 PolarHBondContact O-N 3.42Å; A237-S240 PolarHBondContact O-N 3.47Å; A237-S241 PolarHBondContact O-N 3.06Å
238	F	96.1	Very high	91.7	Very high	1 Å²	1	44.2 Å²	44.2	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-64.4	-46.1	175.6	-176.1	-120.7	0	0	0	112.2	M223 A226 M227 A234 F235 S236 S240 S241 L242 F271 L285	M223-F238 HydrophobicContact CE-CE2 4.42Å; M223-F238 HydrophobicContact SD-CD2 4.11Å; M223-F238 HydrophobicContact SD-CE2 4.26Å; A226-F238 HydrophobicContact CB-CB 3.77Å; A226-F238 HydrophobicContact CB-CD2 4.44Å; M227-F238 HydrophobicContact CE-CD2 3.9Å; M227-F238 HydrophobicContact CE-CE2 4.24Å; A234-F238 PolarHBondContact O-N 2.69Å; F235-F238 PolarHBondContact O-N 2.71Å; S236-F238 VanDerWaalsContact C-N 3.31Å; S236-F238 PolarHBondContact O-N 3.47Å; F238-S240 VanDerWaalsContact C-N 3.27Å; F238-S240 PolarHBondContact O-N 3.36Å; F238-S241 PolarHBondContact O-N 3.13Å; F238-S241 PolarHBondContact O-OG 3.3Å; F238-L242 HydrophobicContact CD1-CD1 4.44Å; F238-L242 HydrophobicContact CE1-CD1 3.9Å; F238-L242 HydrophobicContact CE2-CD2 4.29Å; F238-L242 HydrophobicContact CE2-CG 4.41Å; F238-L242 HydrophobicContact CZ-CD1 3.94Å; F238-L242 HydrophobicContact CZ-CD2 4.29Å; F238-L242 HydrophobicContact CZ-CG 4.3Å; F238-L242 WeakPolarHBondContact O-CG 3.47Å; F238-L242 PolarHBondContact O-N 3.08Å; F238-L242 VanDerWaalsContact O-N 3.12Å; F238-F271 HydrophobicContact CE1-CD1 4.36Å; F238-F271 AromaticContact CE1-CD2 3.57Å; F238-F271 HydrophobicContact CE1-CD2 3.57Å; F238-F271 HydrophobicContact CE1-CE1 4.37Å; F238-F271 AromaticContact CE1-CE2 3.58Å; F238-F271 HydrophobicContact CE1-CE2 3.58Å; F238-F271 AromaticContact CE1-CG 3.99Å; F238-F271 HydrophobicContact CE1-CG 3.99Å; F238-F271 AromaticContact CE1-CZ 4Å; F238-F271 HydrophobicContact CE1-CZ 4Å; F238-F271 HydrophobicContact CZ-CD2 4.22Å; F238-F271 AromaticContact CZ-CE2 3.76Å; F238-F271 HydrophobicContact CZ-CE2 3.76Å; F238-F271 HydrophobicContact CZ-CZ 4.08Å; F238-L285 HydrophobicContact CD1-CD1 4.38Å; F238-L285 HydrophobicContact CD1-CD2 4.44Å; F238-L285 HydrophobicContact CD2-CD2 4.24Å; F238-L285 HydrophobicContact CE1-CD1 3.85Å; F238-L285 HydrophobicContact CE1-CD2 3.96Å; F238-L285 HydrophobicContact CE1-CG 4.4Å; F238-L285 HydrophobicContact CE2-CD2 3.76Å; F238-L285 HydrophobicContact CZ-CD1 4.24Å; F238-L285 HydrophobicContact CZ-CD2 3.6Å
239	M	94.1	Very high	92.2	Very high	18 Å²	18	38.7 Å²	38.7	9%	0.089	22%	0.22	C	C	.	.	H	α-helix	trans	-65.5	-34.8	177.1	-67.5	-58.6	-56.9	0	0	111.9	F235 S236 L242 T243 M268 F271 R272	F235-M239 HydrophobicContact CD1-CG 3.99Å; F235-M239 HydrophobicContact CE1-CG 3.53Å; F235-M239 HydrophobicContact CE1-SD 4.22Å; F235-M239 HydrophobicContact CE2-CG 4.34Å; F235-M239 HydrophobicContact CE2-SD 4.34Å; F235-M239 HydrophobicContact CZ-CG 3.72Å; F235-M239 HydrophobicContact CZ-SD 3.81Å; F235-M239 WeakPolarHBondContact O-CG 3.28Å; F235-M239 PolarHBondContact O-N 3.27Å; S236-M239 PolarHBondContact O-N 3.47Å; M239-L242 PolarHBondContact O-N 3.33Å; M239-L242 HydrophobicContact SD-CD1 4.47Å; M239-T243 PolarHBondContact O-N 3.09Å; M239-T243 VanDerWaalsContact O-N 3.12Å; M239-T243 PolarHBondContact O-OG1 3.18Å; M239-M268 HydrophobicContact CE-CB 3.71Å; M239-M268 HydrophobicContact CE-CE 3.9Å; M239-M268 HydrophobicContact CE-CG 3.9Å; M239-F271 HydrophobicContact SD-CB 4.1Å; M239-R272 HydrophobicContact CE-CG 3.66Å; M239-R272 HydrophobicContact SD-CG 4.44Å
240	S	95.1	Very high	92.6	Very high	33 Å²	33	38.4 Å²	38.4	23%	0.231	22%	0.216	C	C	.	.	H	α-helix	trans	-65.7	-39.3	173.6	178.9	0	0	0	0	112.2	R222 S236 A237 F238 T243 L244	R222-S240 PolarHBondContact NH1-OG 3.42Å; S236-S240 WeakPolarHBondContact O-CB 3.3Å; S236-S240 PolarHBondContact O-N 3.33Å; A237-S240 PolarHBondContact O-N 3.47Å; F238-S240 VanDerWaalsContact C-N 3.27Å; F238-S240 PolarHBondContact O-N 3.36Å; S240-T243 WeakPolarHBondContact O-CB 3.39Å; S240-T243 PolarHBondContact O-N 3.37Å; S240-L244 PolarHBondContact O-N 3.08Å
241	S	97.1	Very high	93.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.4	-37.6	176.5	71.7	0	0	0	0	112	F219 M223 A237 F238 T243 L244 I245	F219-S241 VanDerWaalsContact CD2-O 3.3Å; F219-S241 WeakPolarHBondContact CD2-O 3.42Å; M223-S241 PolarHBondContact SD-OG 3.09Å; A237-S241 PolarHBondContact O-N 3.06Å; F238-S241 PolarHBondContact O-N 3.13Å; F238-S241 PolarHBondContact O-OG 3.3Å; S241-T243 VanDerWaalsContact C-N 3.29Å; S241-T243 PolarHBondContact O-N 2.94Å; S241-L244 WeakPolarHBondContact O-CB 3.48Å; S241-L244 PolarHBondContact O-N 3.42Å; S241-I245 PolarHBondContact O-N 3.35Å
242	L	96.8	Very high	94.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.1	-33.1	173.9	-61.4	-176	0	0	0	112.6	F238 M239 I245 I246 V264 M268 F271 V308	F238-L242 HydrophobicContact CD1-CD1 4.44Å; F238-L242 HydrophobicContact CE1-CD1 3.9Å; F238-L242 HydrophobicContact CE2-CD2 4.29Å; F238-L242 HydrophobicContact CE2-CG 4.41Å; F238-L242 HydrophobicContact CZ-CD1 3.94Å; F238-L242 HydrophobicContact CZ-CD2 4.29Å; F238-L242 HydrophobicContact CZ-CG 4.3Å; F238-L242 WeakPolarHBondContact O-CG 3.47Å; F238-L242 PolarHBondContact O-N 3.08Å; F238-L242 VanDerWaalsContact O-N 3.12Å; M239-L242 PolarHBondContact O-N 3.33Å; M239-L242 HydrophobicContact SD-CD1 4.47Å; L242-I245 HydrophobicContact CD2-CD1 3.89Å; L242-I245 WeakPolarHBondContact O-CB 3.36Å; L242-I245 PolarHBondContact O-N 3Å; L242-I246 PolarHBondContact O-N 2.89Å; L242-V264 HydrophobicContact CB-CG1 4.12Å; L242-V264 WeakPolarHBondContact O-CG1 3.48Å; L242-M268 HydrophobicContact CB-CE 4.2Å; L242-M268 HydrophobicContact CB-CG 3.62Å; L242-M268 HydrophobicContact CB-SD 3.83Å; L242-M268 HydrophobicContact CD1-CG 3.53Å; L242-M268 HydrophobicContact CG-CG 4.22Å; L242-F271 HydrophobicContact CD1-CD2 3.87Å; L242-F271 HydrophobicContact CD1-CE2 4Å; L242-V308 HydrophobicContact CD1-CG2 4.47Å; L242-V308 HydrophobicContact CD2-CB 4.46Å; L242-V308 HydrophobicContact CD2-CG1 3.65Å; L242-V308 HydrophobicContact CD2-CG2 3.87Å
243	T	95.8	Very high	94.9	Very high	58 Å²	58	24.5 Å²	24.5	36%	0.356	14%	0.142	S	C	.	.	H	α-helix	trans	-64.4	-43.9	172.5	-52.1	0	0	0	0	110.6	M239 S240 S241 I245 I246 D247 M268	M239-T243 PolarHBondContact O-N 3.09Å; M239-T243 VanDerWaalsContact O-N 3.12Å; M239-T243 PolarHBondContact O-OG1 3.18Å; S240-T243 WeakPolarHBondContact O-CB 3.39Å; S240-T243 PolarHBondContact O-N 3.37Å; S241-T243 VanDerWaalsContact C-N 3.29Å; S241-T243 PolarHBondContact O-N 2.94Å; T243-I245 VanDerWaalsContact C-N 3.28Å; T243-I245 PolarHBondContact O-N 3.45Å; T243-I246 WeakPolarHBondContact O-CA 3.49Å; T243-I246 WeakPolarHBondContact O-CB 3.37Å; T243-I246 PolarHBondContact O-N 3.48Å; T243-D247 PolarHBondContact O-N 3.38Å; T243-D247 VanDerWaalsContact O-N 3.09Å; T243-M268 WeakPolarHBondContact OG1-CE 3.3Å
244	L	96.5	Very high	94.7	Very high	10 Å²	10	24.6 Å²	24.6	5%	0.052	14%	0.142	C	C	.	.	H	α-helix	trans	-63.2	-30.9	175.9	-72.1	163.5	0	0	0	112.9	L215 E218 F219 R222 S240 S241 I246 D247 I248	L215-L244 HydrophobicContact CD2-CD2 4.22Å; E218-L244 HydrophobicContact CB-CD1 4.21Å; E218-L244 HydrophobicContact CG-CD1 3.74Å; E218-L244 HydrophobicContact CG-CD2 4.39Å; F219-L244 HydrophobicContact CB-CB 4.07Å; F219-L244 HydrophobicContact CB-CD1 4.48Å; F219-L244 HydrophobicContact CD2-CB 4.48Å; R222-L244 HydrophobicContact CB-CD1 4.32Å; R222-L244 HydrophobicContact CG-CD1 3.84Å; S240-L244 PolarHBondContact O-N 3.08Å; S241-L244 WeakPolarHBondContact O-CB 3.48Å; S241-L244 PolarHBondContact O-N 3.42Å; L244-I246 VanDerWaalsContact C-N 3.3Å; L244-I246 PolarHBondContact O-N 2.9Å; L244-D247 PolarHBondContact O-N 3.47Å; L244-I248 WeakPolarHBondContact O-CD1 3.36Å; L244-I248 VanDerWaalsContact O-CG1 3.22Å; L244-I248 WeakPolarHBondContact O-CG1 3.39Å; L244-I248 PolarHBondContact O-N 3.18Å
245	I	97.8	Very high	94.4	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-59.1	-44.4	170.4	-67.1	177.1	0	0	0	110.3	F219 S241 L242 T243 D247 I248 L249 V264 V311 V312 L315	F219-I245 HydrophobicContact CD2-CD1 4.44Å; F219-I245 HydrophobicContact CD2-CG1 3.76Å; F219-I245 HydrophobicContact CE2-CD1 3.61Å; F219-I245 HydrophobicContact CE2-CG1 3.41Å; F219-I245 VanDerWaalsContact CE2-CG1 3.41Å; F219-I245 HydrophobicContact CZ-CD1 4Å; F219-I245 HydrophobicContact CZ-CG1 4.02Å; S241-I245 PolarHBondContact O-N 3.35Å; L242-I245 HydrophobicContact CD2-CD1 3.89Å; L242-I245 WeakPolarHBondContact O-CB 3.36Å; L242-I245 PolarHBondContact O-N 3Å; T243-I245 VanDerWaalsContact C-N 3.28Å; T243-I245 PolarHBondContact O-N 3.45Å; I245-D247 VanDerWaalsContact C-N 3.31Å; I245-D247 PolarHBondContact O-N 2.88Å; I245-I248 PolarHBondContact O-N 3.32Å; I245-L249 HydrophobicContact CG2-CD1 3.88Å; I245-L249 HydrophobicContact CG2-CG 4.33Å; I245-L249 WeakPolarHBondContact O-CB 3.19Å; I245-L249 VanDerWaalsContact O-CG 3.23Å; I245-L249 WeakPolarHBondContact O-CG 3.31Å; I245-L249 PolarHBondContact O-N 3.48Å; I245-V264 HydrophobicContact CB-CG1 4.42Å; I245-V264 HydrophobicContact CG2-CG1 4.37Å; I245-V264 HydrophobicContact CG2-CG2 3.67Å; I245-V311 HydrophobicContact CG2-CG1 3.71Å; I245-V312 HydrophobicContact CD1-CG2 4.07Å; I245-L315 HydrophobicContact CG2-CD1 4.18Å
246	I	95.6	Very high	94.3	Very high	14 Å²	14	28.2 Å²	28.2	7%	0.072	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-40.4	177.8	-63.2	174.1	0	0	0	110.5	L242 T243 L244 L249 N250 K261 V264 M268	L242-I246 PolarHBondContact O-N 2.89Å; T243-I246 WeakPolarHBondContact O-CA 3.49Å; T243-I246 WeakPolarHBondContact O-CB 3.37Å; T243-I246 PolarHBondContact O-N 3.48Å; L244-I246 VanDerWaalsContact C-N 3.3Å; L244-I246 PolarHBondContact O-N 2.9Å; I246-L249 CarbonylContact O-C 3.5Å; I246-L249 PolarHBondContact O-N 2.9Å; I246-N250 VanDerWaalsContact O-CG 3.29Å; I246-N250 PolarHBondContact O-N 2.98Å; I246-N250 PolarHBondContact O-ND2 3.4Å; I246-K261 HydrophobicContact CG2-CG 4.45Å; I246-V264 HydrophobicContact CD1-CG1 4.2Å; I246-V264 HydrophobicContact CG1-CB 4.22Å; I246-V264 HydrophobicContact CG1-CG1 3.92Å; I246-M268 HydrophobicContact CD1-SD 3.95Å
247	D	94.7	Very high	94.4	Very high	61 Å²	61	24.6 Å²	24.6	33%	0.326	14%	0.135	S	C	.	.	H	α-helix	trans	-64.1	-43.6	176.8	-64.5	-32.2	0	0	0	112.3	T243 L244 I245 L249 N250 V251	T243-D247 PolarHBondContact O-N 3.38Å; T243-D247 VanDerWaalsContact O-N 3.09Å; L244-D247 PolarHBondContact O-N 3.47Å; I245-D247 VanDerWaalsContact C-N 3.31Å; I245-D247 PolarHBondContact O-N 2.88Å; D247-L249 VanDerWaalsContact C-N 3.33Å; D247-L249 PolarHBondContact O-N 3.5Å; D247-N250 WeakPolarHBondContact O-CB 3.31Å; D247-N250 PolarHBondContact O-N 2.84Å; D247-V251 PolarHBondContact O-N 3.44Å
248	I	96.9	Very high	94.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.9	-44.7	173.8	-66.3	159.3	0	0	0	110.1	L215 V216 F219 L244 I245 N250 V251 I252 L315 F319 L370	L215-I248 HydrophobicContact CB-CG1 3.83Å; V216-I248 HydrophobicContact CB-CD1 4.48Å; V216-I248 HydrophobicContact CG2-CD1 4Å; V216-I248 HydrophobicContact CG2-CG1 4.2Å; V216-I248 HydrophobicContact CG2-CG2 4.39Å; F219-I248 HydrophobicContact CB-CD1 3.86Å; F219-I248 HydrophobicContact CG-CD1 4.25Å; L244-I248 WeakPolarHBondContact O-CD1 3.36Å; L244-I248 VanDerWaalsContact O-CG1 3.22Å; L244-I248 WeakPolarHBondContact O-CG1 3.39Å; L244-I248 PolarHBondContact O-N 3.18Å; I245-I248 PolarHBondContact O-N 3.32Å; I248-N250 VanDerWaalsContact C-N 3.3Å; I248-N250 PolarHBondContact O-N 3.41Å; I248-V251 WeakPolarHBondContact O-CB 3.32Å; I248-V251 PolarHBondContact O-N 3.48Å; I248-V251 VanDerWaalsContact O-N 3.14Å; I248-I252 HydrophobicContact CG2-CD1 4.39Å; I248-I252 WeakPolarHBondContact O-CG1 3.09Å; I248-I252 PolarHBondContact O-N 2.84Å; I248-L315 HydrophobicContact CG2-CD1 4.22Å; I248-L315 HydrophobicContact CG2-CD2 3.88Å; I248-F319 HydrophobicContact CG2-CE2 4.11Å; I248-F319 HydrophobicContact CG2-CZ 4.36Å; I248-L370 HydrophobicContact CG2-CD2 4.41Å
249	L	96.9	Very high	93.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-35.8	176.6	-71	169.6	0	0	0	111.8	I245 I246 D247 V251 I252 D253 M257 I260 K261 V264 F314 L315	I245-L249 HydrophobicContact CG2-CD1 3.88Å; I245-L249 HydrophobicContact CG2-CG 4.33Å; I245-L249 WeakPolarHBondContact O-CB 3.19Å; I245-L249 VanDerWaalsContact O-CG 3.23Å; I245-L249 WeakPolarHBondContact O-CG 3.31Å; I245-L249 PolarHBondContact O-N 3.48Å; I246-L249 CarbonylContact O-C 3.5Å; I246-L249 PolarHBondContact O-N 2.9Å; D247-L249 VanDerWaalsContact C-N 3.33Å; D247-L249 PolarHBondContact O-N 3.5Å; L249-V251 VanDerWaalsContact C-N 3.33Å; L249-I252 HydrophobicContact CD2-CD1 4.43Å; L249-I252 PolarHBondContact O-N 3.4Å; L249-D253 CarbonylContact O-C 3.54Å; L249-D253 PolarHBondContact O-N 3.11Å; L249-M257 HydrophobicContact CB-CB 4.08Å; L249-M257 HydrophobicContact CB-CG 4.41Å; L249-M257 HydrophobicContact CD2-CB 4.18Å; L249-M257 HydrophobicContact CD2-CG 4.09Å; L249-M257 HydrophobicContact CD2-SD 3.98Å; L249-I260 HydrophobicContact CD1-CB 4.22Å; L249-I260 HydrophobicContact CD1-CG2 3.75Å; L249-I260 HydrophobicContact CD2-CB 4.38Å; L249-I260 HydrophobicContact CD2-CG2 4.02Å; L249-K261 HydrophobicContact CB-CD 4.46Å; L249-K261 HydrophobicContact CB-CG 3.9Å; L249-K261 HydrophobicContact CD1-CG 3.8Å; L249-V264 HydrophobicContact CD1-CG2 4.38Å; L249-F314 HydrophobicContact CD2-CD1 4.41Å; L249-F314 HydrophobicContact CD2-CE1 4.03Å; L249-L315 HydrophobicContact CD2-CD2 4Å
250	N	94.3	Very high	93.8	Very high	57 Å²	57	23.3 Å²	23.3	31%	0.305	13%	0.127	S	C	.	.	H	α-helix	trans	-64.1	-35.9	173.8	-75.5	-31.9	0	0	0	112.4	I246 D247 I248 D253 K261	I246-N250 VanDerWaalsContact O-CG 3.29Å; I246-N250 PolarHBondContact O-N 2.98Å; I246-N250 PolarHBondContact O-ND2 3.4Å; D247-N250 WeakPolarHBondContact O-CB 3.31Å; D247-N250 PolarHBondContact O-N 2.84Å; I248-N250 VanDerWaalsContact C-N 3.3Å; I248-N250 PolarHBondContact O-N 3.41Å; N250-D253 CarbonylContact O-C 3.57Å; N250-K261 WeakPolarHBondContact OD1-CE 3.46Å; N250-K261 PolarHBondContact OD1-NZ 3.17Å
251	V	94.5	Very high	93.7	Very high	16 Å²	16	21.8 Å²	21.8	10%	0.097	12%	0.117	C	C	.	.	H	α-helix	trans	-67.8	-40.7	174	173	0	0	0	0	111.3	L215 D247 I248 L249 N361 I366 N369 L370	L215-V251 HydrophobicContact CD1-CG2 3.79Å; D247-V251 PolarHBondContact O-N 3.44Å; I248-V251 WeakPolarHBondContact O-CB 3.32Å; I248-V251 PolarHBondContact O-N 3.48Å; I248-V251 VanDerWaalsContact O-N 3.14Å; L249-V251 VanDerWaalsContact C-N 3.33Å; V251-N361 PolarHBondContact O-ND2 2.99Å; V251-I366 HydrophobicContact CG1-CG2 4.4Å; V251-N369 HydrophobicContact CG1-CB 3.87Å; V251-N369 HydrophobicContact CG2-CB 4.25Å; V251-L370 HydrophobicContact CB-CD2 4.3Å; V251-L370 HydrophobicContact CG1-CD2 3.99Å; V251-L370 HydrophobicContact CG1-CG 3.92Å
252	I	95.9	Very high	93.3	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.5	-55.6	174.7	-65.4	172.4	0	0	0	109.6	I248 L249 M257 L315 F318 V360 N361	I248-I252 HydrophobicContact CG2-CD1 4.39Å; I248-I252 WeakPolarHBondContact O-CG1 3.09Å; I248-I252 PolarHBondContact O-N 2.84Å; L249-I252 HydrophobicContact CD2-CD1 4.43Å; L249-I252 PolarHBondContact O-N 3.4Å; I252-M257 HydrophobicContact CB-CG 4.14Å; I252-M257 HydrophobicContact CG2-CE 4.24Å; I252-M257 HydrophobicContact CG2-CG 3.89Å; I252-M257 HydrophobicContact CG2-SD 3.89Å; I252-L315 HydrophobicContact CD1-CD2 3.63Å; I252-F318 HydrophobicContact CD1-CD1 3.72Å; I252-F318 HydrophobicContact CD1-CE1 3.61Å; I252-F318 HydrophobicContact CD1-CG 4.46Å; I252-F318 HydrophobicContact CD1-CZ 4.29Å; I252-F318 HydrophobicContact CG1-CD1 4.3Å; I252-F318 HydrophobicContact CG1-CE1 3.66Å; I252-F318 HydrophobicContact CG1-CZ 4.15Å; I252-F318 HydrophobicContact CG2-CE1 4.25Å; I252-F318 HydrophobicContact CG2-CE2 4.38Å; I252-F318 HydrophobicContact CG2-CZ 3.87Å; I252-V360 HydrophobicContact CG2-CG1 3.9Å; I252-V360 HydrophobicContact CG2-CG2 4.39Å; I252-N361 WeakPolarHBondContact O-CB 3.4Å; I252-N361 PolarHBondContact O-N 3.27Å; I252-N361 PolarHBondContact O-ND2 3.41Å; I252-N361 VanDerWaalsContact O-ND2 3.14Å
253	D	94.2	Very high	92.9	Very high	15 Å²	15	22 Å²	22	8%	0.08	12%	0.118	C	C	.	.			trans	-164.7	151.7	168.6	-170	-116.4	0	0	0	113.7	L249 N250 M255 A256 M257 K261 V360	L249-D253 CarbonylContact O-C 3.54Å; L249-D253 PolarHBondContact O-N 3.11Å; N250-D253 CarbonylContact O-C 3.57Å; D253-M255 WeakPolarHBondContact OD1-CA 3.15Å; D253-M255 PolarHBondContact OD1-N 2.96Å; D253-A256 HydrophobicContact CB-CB 3.88Å; D253-A256 WeakPolarHBondContact OD1-CB 3.49Å; D253-A256 PolarHBondContact OD1-N 3.48Å; D253-M257 HydrophobicContact CB-CG 4.22Å; D253-K261 PolarHBondContact O-NZ 3.42Å; D253-V360 HydrophobicContact CB-CG2 4.33Å
254	L	86	Confident	92.7	Very high	117 Å²	117	19.4 Å²	19.4	61%	0.613	10%	0.102	S	C	*	.	S	Bend	trans	-73.7	-37.1	177.7	-168.1	62.9	0	0	0	112.9	N258 K261	L254-N258 PolarHBondContact O-OD1 3.06Å; L254-N258 VanDerWaalsContact O-OD1 3.06Å; L254-K261 PolarHBondContact O-NZ 3.25Å
255	M	86.4	Confident	92.3	Very high	103 Å²	103	18.9 Å²	18.9	51%	0.507	10%	0.099	S	C	.	.	S	Bend	trans	-113.3	-44.4	-169.9	-64.7	-174.4	67.5	0	0	114.6	Q128 D253 M257 N258	Q128-M255 PolarHBondContact NE2-O 3.47Å; Q128-M255 VanDerWaalsContact NE2-O 3.13Å; D253-M255 WeakPolarHBondContact OD1-CA 3.15Å; D253-M255 PolarHBondContact OD1-N 2.96Å; M255-M257 PolarHBondContact O-N 3.47Å; M255-N258 VanDerWaalsContact O-CB 3.24Å; M255-N258 WeakPolarHBondContact O-CB 3.5Å; M255-N258 PolarHBondContact O-N 3.44Å; M255-N258 PolarHBondContact O-ND2 3.49Å; M255-N258 VanDerWaalsContact O-ND2 3.13Å
256	A	88.4	Confident	91.6	Very high	2 Å²	2	19.8 Å²	19.8	2%	0.017	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-33	179.2	0	0	0	0	0	112.7	D253 S356 V360	D253-A256 HydrophobicContact CB-CB 3.88Å; D253-A256 WeakPolarHBondContact OD1-CB 3.49Å; D253-A256 PolarHBondContact OD1-N 3.48Å; A256-S356 WeakPolarHBondContact CB-O 3.4Å; A256-V360 HydrophobicContact CB-CG2 4.04Å
257	M	93.4	Very high	91.2	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-0.7	-179.7	-63.7	-58.1	105.6	0	0	113.8	L249 I252 D253 M255 V259 I260 K261 F314 A333 F353 V360	L249-M257 HydrophobicContact CB-CB 4.08Å; L249-M257 HydrophobicContact CB-CG 4.41Å; L249-M257 HydrophobicContact CD2-CB 4.18Å; L249-M257 HydrophobicContact CD2-CG 4.09Å; L249-M257 HydrophobicContact CD2-SD 3.98Å; I252-M257 HydrophobicContact CB-CG 4.14Å; I252-M257 HydrophobicContact CG2-CE 4.24Å; I252-M257 HydrophobicContact CG2-CG 3.89Å; I252-M257 HydrophobicContact CG2-SD 3.89Å; D253-M257 HydrophobicContact CB-CG 4.22Å; M255-M257 PolarHBondContact O-N 3.47Å; M257-V259 PolarHBondContact O-N 3.26Å; M257-V259 VanDerWaalsContact O-N 3.16Å; M257-I260 PolarHBondContact O-N 3.16Å; M257-I260 HydrophobicContact SD-CD1 4.05Å; M257-K261 HydrophobicContact CB-CD 4.49Å; M257-K261 HydrophobicContact CB-CG 4.44Å; M257-K261 WeakPolarHBondContact O-CG 3.43Å; M257-K261 PolarHBondContact O-N 2.7Å; M257-F314 HydrophobicContact CE-CZ 4.43Å; M257-F314 HydrophobicContact SD-CE1 3.95Å; M257-F314 HydrophobicContact SD-CZ 3.8Å; M257-A333 HydrophobicContact CE-CB 4.49Å; M257-F353 HydrophobicContact CE-CD2 4.49Å; M257-F353 HydrophobicContact CE-CE2 3.48Å; M257-F353 VanDerWaalsContact CE-CE2 3.48Å; M257-F353 HydrophobicContact CE-CZ 3.89Å; M257-F353 HydrophobicContact SD-CE2 4.17Å; M257-V360 HydrophobicContact CE-CG2 3.84Å
258	N	90.5	Very high	90.9	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.011	9%	0.085	C	C	.	.	H	α-helix	trans	-55.4	-37.1	-175	-77.6	-19.4	0	0	0	114	L124 V125 Q128 L254 M255 I260 K261 L262	L124-N258 WeakPolarHBondContact CB-ND2 3.38Å; V125-N258 HydrophobicContact CG2-CB 3.94Å; Q128-N258 PolarHBondContact OE1-ND2 3.2Å; L254-N258 PolarHBondContact O-OD1 3.06Å; L254-N258 VanDerWaalsContact O-OD1 3.06Å; M255-N258 VanDerWaalsContact O-CB 3.24Å; M255-N258 WeakPolarHBondContact O-CB 3.5Å; M255-N258 PolarHBondContact O-N 3.44Å; M255-N258 PolarHBondContact O-ND2 3.49Å; M255-N258 VanDerWaalsContact O-ND2 3.13Å; N258-I260 VanDerWaalsContact C-N 3.31Å; N258-I260 PolarHBondContact O-N 3.39Å; N258-K261 PolarHBondContact O-N 2.93Å; N258-L262 VanDerWaalsContact O-CB 3.3Å; N258-L262 WeakPolarHBondContact O-CB 3.41Å; N258-L262 PolarHBondContact O-N 3.3Å
259	V	90.5	Very high	90.2	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-63.6	-38.3	177.2	169.3	0	0	0	0	111.6	V125 M257 E263 Q345 L349 V352	V125-V259 HydrophobicContact CG2-CG2 4.34Å; M257-V259 PolarHBondContact O-N 3.26Å; M257-V259 VanDerWaalsContact O-N 3.16Å; V259-E263 PolarHBondContact O-N 3.35Å; V259-Q345 VanDerWaalsContact CG1-NE2 3.31Å; V259-L349 HydrophobicContact CG1-CB 3.83Å; V259-L349 HydrophobicContact CG1-CD1 4.42Å; V259-L349 HydrophobicContact CG1-CG 4.49Å; V259-L349 HydrophobicContact CG2-CD2 4.29Å; V259-V352 HydrophobicContact CG2-CB 3.92Å; V259-V352 HydrophobicContact CG2-CG1 3.53Å
260	I	93.4	Very high	89.3	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-77.7	-38.7	177.2	-54.4	-178.1	0	0	0	110.2	L249 M257 N258 L262 E263 V264 V311 F314 Y337 F353	L249-I260 HydrophobicContact CD1-CB 4.22Å; L249-I260 HydrophobicContact CD1-CG2 3.75Å; L249-I260 HydrophobicContact CD2-CB 4.38Å; L249-I260 HydrophobicContact CD2-CG2 4.02Å; M257-I260 PolarHBondContact O-N 3.16Å; M257-I260 HydrophobicContact SD-CD1 4.05Å; N258-I260 VanDerWaalsContact C-N 3.31Å; N258-I260 PolarHBondContact O-N 3.39Å; I260-L262 PolarHBondContact O-N 2.95Å; I260-E263 VanDerWaalsContact O-CB 3.31Å; I260-E263 WeakPolarHBondContact O-CB 3.45Å; I260-E263 PolarHBondContact O-N 3.35Å; I260-E263 VanDerWaalsContact O-N 3.1Å; I260-V264 WeakPolarHBondContact O-CG2 3.35Å; I260-V264 PolarHBondContact O-N 3.28Å; I260-V264 VanDerWaalsContact O-N 3.09Å; I260-V311 HydrophobicContact CG2-CB 4.43Å; I260-V311 HydrophobicContact CG2-CG1 3.69Å; I260-V311 HydrophobicContact CG2-CG2 3.98Å; I260-F314 HydrophobicContact CD1-CD1 3.78Å; I260-F314 HydrophobicContact CD1-CD2 3.84Å; I260-F314 HydrophobicContact CD1-CE1 3.55Å; I260-F314 HydrophobicContact CD1-CE2 3.6Å; I260-F314 HydrophobicContact CD1-CG 3.93Å; I260-F314 HydrophobicContact CD1-CZ 3.46Å; I260-F314 VanDerWaalsContact CD1-CZ 3.46Å; I260-Y337 HydrophobicContact CD1-CD2 4.33Å; I260-F353 HydrophobicContact CD1-CD2 4.24Å; I260-F353 HydrophobicContact CD1-CE2 3.62Å; I260-F353 HydrophobicContact CD1-CZ 4.39Å; I260-F353 HydrophobicContact CG1-CD2 4.31Å; I260-F353 HydrophobicContact CG1-CE2 4.18Å
261	K	92.5	Very high	88.8	Confident	1 Å²	1	16.8 Å²	16.8	0%	0.004	9%	0.086	C	C	.	.	H	α-helix	trans	-62.8	-41.7	175.2	-64.9	172.3	-170.3	167.9	0	112	H121 I246 L249 N250 D253 L254 M257 N258 E263 V264 A265	H121-K261 WeakPolarHBondContact CD2-CB 3.44Å; I246-K261 HydrophobicContact CG2-CG 4.45Å; L249-K261 HydrophobicContact CB-CD 4.46Å; L249-K261 HydrophobicContact CB-CG 3.9Å; L249-K261 HydrophobicContact CD1-CG 3.8Å; N250-K261 WeakPolarHBondContact OD1-CE 3.46Å; N250-K261 PolarHBondContact OD1-NZ 3.17Å; D253-K261 PolarHBondContact O-NZ 3.42Å; L254-K261 PolarHBondContact O-NZ 3.25Å; M257-K261 HydrophobicContact CB-CD 4.49Å; M257-K261 HydrophobicContact CB-CG 4.44Å; M257-K261 WeakPolarHBondContact O-CG 3.43Å; M257-K261 PolarHBondContact O-N 2.7Å; N258-K261 PolarHBondContact O-N 2.93Å; K261-E263 PolarHBondContact O-N 3.47Å; K261-V264 PolarHBondContact O-N 3.47Å; K261-A265 WeakPolarHBondContact O-CB 3.35Å; K261-A265 PolarHBondContact O-N 3.06Å
262	L	88.6	Confident	88.2	Confident	2 Å²	2	19.6 Å²	19.6	1%	0.01	10%	0.095	C	C	.	.	H	α-helix	trans	-57.1	-38.4	173.1	176.8	62.3	0	0	0	110.8	Y17 H121 R122 V125 N258 I260 A265 D266	Y17-L262 HydrophobicContact CD2-CD1 4.42Å; Y17-L262 HydrophobicContact CG-CD2 4.34Å; H121-L262 HydrophobicContact CB-CB 4.19Å; H121-L262 HydrophobicContact CB-CD1 4.34Å; R122-L262 HydrophobicContact CB-CD1 4.09Å; V125-L262 HydrophobicContact CB-CD2 4.15Å; V125-L262 HydrophobicContact CG1-CD2 4.18Å; V125-L262 HydrophobicContact CG2-CB 4.21Å; V125-L262 HydrophobicContact CG2-CD2 3.94Å; N258-L262 VanDerWaalsContact O-CB 3.3Å; N258-L262 WeakPolarHBondContact O-CB 3.41Å; N258-L262 PolarHBondContact O-N 3.3Å; I260-L262 PolarHBondContact O-N 2.95Å; L262-A265 PolarHBondContact O-N 3.27Å; L262-D266 WeakPolarHBondContact O-CB 3.37Å; L262-D266 PolarHBondContact O-N 3.46Å
263	E	87.6	Confident	87.2	Confident	3 Å²	3	21.7 Å²	21.7	1%	0.014	11%	0.108	C	C	.	.	H	α-helix	trans	-66.4	-44.9	178.7	-176.2	56	-169	0	0	113.1	L18 V259 I260 K261 A265 D266 C267 R307 V311	L18-E263 HydrophobicContact CD1-CG 3.97Å; L18-E263 VanDerWaalsContact CD1-OE1 3.25Å; L18-E263 WeakPolarHBondContact CD1-OE1 3.36Å; L18-E263 WeakPolarHBondContact CD1-OE2 3.45Å; L18-E263 HydrophobicContact CD2-CB 4.48Å; L18-E263 WeakPolarHBondContact CD2-OE2 3.44Å; L18-E263 WeakPolarHBondContact CG-OE2 2.98Å; V259-E263 PolarHBondContact O-N 3.35Å; I260-E263 VanDerWaalsContact O-CB 3.31Å; I260-E263 WeakPolarHBondContact O-CB 3.45Å; I260-E263 PolarHBondContact O-N 3.35Å; I260-E263 VanDerWaalsContact O-N 3.1Å; K261-E263 PolarHBondContact O-N 3.47Å; E263-A265 VanDerWaalsContact C-N 3.33Å; E263-D266 PolarHBondContact O-N 2.88Å; E263-C267 PolarHBondContact O-N 3.24Å; E263-C267 PolarHBondContact O-SG 3.09Å; E263-R307 WeakPolarHBondContact OE1-CB 3.14Å; E263-R307 WeakPolarHBondContact OE1-CD 3.44Å; E263-R307 VanDerWaalsContact OE1-CG 3.23Å; E263-R307 WeakPolarHBondContact OE1-CG 3.25Å; E263-R307 IonicContact OE1-CZ 3.65Å; E263-R307 IonicContact OE1-NE 3.68Å; E263-R307 PolarHBondContact OE1-NE 2.99Å; E263-R307 IonicContact OE1-NH1 3.23Å; E263-R307 PolarHBondContact OE1-NH1 3.05Å; E263-R307 IonicContact OE2-NH1 2.78Å; E263-R307 PolarHBondContact OE2-NH1 3.03Å; E263-V311 HydrophobicContact CG-CG2 4.2Å
264	V	92.4	Very high	86.2	Confident	2 Å²	2	22.4 Å²	22.4	1%	0.012	12%	0.116	C	C	.	.	H	α-helix	trans	-62.2	-45.4	175.2	-179.9	0	0	0	0	110.2	L242 I245 I246 L249 I260 K261 D266 C267 M268 V311	L242-V264 HydrophobicContact CB-CG1 4.12Å; L242-V264 WeakPolarHBondContact O-CG1 3.48Å; I245-V264 HydrophobicContact CB-CG1 4.42Å; I245-V264 HydrophobicContact CG2-CG1 4.37Å; I245-V264 HydrophobicContact CG2-CG2 3.67Å; I246-V264 HydrophobicContact CD1-CG1 4.2Å; I246-V264 HydrophobicContact CG1-CB 4.22Å; I246-V264 HydrophobicContact CG1-CG1 3.92Å; L249-V264 HydrophobicContact CD1-CG2 4.38Å; I260-V264 WeakPolarHBondContact O-CG2 3.35Å; I260-V264 PolarHBondContact O-N 3.28Å; I260-V264 VanDerWaalsContact O-N 3.09Å; K261-V264 PolarHBondContact O-N 3.47Å; V264-D266 PolarHBondContact O-N 3.22Å; V264-C267 PolarHBondContact O-N 2.83Å; V264-M268 HydrophobicContact CG1-CG 4.4Å; V264-M268 HydrophobicContact CG1-SD 4.03Å; V264-M268 VanDerWaalsContact O-CG 3.25Å; V264-M268 WeakPolarHBondContact O-CG 3.5Å; V264-M268 PolarHBondContact O-N 3.21Å; V264-V311 HydrophobicContact CG2-CB 4.34Å; V264-V311 HydrophobicContact CG2-CG1 3.77Å; V264-V311 HydrophobicContact CG2-CG2 4.08Å
265	A	88.7	Confident	85.8	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62.7	-42.4	179.9	0	0	0	0	0	112.1	V118 K261 L262 E263 M268 Q269	V118-A265 HydrophobicContact CB-CB 4.36Å; V118-A265 HydrophobicContact CG2-CB 3.82Å; V118-A265 VanDerWaalsContact CG2-O 3.24Å; V118-A265 WeakPolarHBondContact CG2-O 3.34Å; K261-A265 WeakPolarHBondContact O-CB 3.35Å; K261-A265 PolarHBondContact O-N 3.06Å; L262-A265 PolarHBondContact O-N 3.27Å; E263-A265 VanDerWaalsContact C-N 3.33Å; A265-M268 WeakPolarHBondContact O-CB 3.36Å; A265-M268 PolarHBondContact O-N 2.91Å; A265-Q269 PolarHBondContact O-N 3Å
266	D	83.1	Confident	85.3	Confident	19 Å²	19	21.5 Å²	21.5	10%	0.102	10%	0.104	C	C	.	.	H	α-helix	trans	-60	-47	174.7	-177.1	70.5	0	0	0	111.5	L262 E263 V264 M268 Q269 I270 R307	L262-D266 WeakPolarHBondContact O-CB 3.37Å; L262-D266 PolarHBondContact O-N 3.46Å; E263-D266 PolarHBondContact O-N 2.88Å; V264-D266 PolarHBondContact O-N 3.22Å; D266-M268 PolarHBondContact O-N 3.44Å; D266-Q269 WeakPolarHBondContact O-CB 3.47Å; D266-Q269 PolarHBondContact O-N 2.93Å; D266-I270 PolarHBondContact O-N 2.99Å; D266-R307 IonicContact OD2-CZ 2.92Å; D266-R307 IonicContact OD2-NH1 2.96Å; D266-R307 PolarHBondContact OD2-NH1 3.43Å; D266-R307 IonicContact OD2-NH2 2.63Å; D266-R307 PolarHBondContact OD2-NH2 3.12Å; D266-R307 VanDerWaalsContact OD2-NH2 3.09Å
267	C	86.8	Confident	84.6	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59	-46.1	174.8	-67.4	0	0	0	0	111.6	E263 V264 Q269 I270 F271 V308	E263-C267 PolarHBondContact O-N 3.24Å; E263-C267 PolarHBondContact O-SG 3.09Å; V264-C267 PolarHBondContact O-N 2.83Å; C267-Q269 VanDerWaalsContact C-N 3.29Å; C267-Q269 PolarHBondContact O-N 2.78Å; C267-I270 PolarHBondContact O-N 2.92Å; C267-I270 VanDerWaalsContact O-N 3.16Å; C267-F271 HydrophobicContact CB-CD2 4.41Å; C267-F271 HydrophobicContact CB-CE2 3.91Å; C267-F271 WeakPolarHBondContact O-CD2 3.19Å; C267-F271 WeakPolarHBondContact O-CG 3.39Å; C267-F271 PolarHBondContact O-N 3.42Å; C267-V308 HydrophobicContact CB-CG2 3.85Å
268	M	88.5	Confident	83.7	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-56.8	-41.6	175.9	-72.3	172.1	83.8	0	0	112	M239 L242 T243 I246 V264 A265 D266 F271 R272	M239-M268 HydrophobicContact CE-CB 3.71Å; M239-M268 HydrophobicContact CE-CE 3.9Å; M239-M268 HydrophobicContact CE-CG 3.9Å; L242-M268 HydrophobicContact CB-CE 4.2Å; L242-M268 HydrophobicContact CB-CG 3.62Å; L242-M268 HydrophobicContact CB-SD 3.83Å; L242-M268 HydrophobicContact CD1-CG 3.53Å; L242-M268 HydrophobicContact CG-CG 4.22Å; T243-M268 WeakPolarHBondContact OG1-CE 3.3Å; I246-M268 HydrophobicContact CD1-SD 3.95Å; V264-M268 HydrophobicContact CG1-CG 4.4Å; V264-M268 HydrophobicContact CG1-SD 4.03Å; V264-M268 VanDerWaalsContact O-CG 3.25Å; V264-M268 WeakPolarHBondContact O-CG 3.5Å; V264-M268 PolarHBondContact O-N 3.21Å; A265-M268 WeakPolarHBondContact O-CB 3.36Å; A265-M268 PolarHBondContact O-N 2.91Å; D266-M268 PolarHBondContact O-N 3.44Å; M268-F271 PolarHBondContact O-N 3.29Å; M268-R272 WeakPolarHBondContact O-CB 2.87Å; M268-R272 VanDerWaalsContact O-CG 3.25Å; M268-R272 WeakPolarHBondContact O-CG 2.94Å; M268-R272 PolarHBondContact O-N 3.49Å
269	Q	81.1	Confident	83	Confident	36 Å²	36	29 Å²	29	17%	0.168	15%	0.15	C	C	.	.	H	α-helix	trans	-65.4	-41	177.1	-177.4	62.2	34.3	0	0	112.4	V118 A265 D266 C267 R272 T273	V118-Q269 HydrophobicContact CG2-CB 3.97Å; A265-Q269 PolarHBondContact O-N 3Å; D266-Q269 WeakPolarHBondContact O-CB 3.47Å; D266-Q269 PolarHBondContact O-N 2.93Å; C267-Q269 VanDerWaalsContact C-N 3.29Å; C267-Q269 PolarHBondContact O-N 2.78Å; Q269-R272 PolarHBondContact O-N 2.86Å; Q269-T273 PolarHBondContact NE2-OG1 2.88Å; Q269-T273 WeakPolarHBondContact O-CB 3.44Å; Q269-T273 PolarHBondContact O-N 3.44Å; Q269-T273 PolarHBondContact O-OG1 3.46Å
270	I	78.2	Confident	82.5	Confident	34 Å²	34	38.4 Å²	38.4	17%	0.174	19%	0.191	C	C	.	.	H	α-helix	trans	-61.9	-48	175.9	-73.2	162.2	0	0	0	110.4	D266 C267 R272 T273 A274 V300 I301 S304	D266-I270 PolarHBondContact O-N 2.99Å; C267-I270 PolarHBondContact O-N 2.92Å; C267-I270 VanDerWaalsContact O-N 3.16Å; I270-R272 PolarHBondContact O-N 3.13Å; I270-T273 PolarHBondContact O-N 3.43Å; I270-A274 VanDerWaalsContact O-CB 3.31Å; I270-A274 WeakPolarHBondContact O-CB 3.23Å; I270-A274 PolarHBondContact O-N 3.35Å; I270-V300 HydrophobicContact CG2-CG1 3.69Å; I270-I301 HydrophobicContact CG2-CD1 3.98Å; I270-S304 WeakPolarHBondContact CD1-OG 3.45Å
271	F	84.1	Confident	82	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-41.5	178.3	-62.9	-51.1	0	0	0	112.4	F235 F238 M239 L242 C267 M268 A274 K275 L285 M288 I301 V305 V308	F235-F271 HydrophobicContact CE2-CB 4.14Å; F235-F271 HydrophobicContact CZ-CB 4.29Å; F238-F271 HydrophobicContact CE1-CD1 4.36Å; F238-F271 AromaticContact CE1-CD2 3.57Å; F238-F271 HydrophobicContact CE1-CD2 3.57Å; F238-F271 HydrophobicContact CE1-CE1 4.37Å; F238-F271 AromaticContact CE1-CE2 3.58Å; F238-F271 HydrophobicContact CE1-CE2 3.58Å; F238-F271 AromaticContact CE1-CG 3.99Å; F238-F271 HydrophobicContact CE1-CG 3.99Å; F238-F271 AromaticContact CE1-CZ 4Å; F238-F271 HydrophobicContact CE1-CZ 4Å; F238-F271 HydrophobicContact CZ-CD2 4.22Å; F238-F271 AromaticContact CZ-CE2 3.76Å; F238-F271 HydrophobicContact CZ-CE2 3.76Å; F238-F271 HydrophobicContact CZ-CZ 4.08Å; M239-F271 HydrophobicContact SD-CB 4.1Å; L242-F271 HydrophobicContact CD1-CD2 3.87Å; L242-F271 HydrophobicContact CD1-CE2 4Å; C267-F271 HydrophobicContact CB-CD2 4.41Å; C267-F271 HydrophobicContact CB-CE2 3.91Å; C267-F271 WeakPolarHBondContact O-CD2 3.19Å; C267-F271 WeakPolarHBondContact O-CG 3.39Å; C267-F271 PolarHBondContact O-N 3.42Å; M268-F271 PolarHBondContact O-N 3.29Å; F271-A274 PolarHBondContact O-N 3.13Å; F271-K275 VanDerWaalsContact O-CB 3.27Å; F271-K275 WeakPolarHBondContact O-CB 3.29Å; F271-K275 PolarHBondContact O-N 3.07Å; F271-L285 HydrophobicContact CD1-CD1 4.03Å; F271-L285 HydrophobicContact CE1-CD1 3.73Å; F271-L285 HydrophobicContact CZ-CD1 4.32Å; F271-M288 HydrophobicContact CB-CE 4.36Å; F271-M288 HydrophobicContact CD1-CE 4.19Å; F271-M288 WeakPolarHBondContact O-CE 3.49Å; F271-I301 HydrophobicContact CD1-CG2 4.33Å; F271-I301 HydrophobicContact CE1-CG2 3.98Å; F271-V305 HydrophobicContact CE1-CG2 3.86Å; F271-V305 HydrophobicContact CZ-CG2 3.81Å; F271-V308 HydrophobicContact CE2-CG2 3.92Å; F271-V308 HydrophobicContact CZ-CG2 4.38Å
272	R	82.4	Confident	81.6	Confident	74 Å²	74	45.8 Å²	45.8	28%	0.279	23%	0.226	S	C	.	.	H	α-helix	trans	-61.6	-44.6	174.9	-73.9	174.5	-175	129.7	-10.3	112	C115 D117 M239 M268 Q269 I270 K275 K276	C115-R272 PolarHBondContact SG-NH1 2.95Å; D117-R272 IonicContact OD2-NH2 3.69Å; M239-R272 HydrophobicContact CE-CG 3.66Å; M239-R272 HydrophobicContact SD-CG 4.44Å; M268-R272 WeakPolarHBondContact O-CB 2.87Å; M268-R272 VanDerWaalsContact O-CG 3.25Å; M268-R272 WeakPolarHBondContact O-CG 2.94Å; M268-R272 PolarHBondContact O-N 3.49Å; Q269-R272 PolarHBondContact O-N 2.86Å; I270-R272 PolarHBondContact O-N 3.13Å; R272-K275 PolarHBondContact O-N 2.89Å; R272-K276 WeakPolarHBondContact O-CB 2.87Å; R272-K276 PolarHBondContact O-N 3.38Å
273	T	74.1	Confident	81.5	Confident	45 Å²	45	46.8 Å²	46.8	28%	0.276	23%	0.234	S	C	.	.	H	α-helix	trans	-63.6	-48.2	179.5	-56.2	0	0	0	0	110.2	Q269 I270 K275 K276 H277	Q269-T273 PolarHBondContact NE2-OG1 2.88Å; Q269-T273 WeakPolarHBondContact O-CB 3.44Å; Q269-T273 PolarHBondContact O-N 3.44Å; Q269-T273 PolarHBondContact O-OG1 3.46Å; I270-T273 PolarHBondContact O-N 3.43Å; T273-K275 VanDerWaalsContact C-N 3.35Å; T273-K275 PolarHBondContact O-N 3.39Å; T273-K276 WeakPolarHBondContact O-CB 3.48Å; T273-K276 PolarHBondContact O-N 3.41Å; T273-H277 PolarHBondContact O-CD2 2.75Å; T273-H277 PolarHBondContact O-N 3.35Å; T273-H277 VanDerWaalsContact O-N 3.15Å
274	A	73.2	Confident	81.6	Confident	29 Å²	29	47.4 Å²	47.4	24%	0.24	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-42.3	176.6	0	0	0	0	0	112.1	I270 F271 K276 H277 S278 M288 I301	I270-A274 VanDerWaalsContact O-CB 3.31Å; I270-A274 WeakPolarHBondContact O-CB 3.23Å; I270-A274 PolarHBondContact O-N 3.35Å; F271-A274 PolarHBondContact O-N 3.13Å; A274-K276 PolarHBondContact O-N 3.11Å; A274-H277 PolarHBondContact O-N 2.78Å; A274-S278 VanDerWaalsContact O-CB 3.25Å; A274-S278 WeakPolarHBondContact O-CB 3.25Å; A274-S278 PolarHBondContact O-N 3.42Å; A274-S278 PolarHBondContact O-OG 3.16Å; A274-M288 HydrophobicContact CB-CE 3.4Å; A274-I301 HydrophobicContact CB-CD1 3.38Å; A274-I301 HydrophobicContact CB-CG1 4.42Å
275	K	77.7	Confident	81.5	Confident	55 Å²	55	47.5 Å²	47.5	24%	0.239	24%	0.238	C	C	.	.	H	α-helix	trans	-63.3	-40.5	175.6	179.7	63.2	-172.2	123.6	0	112.5	F235 F271 R272 T273 H277 S278 V282 M288	F235-K275 HydrophobicContact CD1-CD 4.36Å; F235-K275 HydrophobicContact CD1-CG 3.96Å; F235-K275 HydrophobicContact CD2-CB 4.46Å; F235-K275 HydrophobicContact CD2-CD 4.36Å; F235-K275 HydrophobicContact CD2-CG 4.41Å; F235-K275 HydrophobicContact CE1-CB 3.89Å; F235-K275 HydrophobicContact CE1-CG 3.7Å; F235-K275 HydrophobicContact CE2-CB 3.81Å; F235-K275 HydrophobicContact CE2-CG 4.18Å; F235-K275 HydrophobicContact CG-CD 4.28Å; F235-K275 HydrophobicContact CG-CG 4.31Å; F235-K275 HydrophobicContact CZ-CB 3.49Å; F235-K275 VanDerWaalsContact CZ-CB 3.49Å; F235-K275 HydrophobicContact CZ-CG 3.83Å; F271-K275 VanDerWaalsContact O-CB 3.27Å; F271-K275 WeakPolarHBondContact O-CB 3.29Å; F271-K275 PolarHBondContact O-N 3.07Å; R272-K275 PolarHBondContact O-N 2.89Å; T273-K275 VanDerWaalsContact C-N 3.35Å; T273-K275 PolarHBondContact O-N 3.39Å; K275-H277 VanDerWaalsContact C-N 3.26Å; K275-H277 PolarHBondContact O-N 3.39Å; K275-S278 WeakPolarHBondContact CA-OG 3.27Å; K275-S278 PolarHBondContact O-N 2.95Å; K275-S278 PolarHBondContact O-OG 3.03Å; K275-V282 VanDerWaalsContact CE-O 3.24Å; K275-V282 WeakPolarHBondContact CE-O 3.41Å; K275-V282 PolarHBondContact NZ-O 2.87Å; K275-M288 HydrophobicContact CB-CE 4.5Å
276	K	77	Confident	81.5	Confident	146 Å²	146	49.9 Å²	49.9	64%	0.635	25%	0.251	S	S	*	.	H	α-helix	trans	-60.3	-36.1	177.3	-178.1	-178.3	177	-175.7	0	112.3	R272 T273 A274	R272-K276 WeakPolarHBondContact O-CB 2.87Å; R272-K276 PolarHBondContact O-N 3.38Å; T273-K276 WeakPolarHBondContact O-CB 3.48Å; T273-K276 PolarHBondContact O-N 3.41Å; A274-K276 PolarHBondContact O-N 3.11Å
277	H	72.5	Confident	81.8	Confident	83 Å²	83	51.6 Å²	51.6	38%	0.384	26%	0.26	S	S	.	.	H	α-helix	trans	-99.8	-9.2	-175.7	-62.3	-59.4	0	0	0	114	G73 T273 A274 K275	G73-H277 WeakPolarHBondContact CA-CE1 3.32Å; G73-H277 WeakPolarHBondContact CA-NE2 3.48Å; G73-H277 PolarHBondContact O-CD2 3.16Å; G73-H277 PolarHBondContact O-CE1 3.25Å; G73-H277 PolarHBondContact O-ND1 2.91Å; G73-H277 PolarHBondContact O-NE2 3.4Å; G73-H277 VanDerWaalsContact O-NE2 3.08Å; T273-H277 PolarHBondContact O-CD2 2.75Å; T273-H277 PolarHBondContact O-N 3.35Å; T273-H277 VanDerWaalsContact O-N 3.15Å; A274-H277 PolarHBondContact O-N 2.78Å; K275-H277 VanDerWaalsContact C-N 3.26Å; K275-H277 PolarHBondContact O-N 3.39Å
278	S	75.3	Confident	81.8	Confident	32 Å²	32	51.9 Å²	51.9	22%	0.224	26%	0.262	C	S	.	.	S	Bend	trans	-71.2	156.6	171.6	69.7	0	0	0	0	112.7	A274 K275	A274-S278 VanDerWaalsContact O-CB 3.25Å; A274-S278 WeakPolarHBondContact O-CB 3.25Å; A274-S278 PolarHBondContact O-N 3.42Å; A274-S278 PolarHBondContact O-OG 3.16Å; K275-S278 WeakPolarHBondContact CA-OG 3.27Å; K275-S278 PolarHBondContact O-N 2.95Å; K275-S278 PolarHBondContact O-OG 3.03Å
279	A	76.2	Confident	81.7	Confident	46 Å²	46	52 Å²	52	38%	0.38	26%	0.263	S	S	.	.			trans	-63.1	158.1	171.9	0	0	0	0	0	111.6	E281 V282	A279-E281 HydrophobicContact CB-CG 4.31Å; A279-E281 WeakPolarHBondContact CB-OE1 3.35Å; A279-E281 WeakPolarHBondContact CB-OE2 3.21Å; A279-E281 PolarHBondContact O-N 3.34Å; A279-E281 VanDerWaalsContact O-N 3.16Å; A279-V282 WeakPolarHBondContact O-CB 2.82Å; A279-V282 PolarHBondContact O-N 3.17Å
280	K	79.2	Confident	81.9	Confident	199 Å²	199	53 Å²	53	87%	0.865	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-30.2	-172.3	-73.8	-175.7	178.6	179.5	0	112.9	V282	K280-V282 VanDerWaalsContact C-N 3.31Å; K280-V282 PolarHBondContact O-N 2.93Å
281	E	81.8	Confident	82	Confident	144 Å²	144	53 Å²	53	67%	0.673	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-22.1	178.3	63.3	-88	-159.1	0	0	114.1	A279 S283	A279-E281 HydrophobicContact CB-CG 4.31Å; A279-E281 WeakPolarHBondContact CB-OE1 3.35Å; A279-E281 WeakPolarHBondContact CB-OE2 3.21Å; A279-E281 PolarHBondContact O-N 3.34Å; A279-E281 VanDerWaalsContact O-N 3.16Å; E281-S283 PolarHBondContact O-N 3.44Å
282	V	84	Confident	81.7	Confident	13 Å²	13	54 Å²	54	8%	0.079	28%	0.28	C	S	.	.			trans	-72.1	100	178.3	175.9	0	0	0	0	108	K275 A279 K280 D287 M288	K275-V282 VanDerWaalsContact CE-O 3.24Å; K275-V282 WeakPolarHBondContact CE-O 3.41Å; K275-V282 PolarHBondContact NZ-O 2.87Å; A279-V282 WeakPolarHBondContact O-CB 2.82Å; A279-V282 PolarHBondContact O-N 3.17Å; K280-V282 VanDerWaalsContact C-N 3.31Å; K280-V282 PolarHBondContact O-N 2.93Å; V282-D287 HydrophobicContact CB-CB 4.22Å; V282-D287 HydrophobicContact CG1-CB 3.79Å; V282-D287 HydrophobicContact CG2-CB 4.48Å; V282-M288 HydrophobicContact CG1-CB 4.3Å; V282-M288 HydrophobicContact CG1-CG 3.44Å; V282-M288 VanDerWaalsContact CG1-CG 3.44Å
283	S	86.8	Confident	81.3	Confident	23 Å²	23	53.2 Å²	53.2	16%	0.161	28%	0.282	C	S	.	.			trans	-117.7	-15.5	-167	69.1	0	0	0	0	113.9	G231 F235 E281 D287	G231-S283 WeakPolarHBondContact CA-OG 3.32Å; F235-S283 VanDerWaalsContact CB-O 3.28Å; F235-S283 WeakPolarHBondContact CB-O 3.28Å; F235-S283 PolarHBondContact N-O 3.18Å; E281-S283 PolarHBondContact O-N 3.44Å; S283-D287 PolarHBondContact N-OD2 3.09Å; S283-D287 PolarHBondContact OG-OD2 2.77Å; S283-D287 VanDerWaalsContact OG-OD2 3.1Å
284	S	90.6	Very high	81.2	Confident	16 Å²	16	59 Å²	59	11%	0.112	30%	0.303	C	S	.	.	S	Bend	trans	-128.3	166.4	-177.3	67.3	0	0	0	0	111.7	D286 D287 M288	S284-D286 PolarHBondContact O-N 3.18Å; S284-D287 PolarHBondContact N-OD2 3.06Å; S284-D287 PolarHBondContact O-N 2.84Å; S284-D287 PolarHBondContact OG-N 3.24Å; S284-D287 VanDerWaalsContact OG-N 3.13Å; S284-D287 PolarHBondContact OG-OD2 3.44Å; S284-M288 WeakPolarHBondContact O-CG 3.36Å; S284-M288 PolarHBondContact O-N 2.8Å
285	L	90	Very high	80.9	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.016	32%	0.32	C	S	.	.	H	α-helix	trans	-61.7	-33.2	172.6	-175.2	62.7	0	0	0	112	M227 F238 F271 M288 L289 I301 V305 I407	M227-L285 HydrophobicContact CE-CD2 3.94Å; F238-L285 HydrophobicContact CD1-CD1 4.38Å; F238-L285 HydrophobicContact CD1-CD2 4.44Å; F238-L285 HydrophobicContact CD2-CD2 4.24Å; F238-L285 HydrophobicContact CE1-CD1 3.85Å; F238-L285 HydrophobicContact CE1-CD2 3.96Å; F238-L285 HydrophobicContact CE1-CG 4.4Å; F238-L285 HydrophobicContact CE2-CD2 3.76Å; F238-L285 HydrophobicContact CZ-CD1 4.24Å; F238-L285 HydrophobicContact CZ-CD2 3.6Å; F271-L285 HydrophobicContact CD1-CD1 4.03Å; F271-L285 HydrophobicContact CE1-CD1 3.73Å; F271-L285 HydrophobicContact CZ-CD1 4.32Å; L285-M288 PolarHBondContact O-N 3.38Å; L285-L289 HydrophobicContact CG-CD1 4.42Å; L285-L289 WeakPolarHBondContact O-CG 3.39Å; L285-L289 PolarHBondContact O-N 3.1Å; L285-L289 VanDerWaalsContact O-N 3.08Å; L285-I301 HydrophobicContact CD1-CG2 4.38Å; L285-V305 HydrophobicContact CD1-CG2 3.77Å; L285-V305 HydrophobicContact CD2-CG1 4.48Å; L285-V305 HydrophobicContact CD2-CG2 3.89Å; L285-V305 HydrophobicContact CG-CG2 4.11Å; L285-I407 HydrophobicContact CB-CD1 4.13Å; L285-I407 HydrophobicContact CD2-CD1 4.07Å; L285-I407 HydrophobicContact CG-CD1 4.01Å
286	D	89.8	Confident	80	Confident	51 Å²	51	65.3 Å²	65.3	27%	0.273	34%	0.34	S	S	.	.	H	α-helix	trans	-66.2	-44.7	177.4	-160.5	87	0	0	0	110.2	S284 M288 L289 V290 I407 R410 N411	S284-D286 PolarHBondContact O-N 3.18Å; D286-M288 VanDerWaalsContact C-N 3.27Å; D286-M288 PolarHBondContact O-N 3.34Å; D286-L289 PolarHBondContact O-N 2.95Å; D286-V290 WeakPolarHBondContact O-CG2 3.41Å; D286-V290 PolarHBondContact O-N 2.97Å; D286-I407 HydrophobicContact CB-CD1 3.97Å; D286-R410 IonicContact OD1-CZ 3.56Å; D286-R410 IonicContact OD1-NE 2.98Å; D286-R410 PolarHBondContact OD1-NE 3.22Å; D286-R410 IonicContact OD1-NH2 3.51Å; D286-R410 PolarHBondContact OD1-NH2 3.25Å; D286-N411 PolarHBondContact OD1-ND2 2.91Å
287	D	89.3	Confident	78.8	Confident	54 Å²	54	60.4 Å²	60.4	29%	0.289	32%	0.323	S	S	.	.	H	α-helix	trans	-59.2	-38.7	174.9	-59.2	-42.8	0	0	0	112	V282 S283 S284 V290 A291	V282-D287 HydrophobicContact CB-CB 4.22Å; V282-D287 HydrophobicContact CG1-CB 3.79Å; V282-D287 HydrophobicContact CG2-CB 4.48Å; S283-D287 PolarHBondContact N-OD2 3.09Å; S283-D287 PolarHBondContact OG-OD2 2.77Å; S283-D287 VanDerWaalsContact OG-OD2 3.1Å; S284-D287 PolarHBondContact N-OD2 3.06Å; S284-D287 PolarHBondContact O-N 2.84Å; S284-D287 PolarHBondContact OG-N 3.24Å; S284-D287 VanDerWaalsContact OG-N 3.13Å; S284-D287 PolarHBondContact OG-OD2 3.44Å; D287-V290 PolarHBondContact O-N 3.07Å; D287-A291 VanDerWaalsContact O-CB 3.28Å; D287-A291 WeakPolarHBondContact O-CB 3.31Å; D287-A291 PolarHBondContact O-N 3.18Å
288	M	86.4	Confident	78.4	Confident	6 Å²	6	58 Å²	58	3%	0.03	32%	0.317	C	S	.	.	H	α-helix	trans	-66.6	-41.8	178.6	-66.7	173.7	72	0	0	111.8	F235 F271 A274 K275 V282 S284 L285 D286 A291 E292 I301	F235-M288 HydrophobicContact CD2-SD 3.8Å; F235-M288 HydrophobicContact CE2-CE 4.22Å; F235-M288 HydrophobicContact CE2-SD 3.59Å; F235-M288 VanDerWaalsContact CE2-SD 3.59Å; F271-M288 HydrophobicContact CB-CE 4.36Å; F271-M288 HydrophobicContact CD1-CE 4.19Å; F271-M288 WeakPolarHBondContact O-CE 3.49Å; A274-M288 HydrophobicContact CB-CE 3.4Å; K275-M288 HydrophobicContact CB-CE 4.5Å; V282-M288 HydrophobicContact CG1-CB 4.3Å; V282-M288 HydrophobicContact CG1-CG 3.44Å; V282-M288 VanDerWaalsContact CG1-CG 3.44Å; S284-M288 WeakPolarHBondContact O-CG 3.36Å; S284-M288 PolarHBondContact O-N 2.8Å; L285-M288 PolarHBondContact O-N 3.38Å; D286-M288 VanDerWaalsContact C-N 3.27Å; D286-M288 PolarHBondContact O-N 3.34Å; M288-A291 PolarHBondContact O-N 3.14Å; M288-E292 PolarHBondContact O-N 3.07Å; M288-I301 HydrophobicContact CB-CG2 4.16Å; M288-I301 HydrophobicContact CE-CD1 4.2Å
289	L	85.5	Confident	78.1	Confident	4 Å²	4	58 Å²	58	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-66.9	-42.9	175.7	-72.5	165.6	0	0	0	111.4	L285 D286 A291 E292 L293 I301 K302 V305 I407 N411	L285-L289 HydrophobicContact CG-CD1 4.42Å; L285-L289 WeakPolarHBondContact O-CG 3.39Å; L285-L289 PolarHBondContact O-N 3.1Å; L285-L289 VanDerWaalsContact O-N 3.08Å; D286-L289 PolarHBondContact O-N 2.95Å; L289-A291 VanDerWaalsContact C-N 3.3Å; L289-A291 PolarHBondContact O-N 3.18Å; L289-E292 WeakPolarHBondContact O-CB 3.41Å; L289-E292 PolarHBondContact O-N 3.32Å; L289-L293 WeakPolarHBondContact O-CG 3.46Å; L289-L293 PolarHBondContact O-N 3.19Å; L289-I301 HydrophobicContact CD2-CB 4.2Å; L289-I301 HydrophobicContact CD2-CG2 3.72Å; L289-I301 HydrophobicContact CG-CG2 4.02Å; L289-K302 HydrophobicContact CD2-CB 4.04Å; L289-V305 HydrophobicContact CD1-CG2 4.4Å; L289-V305 HydrophobicContact CD2-CG2 4.34Å; L289-I407 HydrophobicContact CD1-CD1 3.91Å; L289-I407 HydrophobicContact CD1-CG1 3.68Å; L289-N411 HydrophobicContact CB-CB 3.89Å; L289-N411 HydrophobicContact CD1-CB 4.23Å
290	V	86.1	Confident	78	Confident	57 Å²	57	58 Å²	58	35%	0.345	31%	0.309	S	S	.	.	H	α-helix	trans	-62.9	-37.9	175.1	171.8	0	0	0	0	111.5	D286 D287 N411	D286-V290 WeakPolarHBondContact O-CG2 3.41Å; D286-V290 PolarHBondContact O-N 2.97Å; D287-V290 PolarHBondContact O-N 3.07Å; V290-N411 WeakPolarHBondContact CG2-OD1 3.34Å
291	A	80.1	Confident	78.1	Confident	33 Å²	33	49 Å²	49	27%	0.273	27%	0.271	S	S	.	.	H	α-helix	trans	-65.6	-41.4	174.3	0	0	0	0	0	111.6	D287 M288 L289 L293 K294	D287-A291 VanDerWaalsContact O-CB 3.28Å; D287-A291 WeakPolarHBondContact O-CB 3.31Å; D287-A291 PolarHBondContact O-N 3.18Å; M288-A291 PolarHBondContact O-N 3.14Å; L289-A291 VanDerWaalsContact C-N 3.3Å; L289-A291 PolarHBondContact O-N 3.18Å; A291-L293 VanDerWaalsContact C-N 3.35Å; A291-L293 PolarHBondContact O-N 3.35Å; A291-K294 WeakPolarHBondContact O-CB 3.35Å; A291-K294 PolarHBondContact O-N 3.27Å; A291-K294 VanDerWaalsContact O-N 3.15Å
292	E	78.4	Confident	78.1	Confident	20 Å²	20	45.7 Å²	45.7	9%	0.093	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-39.4	176.4	178.1	164.9	82.4	0	0	112.4	M288 L289 K294 I295 A298 N299 V300 I301 K302	M288-E292 PolarHBondContact O-N 3.07Å; L289-E292 WeakPolarHBondContact O-CB 3.41Å; L289-E292 PolarHBondContact O-N 3.32Å; E292-K294 PolarHBondContact O-N 2.87Å; E292-K294 VanDerWaalsContact O-N 3.12Å; E292-I295 CarbonylContact O-C 3.57Å; E292-I295 PolarHBondContact O-N 2.76Å; E292-A298 HydrophobicContact CG-CB 3.86Å; E292-A298 WeakPolarHBondContact CG-O 3.31Å; E292-N299 WeakPolarHBondContact OE1-CA 3.28Å; E292-V300 WeakPolarHBondContact OE2-CA 3.24Å; E292-V300 PolarHBondContact OE2-N 3.06Å; E292-I301 HydrophobicContact CB-CG1 4.43Å; E292-I301 WeakPolarHBondContact OE1-CB 3.43Å; E292-I301 PolarHBondContact OE1-N 3.15Å; E292-I301 WeakPolarHBondContact OE2-CG1 3.38Å; E292-I301 PolarHBondContact OE2-N 3.14Å; E292-K302 WeakPolarHBondContact OE1-CB 3.29Å; E292-K302 PolarHBondContact OE1-N 3.32Å
293	L	73.3	Confident	78	Confident	59 Å²	59	48.4 Å²	48.4	31%	0.309	27%	0.269	S	S	.	.	H	α-helix	trans	-58.8	-25.1	175.6	-71.4	174.6	0	0	0	113.7	L289 A291 I295 N411	L289-L293 WeakPolarHBondContact O-CG 3.46Å; L289-L293 PolarHBondContact O-N 3.19Å; A291-L293 VanDerWaalsContact C-N 3.35Å; A291-L293 PolarHBondContact O-N 3.35Å; L293-I295 VanDerWaalsContact C-N 3.27Å; L293-N411 HydrophobicContact CD1-CB 4.41Å
294	K	72.7	Confident	77.9	Confident	166 Å²	166	47.4 Å²	47.4	72%	0.722	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-8.2	177.4	-62.1	174.1	-174.6	174.3	0	113.2	A291 E292 P296	A291-K294 WeakPolarHBondContact O-CB 3.35Å; A291-K294 PolarHBondContact O-N 3.27Å; A291-K294 VanDerWaalsContact O-N 3.15Å; E292-K294 PolarHBondContact O-N 2.87Å; E292-K294 VanDerWaalsContact O-N 3.12Å; K294-P296 WeakPolarHBondContact O-CD 3.43Å
295	I	67	Low	77.9	Confident	116 Å²	116	46.6 Å²	46.6	60%	0.595	26%	0.256	S	S	*	.	S	Bend	trans	-118	61.3	178.6	-45.1	172.4	0	0	0	108.6	E292 L293 A298	E292-I295 CarbonylContact O-C 3.57Å; E292-I295 PolarHBondContact O-N 2.76Å; L293-I295 VanDerWaalsContact C-N 3.27Å; I295-A298 HydrophobicContact CB-CB 4.34Å; I295-A298 HydrophobicContact CG2-CB 4.46Å; I295-A298 WeakPolarHBondContact O-CB 3.46Å; I295-A298 PolarHBondContact O-N 2.68Å
296	P	58.8	Low	77.9	Confident	101 Å²	101	49.7 Å²	49.7	66%	0.656	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	136	173.9	-14.5	27.1	0	0	0	108.5	K294	K294-P296 WeakPolarHBondContact O-CD 3.43Å
297	P	51.7	Low	78	Confident	43 Å²	43	48.2 Å²	48.2	28%	0.279	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	cis	-104.9	29.3	10.4	40.8	-42	0	0	0	115.2	C46 K47 G48 N299	C46-P297 WeakPolarHBondContact O-CB 3.25Å; C46-P297 WeakPolarHBondContact O-CG 3.39Å; K47-P297 WeakPolarHBondContact O-CG 3.27Å; G48-P297 VanDerWaalsContact CA-CG 3.44Å; P297-N299 PolarHBondContact O-N 2.84Å
298	A	63	Low	78.2	Confident	32 Å²	32	45.7 Å²	45.7	26%	0.264	25%	0.247	S	C	.	.			trans	-58.4	130.7	-177.6	0	0	0	0	0	111.7	E292 I295	E292-A298 HydrophobicContact CG-CB 3.86Å; E292-A298 WeakPolarHBondContact CG-O 3.31Å; I295-A298 HydrophobicContact CB-CB 4.34Å; I295-A298 HydrophobicContact CG2-CB 4.46Å; I295-A298 WeakPolarHBondContact O-CB 3.46Å; I295-A298 PolarHBondContact O-N 2.68Å
299	N	70.1	Confident	78.7	Confident	31 Å²	31	48.2 Å²	48.2	17%	0.166	26%	0.256	C	S	.	.			trans	-137.3	18.4	179	72	-35.7	0	0	0	112.3	E292 P297 D303	E292-N299 WeakPolarHBondContact OE1-CA 3.28Å; P297-N299 PolarHBondContact O-N 2.84Å; N299-D303 PolarHBondContact ND2-OD1 2.74Å; N299-D303 PolarHBondContact ND2-OD2 2.93Å; N299-D303 WeakPolarHBondContact O-CB 3.39Å; N299-D303 PolarHBondContact O-N 3.32Å
300	V	74.3	Confident	79.2	Confident	46 Å²	46	48.3 Å²	48.3	28%	0.279	26%	0.258	S	S	.	.	H	α-helix	trans	-69.4	-42.6	-172.4	177.9	0	0	0	0	111.3	I270 E292 S304	I270-V300 HydrophobicContact CG2-CG1 3.69Å; E292-V300 WeakPolarHBondContact OE2-CA 3.24Å; E292-V300 PolarHBondContact OE2-N 3.06Å; V300-S304 VanDerWaalsContact O-CB 3.27Å; V300-S304 WeakPolarHBondContact O-CB 3.37Å; V300-S304 PolarHBondContact O-N 2.79Å; V300-S304 PolarHBondContact O-OG 2.91Å
301	I	79.8	Confident	79.7	Confident	12 Å²	12	45.7 Å²	45.7	6%	0.062	24%	0.242	C	C	.	.	H	α-helix	trans	-69.6	-49.1	176.7	-53.3	-52.4	0	0	0	109.2	I270 F271 A274 L285 M288 L289 E292 D303 S304 V305	I270-I301 HydrophobicContact CG2-CD1 3.98Å; F271-I301 HydrophobicContact CD1-CG2 4.33Å; F271-I301 HydrophobicContact CE1-CG2 3.98Å; A274-I301 HydrophobicContact CB-CD1 3.38Å; A274-I301 HydrophobicContact CB-CG1 4.42Å; L285-I301 HydrophobicContact CD1-CG2 4.38Å; M288-I301 HydrophobicContact CB-CG2 4.16Å; M288-I301 HydrophobicContact CE-CD1 4.2Å; L289-I301 HydrophobicContact CD2-CB 4.2Å; L289-I301 HydrophobicContact CD2-CG2 3.72Å; L289-I301 HydrophobicContact CG-CG2 4.02Å; E292-I301 HydrophobicContact CB-CG1 4.43Å; E292-I301 WeakPolarHBondContact OE1-CB 3.43Å; E292-I301 PolarHBondContact OE1-N 3.15Å; E292-I301 WeakPolarHBondContact OE2-CG1 3.38Å; E292-I301 PolarHBondContact OE2-N 3.14Å; I301-D303 PolarHBondContact O-N 2.71Å; I301-S304 CarbonylContact O-C 3.5Å; I301-S304 PolarHBondContact O-N 2.93Å; I301-S304 VanDerWaalsContact O-N 3.09Å; I301-V305 HydrophobicContact CG2-CG2 4.49Å; I301-V305 WeakPolarHBondContact O-CG2 3.27Å; I301-V305 PolarHBondContact O-N 3.26Å
302	K	82.9	Confident	80.5	Confident	74 Å²	74	44.1 Å²	44.1	32%	0.322	23%	0.229	S	C	.	.	H	α-helix	trans	-55.8	-49.7	177.2	-175.6	177.5	179.6	177	0	112.2	L289 E292 S304 V305 Q306 L408	L289-K302 HydrophobicContact CD2-CB 4.04Å; E292-K302 WeakPolarHBondContact OE1-CB 3.29Å; E292-K302 PolarHBondContact OE1-N 3.32Å; K302-S304 VanDerWaalsContact C-N 3.28Å; K302-S304 PolarHBondContact O-N 3.1Å; K302-V305 PolarHBondContact O-N 3.49Å; K302-Q306 PolarHBondContact O-N 3.26Å; K302-L408 HydrophobicContact CG-CD2 4.23Å
303	D	81.5	Confident	81.5	Confident	70 Å²	70	44.1 Å²	44.1	37%	0.374	23%	0.23	S	C	.	.	H	α-helix	trans	-63.1	-36.5	177.4	-71.4	0.3	0	0	0	110.9	N299 I301 Q306 R307	N299-D303 PolarHBondContact ND2-OD1 2.74Å; N299-D303 PolarHBondContact ND2-OD2 2.93Å; N299-D303 WeakPolarHBondContact O-CB 3.39Å; N299-D303 PolarHBondContact O-N 3.32Å; I301-D303 PolarHBondContact O-N 2.71Å; D303-Q306 WeakPolarHBondContact O-CB 3.23Å; D303-Q306 PolarHBondContact O-N 2.98Å; D303-R307 VanDerWaalsContact O-CG 3.25Å; D303-R307 WeakPolarHBondContact O-CG 3.5Å; D303-R307 PolarHBondContact O-N 3.04Å
304	S	84.8	Confident	82.7	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.007	22%	0.216	C	C	.	.	H	α-helix	trans	-69.7	-35.9	176.3	-59.2	0	0	0	0	112.8	I270 V300 I301 K302 R307 V308	I270-S304 WeakPolarHBondContact CD1-OG 3.45Å; V300-S304 VanDerWaalsContact O-CB 3.27Å; V300-S304 WeakPolarHBondContact O-CB 3.37Å; V300-S304 PolarHBondContact O-N 2.79Å; V300-S304 PolarHBondContact O-OG 2.91Å; I301-S304 CarbonylContact O-C 3.5Å; I301-S304 PolarHBondContact O-N 2.93Å; I301-S304 VanDerWaalsContact O-N 3.09Å; K302-S304 VanDerWaalsContact C-N 3.28Å; K302-S304 PolarHBondContact O-N 3.1Å; S304-R307 PolarHBondContact O-N 2.86Å; S304-R307 PolarHBondContact OG-NH2 2.96Å; S304-V308 WeakPolarHBondContact O-CG2 3.46Å; S304-V308 PolarHBondContact O-N 3.33Å
305	V	91.1	Very high	83.9	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.2	-40.3	171.9	177.6	0	0	0	0	110.7	F271 L285 L289 I301 K302 R307 V308 R309 L404 I407 L408	F271-V305 HydrophobicContact CE1-CG2 3.86Å; F271-V305 HydrophobicContact CZ-CG2 3.81Å; L285-V305 HydrophobicContact CD1-CG2 3.77Å; L285-V305 HydrophobicContact CD2-CG1 4.48Å; L285-V305 HydrophobicContact CD2-CG2 3.89Å; L285-V305 HydrophobicContact CG-CG2 4.11Å; L289-V305 HydrophobicContact CD1-CG2 4.4Å; L289-V305 HydrophobicContact CD2-CG2 4.34Å; I301-V305 HydrophobicContact CG2-CG2 4.49Å; I301-V305 WeakPolarHBondContact O-CG2 3.27Å; I301-V305 PolarHBondContact O-N 3.26Å; K302-V305 PolarHBondContact O-N 3.49Å; V305-R307 VanDerWaalsContact C-N 3.28Å; V305-R307 PolarHBondContact O-N 2.92Å; V305-V308 PolarHBondContact O-N 3.03Å; V305-R309 WeakPolarHBondContact O-CB 3.46Å; V305-R309 PolarHBondContact O-N 2.82Å; V305-L404 HydrophobicContact CG1-CD2 4.14Å; V305-I407 HydrophobicContact CG1-CG2 4.36Å; V305-L408 HydrophobicContact CB-CD2 3.92Å; V305-L408 HydrophobicContact CG1-CD1 4.12Å; V305-L408 HydrophobicContact CG1-CD2 3.67Å; V305-L408 HydrophobicContact CG1-CG 3.75Å
306	Q	89.5	Confident	85.4	Confident	68 Å²	68	29.3 Å²	29.3	32%	0.318	16%	0.159	S	C	.	.	H	α-helix	trans	-61.2	-38.6	173.9	-172.2	66.7	23.1	0	0	111.8	K302 D303 R309 S310 L408	K302-Q306 PolarHBondContact O-N 3.26Å; D303-Q306 WeakPolarHBondContact O-CB 3.23Å; D303-Q306 PolarHBondContact O-N 2.98Å; Q306-R309 WeakPolarHBondContact O-CB 3.27Å; Q306-R309 PolarHBondContact O-N 3.38Å; Q306-S310 PolarHBondContact O-N 3.46Å; Q306-S310 PolarHBondContact O-OG 2.64Å; Q306-L408 VanDerWaalsContact OE1-CD1 3.25Å
307	R	90.9	Very high	87.3	Confident	19 Å²	19	25.3 Å²	25.3	7%	0.072	13%	0.133	C	C	.	.	H	α-helix	trans	-67.2	-44.8	176.5	-73.3	175.6	-38.4	136.1	-10.3	112.3	N16 E263 D266 D303 S304 V305 R309 S310 V311	N16-R307 PolarHBondContact ND2-NH1 3.2Å; E263-R307 WeakPolarHBondContact OE1-CB 3.14Å; E263-R307 WeakPolarHBondContact OE1-CD 3.44Å; E263-R307 VanDerWaalsContact OE1-CG 3.23Å; E263-R307 WeakPolarHBondContact OE1-CG 3.25Å; E263-R307 IonicContact OE1-CZ 3.65Å; E263-R307 IonicContact OE1-NE 3.68Å; E263-R307 PolarHBondContact OE1-NE 2.99Å; E263-R307 IonicContact OE1-NH1 3.23Å; E263-R307 PolarHBondContact OE1-NH1 3.05Å; E263-R307 IonicContact OE2-NH1 2.78Å; E263-R307 PolarHBondContact OE2-NH1 3.03Å; D266-R307 IonicContact OD2-CZ 2.92Å; D266-R307 IonicContact OD2-NH1 2.96Å; D266-R307 PolarHBondContact OD2-NH1 3.43Å; D266-R307 IonicContact OD2-NH2 2.63Å; D266-R307 PolarHBondContact OD2-NH2 3.12Å; D266-R307 VanDerWaalsContact OD2-NH2 3.09Å; D303-R307 VanDerWaalsContact O-CG 3.25Å; D303-R307 WeakPolarHBondContact O-CG 3.5Å; D303-R307 PolarHBondContact O-N 3.04Å; S304-R307 PolarHBondContact O-N 2.86Å; S304-R307 PolarHBondContact OG-NH2 2.96Å; V305-R307 VanDerWaalsContact C-N 3.28Å; V305-R307 PolarHBondContact O-N 2.92Å; R307-R309 VanDerWaalsContact C-N 3.31Å; R307-R309 PolarHBondContact O-N 3.28Å; R307-S310 WeakPolarHBondContact O-CB 3.25Å; R307-S310 PolarHBondContact O-N 2.84Å; R307-V311 PolarHBondContact O-N 3.48Å; R307-V311 VanDerWaalsContact O-N 3.1Å
308	V	94.7	Very high	89.5	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.006	12%	0.12	C	C	.	.	H	α-helix	trans	-56.8	-46	170.6	170.2	0	0	0	0	110.9	L242 C267 F271 S304 V305 S310 V311 V312 L404	L242-V308 HydrophobicContact CD1-CG2 4.47Å; L242-V308 HydrophobicContact CD2-CB 4.46Å; L242-V308 HydrophobicContact CD2-CG1 3.65Å; L242-V308 HydrophobicContact CD2-CG2 3.87Å; C267-V308 HydrophobicContact CB-CG2 3.85Å; F271-V308 HydrophobicContact CE2-CG2 3.92Å; F271-V308 HydrophobicContact CZ-CG2 4.38Å; S304-V308 WeakPolarHBondContact O-CG2 3.46Å; S304-V308 PolarHBondContact O-N 3.33Å; V305-V308 PolarHBondContact O-N 3.03Å; V308-S310 VanDerWaalsContact C-N 3.33Å; V308-S310 PolarHBondContact O-N 3.39Å; V308-V311 WeakPolarHBondContact O-CB 3.48Å; V308-V311 PolarHBondContact O-N 3.27Å; V308-V312 HydrophobicContact CG1-CG2 4.4Å; V308-V312 WeakPolarHBondContact O-CG2 3.48Å; V308-V312 PolarHBondContact O-N 3.48Å; V308-L404 HydrophobicContact CG1-CD1 4.23Å
309	R	96.1	Very high	91.2	Very high	59 Å²	59	21.8 Å²	21.8	22%	0.223	11%	0.107	C	C	.	.	H	α-helix	trans	-55.7	-46.6	175.9	-177	-152	-177.4	-93.8	-5.1	111.6	V305 Q306 R307 V311 V312 V313 L404 D405 L408	V305-R309 WeakPolarHBondContact O-CB 3.46Å; V305-R309 PolarHBondContact O-N 2.82Å; Q306-R309 WeakPolarHBondContact O-CB 3.27Å; Q306-R309 PolarHBondContact O-N 3.38Å; R307-R309 VanDerWaalsContact C-N 3.31Å; R307-R309 PolarHBondContact O-N 3.28Å; R309-V311 VanDerWaalsContact C-N 3.28Å; R309-V311 PolarHBondContact O-N 3.15Å; R309-V312 PolarHBondContact O-N 3.35Å; R309-V312 VanDerWaalsContact O-N 3.11Å; R309-V313 WeakPolarHBondContact O-CG2 3.26Å; R309-V313 PolarHBondContact O-N 3.06Å; R309-L404 HydrophobicContact CB-CB 4.25Å; R309-L404 HydrophobicContact CB-CD1 4.08Å; R309-L404 HydrophobicContact CG-CB 4.18Å; R309-L404 HydrophobicContact CG-CD1 4.47Å; R309-D405 IonicContact CZ-OD1 3.35Å; R309-D405 IonicContact CZ-OD2 3.89Å; R309-D405 IonicContact NE-OD1 3.97Å; R309-D405 PolarHBondContact NE-OD1 3.46Å; R309-D405 IonicContact NE-OD2 2.8Å; R309-D405 IonicContact NH2-OD1 3.34Å; R309-D405 PolarHBondContact NH2-OD1 3.22Å; R309-D405 IonicContact NH2-OD2 3.44Å; R309-D405 PolarHBondContact NH2-OD2 3.28Å; R309-L408 HydrophobicContact CB-CD1 4.47Å
310	S	95.5	Very high	92.5	Very high	7 Å²	7	22.8 Å²	22.8	5%	0.049	11%	0.113	C	C	.	.	H	α-helix	trans	-58.8	-38	176.2	-64.6	0	0	0	0	112.5	Q306 R307 V308 V313 F314 S340 H344	Q306-S310 PolarHBondContact O-N 3.46Å; Q306-S310 PolarHBondContact O-OG 2.64Å; R307-S310 WeakPolarHBondContact O-CB 3.25Å; R307-S310 PolarHBondContact O-N 2.84Å; V308-S310 VanDerWaalsContact C-N 3.33Å; V308-S310 PolarHBondContact O-N 3.39Å; S310-V313 PolarHBondContact O-N 2.92Å; S310-F314 PolarHBondContact O-N 2.84Å; S310-S340 WeakPolarHBondContact O-CB 3.46Å; S310-H344 PolarHBondContact OG-CE1 3.42Å; S310-H344 VanDerWaalsContact OG-CE1 3.25Å; S310-H344 PolarHBondContact OG-ND1 2.84Å
311	V	97.3	Very high	93.5	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.006	11%	0.113	C	C	.	.	H	α-helix	trans	-67.5	-38.7	173.9	178.7	0	0	0	0	112.1	I245 I260 E263 V264 R307 V308 R309 V313 F314 L315 V341	I245-V311 HydrophobicContact CG2-CG1 3.71Å; I260-V311 HydrophobicContact CG2-CB 4.43Å; I260-V311 HydrophobicContact CG2-CG1 3.69Å; I260-V311 HydrophobicContact CG2-CG2 3.98Å; E263-V311 HydrophobicContact CG-CG2 4.2Å; V264-V311 HydrophobicContact CG2-CB 4.34Å; V264-V311 HydrophobicContact CG2-CG1 3.77Å; V264-V311 HydrophobicContact CG2-CG2 4.08Å; R307-V311 PolarHBondContact O-N 3.48Å; R307-V311 VanDerWaalsContact O-N 3.1Å; V308-V311 WeakPolarHBondContact O-CB 3.48Å; V308-V311 PolarHBondContact O-N 3.27Å; R309-V311 VanDerWaalsContact C-N 3.28Å; R309-V311 PolarHBondContact O-N 3.15Å; V311-V313 VanDerWaalsContact C-N 3.34Å; V311-F314 VanDerWaalsContact O-CB 3.31Å; V311-F314 WeakPolarHBondContact O-CB 3.38Å; V311-F314 PolarHBondContact O-N 3.41Å; V311-L315 PolarHBondContact O-N 2.72Å; V311-V341 HydrophobicContact CG2-CG2 4.3Å
312	V	98.2	Very high	94.3	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-67.5	-37.3	175.7	-177.6	0	0	0	0	111	F219 I245 V308 R309 F314 L315 Q316 L397 C400 V401 L404	F219-V312 HydrophobicContact CE1-CG1 4.33Å; F219-V312 HydrophobicContact CE1-CG2 4.49Å; F219-V312 HydrophobicContact CZ-CG1 4.42Å; F219-V312 HydrophobicContact CZ-CG2 3.83Å; I245-V312 HydrophobicContact CD1-CG2 4.07Å; V308-V312 HydrophobicContact CG1-CG2 4.4Å; V308-V312 WeakPolarHBondContact O-CG2 3.48Å; V308-V312 PolarHBondContact O-N 3.48Å; R309-V312 PolarHBondContact O-N 3.35Å; R309-V312 VanDerWaalsContact O-N 3.11Å; V312-F314 VanDerWaalsContact C-N 3.34Å; V312-L315 PolarHBondContact O-N 3.08Å; V312-Q316 WeakPolarHBondContact O-CB 3.24Å; V312-Q316 PolarHBondContact O-N 3Å; V312-L397 HydrophobicContact CG1-CD2 4.01Å; V312-C400 HydrophobicContact CG1-CB 3.9Å; V312-V401 HydrophobicContact CB-CG2 4.3Å; V312-V401 HydrophobicContact CG1-CG2 3.69Å; V312-L404 HydrophobicContact CB-CD1 4.23Å; V312-L404 HydrophobicContact CG2-CD1 3.85Å
313	V	98	Very high	94.8	Very high	21 Å²	21	23.4 Å²	23.4	13%	0.127	11%	0.11	C	C	.	.	H	α-helix	trans	-66.2	-35.9	173.2	175.4	0	0	0	0	111.4	R309 S310 V311 Q316 T317 V401	R309-V313 WeakPolarHBondContact O-CG2 3.26Å; R309-V313 PolarHBondContact O-N 3.06Å; S310-V313 PolarHBondContact O-N 2.92Å; V311-V313 VanDerWaalsContact C-N 3.34Å; V313-Q316 PolarHBondContact O-N 3.08Å; V313-T317 WeakPolarHBondContact O-CB 3.43Å; V313-T317 PolarHBondContact O-N 3.02Å; V313-T317 PolarHBondContact O-OG1 2.63Å; V313-V401 HydrophobicContact CG2-CG1 4.1Å; V313-V401 HydrophobicContact CG2-CG2 3.82Å
314	F	98.2	Very high	95.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-56.5	-54.9	170.1	170	-94.7	0	0	0	110.6	L249 M257 I260 S310 V311 V312 Q316 T317 F318 A336 S340 V341 F353	L249-F314 HydrophobicContact CD2-CD1 4.41Å; L249-F314 HydrophobicContact CD2-CE1 4.03Å; M257-F314 HydrophobicContact CE-CZ 4.43Å; M257-F314 HydrophobicContact SD-CE1 3.95Å; M257-F314 HydrophobicContact SD-CZ 3.8Å; I260-F314 HydrophobicContact CD1-CD1 3.78Å; I260-F314 HydrophobicContact CD1-CD2 3.84Å; I260-F314 HydrophobicContact CD1-CE1 3.55Å; I260-F314 HydrophobicContact CD1-CE2 3.6Å; I260-F314 HydrophobicContact CD1-CG 3.93Å; I260-F314 HydrophobicContact CD1-CZ 3.46Å; I260-F314 VanDerWaalsContact CD1-CZ 3.46Å; S310-F314 PolarHBondContact O-N 2.84Å; V311-F314 VanDerWaalsContact O-CB 3.31Å; V311-F314 WeakPolarHBondContact O-CB 3.38Å; V311-F314 PolarHBondContact O-N 3.41Å; V312-F314 VanDerWaalsContact C-N 3.34Å; F314-Q316 VanDerWaalsContact C-N 3.33Å; F314-Q316 PolarHBondContact O-N 2.86Å; F314-T317 PolarHBondContact O-N 3.03Å; F314-F318 VanDerWaalsContact O-CB 3.27Å; F314-F318 WeakPolarHBondContact O-CB 3.43Å; F314-F318 PolarHBondContact O-N 2.84Å; F314-A336 HydrophobicContact CD2-CB 3.63Å; F314-A336 HydrophobicContact CE2-CB 3.73Å; F314-A336 HydrophobicContact CG-CB 4.36Å; F314-A336 WeakPolarHBondContact O-CB 3.42Å; F314-S340 VanDerWaalsContact CA-OG 3.31Å; F314-S340 WeakPolarHBondContact CA-OG 3.48Å; F314-S340 VanDerWaalsContact CB-OG 3.28Å; F314-S340 WeakPolarHBondContact CB-OG 3.35Å; F314-V341 HydrophobicContact CB-CG2 3.9Å; F314-F353 HydrophobicContact CE2-CE2 4.45Å; F314-F353 HydrophobicContact CE2-CZ 4.02Å; F314-F353 HydrophobicContact CZ-CE2 4.48Å; F314-F353 HydrophobicContact CZ-CZ 4.28Å
315	L	98.6	Very high	95.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.8	-45	179	-68.7	178.5	0	0	0	111.2	I245 I248 L249 I252 V311 V312 T317 F318 F319 L397	I245-L315 HydrophobicContact CG2-CD1 4.18Å; I248-L315 HydrophobicContact CG2-CD1 4.22Å; I248-L315 HydrophobicContact CG2-CD2 3.88Å; L249-L315 HydrophobicContact CD2-CD2 4Å; I252-L315 HydrophobicContact CD1-CD2 3.63Å; V311-L315 PolarHBondContact O-N 2.72Å; V312-L315 PolarHBondContact O-N 3.08Å; L315-T317 VanDerWaalsContact C-N 3.35Å; L315-T317 PolarHBondContact O-N 3.24Å; L315-F318 PolarHBondContact O-N 3.3Å; L315-F319 HydrophobicContact CD2-CE2 4.5Å; L315-F319 WeakPolarHBondContact O-CD2 3.34Å; L315-F319 PolarHBondContact O-N 2.95Å; L315-L397 HydrophobicContact CB-CD1 3.91Å; L315-L397 HydrophobicContact CB-CD2 3.85Å; L315-L397 HydrophobicContact CD1-CD2 4.29Å
316	Q	98.5	Very high	95.3	Very high	30 Å²	30	35.6 Å²	35.6	14%	0.14	18%	0.182	C	C	.	.	H	α-helix	trans	-56.2	-50.3	178.8	-173.8	-168.2	21.2	0	0	111	V312 V313 F314 F319 D320 Y394 L397 T398	V312-Q316 WeakPolarHBondContact O-CB 3.24Å; V312-Q316 PolarHBondContact O-N 3Å; V313-Q316 PolarHBondContact O-N 3.08Å; F314-Q316 VanDerWaalsContact C-N 3.33Å; F314-Q316 PolarHBondContact O-N 2.86Å; Q316-F319 PolarHBondContact O-N 3.36Å; Q316-D320 WeakPolarHBondContact O-CB 3.42Å; Q316-D320 PolarHBondContact O-N 2.68Å; Q316-Y394 HydrophobicContact CG-CD2 3.88Å; Q316-Y394 HydrophobicContact CG-CE2 3.84Å; Q316-L397 HydrophobicContact CB-CB 3.89Å; Q316-L397 HydrophobicContact CG-CB 4.16Å; Q316-T398 PolarHBondContact NE2-OG1 2.77Å
317	T	98.2	Very high	95.5	Very high	17 Å²	17	33.1 Å²	33.1	10%	0.104	17%	0.173	C	C	.	.	H	α-helix	trans	-67.3	-39.9	-179.7	-52.4	0	0	0	0	111.2	V313 F314 L315 F319 D320 E321 A336 K339	V313-T317 WeakPolarHBondContact O-CB 3.43Å; V313-T317 PolarHBondContact O-N 3.02Å; V313-T317 PolarHBondContact O-OG1 2.63Å; F314-T317 PolarHBondContact O-N 3.03Å; L315-T317 VanDerWaalsContact C-N 3.35Å; L315-T317 PolarHBondContact O-N 3.24Å; T317-F319 PolarHBondContact O-N 3.2Å; T317-D320 WeakPolarHBondContact O-CB 3.39Å; T317-D320 PolarHBondContact O-N 2.95Å; T317-E321 HydrophobicContact CG2-CG 4.38Å; T317-E321 WeakPolarHBondContact O-CG 3.31Å; T317-E321 PolarHBondContact O-N 3.25Å; T317-A336 HydrophobicContact CG2-CB 4.08Å; T317-K339 HydrophobicContact CG2-CB 4.48Å; T317-K339 HydrophobicContact CG2-CD 3.72Å
318	F	98.4	Very high	95.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.7	-48.6	177.1	176	-103.3	0	0	0	111.4	I252 F314 L315 E321 L322 P329 C332 A333 A336 I366	I252-F318 HydrophobicContact CD1-CD1 3.72Å; I252-F318 HydrophobicContact CD1-CE1 3.61Å; I252-F318 HydrophobicContact CD1-CG 4.46Å; I252-F318 HydrophobicContact CD1-CZ 4.29Å; I252-F318 HydrophobicContact CG1-CD1 4.3Å; I252-F318 HydrophobicContact CG1-CE1 3.66Å; I252-F318 HydrophobicContact CG1-CZ 4.15Å; I252-F318 HydrophobicContact CG2-CE1 4.25Å; I252-F318 HydrophobicContact CG2-CE2 4.38Å; I252-F318 HydrophobicContact CG2-CZ 3.87Å; F314-F318 VanDerWaalsContact O-CB 3.27Å; F314-F318 WeakPolarHBondContact O-CB 3.43Å; F314-F318 PolarHBondContact O-N 2.84Å; L315-F318 PolarHBondContact O-N 3.3Å; F318-E321 PolarHBondContact O-N 3.4Å; F318-L322 HydrophobicContact CD1-CD1 3.83Å; F318-L322 HydrophobicContact CE1-CD1 3.23Å; F318-L322 HydrophobicContact CE1-CG 4.17Å; F318-L322 HydrophobicContact CE2-CD1 4.27Å; F318-L322 HydrophobicContact CE2-CG 4.46Å; F318-L322 HydrophobicContact CZ-CD1 3.5Å; F318-L322 HydrophobicContact CZ-CG 4.15Å; F318-L322 WeakPolarHBondContact O-CG 3.46Å; F318-L322 PolarHBondContact O-N 3.09Å; F318-P329 WeakPolarHBondContact CE2-O 3.31Å; F318-P329 HydrophobicContact CZ-CB 4.46Å; F318-C332 HydrophobicContact CD2-CB 3.83Å; F318-C332 HydrophobicContact CE2-CB 3.93Å; F318-A333 HydrophobicContact CD2-CB 4.02Å; F318-A333 HydrophobicContact CE2-CB 3.91Å; F318-A336 HydrophobicContact CB-CB 3.86Å; F318-I366 HydrophobicContact CE1-CD1 4.33Å; F318-I366 HydrophobicContact CZ-CD1 3.88Å
319	F	97.6	Very high	95.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-70.5	-31.1	178.6	-78.6	-65.4	0	0	0	113.1	V216 I248 L315 Q316 T317 L322 R323 I366 L370 F390 C393 L397	V216-F319 HydrophobicContact CG2-CE2 4.02Å; V216-F319 HydrophobicContact CG2-CZ 4.16Å; I248-F319 HydrophobicContact CG2-CE2 4.11Å; I248-F319 HydrophobicContact CG2-CZ 4.36Å; L315-F319 HydrophobicContact CD2-CE2 4.5Å; L315-F319 WeakPolarHBondContact O-CD2 3.34Å; L315-F319 PolarHBondContact O-N 2.95Å; Q316-F319 PolarHBondContact O-N 3.36Å; T317-F319 PolarHBondContact O-N 3.2Å; F319-L322 HydrophobicContact CD1-CD1 4.14Å; F319-L322 HydrophobicContact CE1-CD1 4.28Å; F319-L322 PolarHBondContact O-N 3.1Å; F319-R323 VanDerWaalsContact O-CG 3.29Å; F319-R323 WeakPolarHBondContact O-CG 3.46Å; F319-R323 PolarHBondContact O-N 2.79Å; F319-I366 HydrophobicContact CE1-CG2 4.4Å; F319-L370 HydrophobicContact CE1-CD1 3.51Å; F319-L370 HydrophobicContact CZ-CD1 3.67Å; F319-L370 HydrophobicContact CZ-CD2 4.22Å; F319-F390 AromaticContact CD1-CD1 3.75Å; F319-F390 HydrophobicContact CD1-CD1 3.75Å; F319-F390 HydrophobicContact CD1-CE1 4.37Å; F319-F390 AromaticContact CE1-CD1 3.94Å; F319-F390 HydrophobicContact CE1-CD1 3.94Å; F319-F390 HydrophobicContact CE1-CE1 4.17Å; F319-C393 HydrophobicContact CB-CB 4.2Å; F319-C393 HydrophobicContact CD1-CB 3.92Å; F319-C393 HydrophobicContact CD2-CB 4.2Å; F319-C393 HydrophobicContact CE1-CB 4.38Å; F319-C393 HydrophobicContact CG-CB 3.83Å; F319-L397 HydrophobicContact CB-CD1 4.35Å; F319-L397 HydrophobicContact CD2-CD1 3.44Å; F319-L397 VanDerWaalsContact CD2-CD1 3.44Å; F319-L397 HydrophobicContact CE2-CD1 4.18Å; F319-L397 HydrophobicContact CG-CD1 4.25Å
320	D	97.5	Very high	95.8	Very high	52 Å²	52	34.6 Å²	34.6	28%	0.278	19%	0.189	S	C	.	.	H	α-helix	trans	-58.6	-52.6	171.6	-174.2	16.4	0	0	0	111.4	Q316 T317 L322 R323 Y394	Q316-D320 WeakPolarHBondContact O-CB 3.42Å; Q316-D320 PolarHBondContact O-N 2.68Å; T317-D320 WeakPolarHBondContact O-CB 3.39Å; T317-D320 PolarHBondContact O-N 2.95Å; D320-L322 VanDerWaalsContact C-N 3.31Å; D320-L322 PolarHBondContact O-N 3.5Å; D320-R323 VanDerWaalsContact O-CB 3.32Å; D320-R323 WeakPolarHBondContact O-CB 3.13Å; D320-R323 WeakPolarHBondContact O-CG 3.39Å; D320-R323 PolarHBondContact O-N 2.78Å; D320-R323 PolarHBondContact O-NE 2.85Å; D320-R323 IonicContact OD1-CZ 2.7Å; D320-R323 VanDerWaalsContact OD1-CZ 3.23Å; D320-R323 IonicContact OD1-NE 3.91Å; D320-R323 PolarHBondContact OD1-NE 2.93Å; D320-R323 VanDerWaalsContact OD1-NE 3.12Å; D320-R323 IonicContact OD1-NH2 3.84Å; D320-R323 PolarHBondContact OD1-NH2 2.91Å; D320-Y394 HydrophobicContact CB-CD2 3.65Å; D320-Y394 HydrophobicContact CB-CE2 3.79Å
321	E	97.2	Very high	95.9	Very high	63 Å²	63	37.6 Å²	37.6	29%	0.294	21%	0.209	S	C	.	.	H	α-helix	trans	-64.7	-35	-179.5	-60.1	-79.4	173.7	0	0	111.4	T317 F318 R323 A324 A327 C332 T335 K339	T317-E321 HydrophobicContact CG2-CG 4.38Å; T317-E321 WeakPolarHBondContact O-CG 3.31Å; T317-E321 PolarHBondContact O-N 3.25Å; F318-E321 PolarHBondContact O-N 3.4Å; E321-R323 PolarHBondContact O-N 3.06Å; E321-A324 PolarHBondContact O-N 3.5Å; E321-A327 WeakPolarHBondContact O-CB 3.34Å; E321-C332 HydrophobicContact CB-CB 3.87Å; E321-T335 HydrophobicContact CG-CG2 4.34Å; E321-T335 WeakPolarHBondContact OE1-CG2 3.49Å; E321-K339 IonicContact OE1-NZ 3.19Å; E321-K339 PolarHBondContact OE1-NZ 3.44Å
322	L	95.8	Very high	95.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-14	177.1	-81.9	-177.3	0	0	0	114.9	F318 F319 D320 A324 A327 P329 C332 R363 F390	F318-L322 HydrophobicContact CD1-CD1 3.83Å; F318-L322 HydrophobicContact CE1-CD1 3.23Å; F318-L322 HydrophobicContact CE1-CG 4.17Å; F318-L322 HydrophobicContact CE2-CD1 4.27Å; F318-L322 HydrophobicContact CE2-CG 4.46Å; F318-L322 HydrophobicContact CZ-CD1 3.5Å; F318-L322 HydrophobicContact CZ-CG 4.15Å; F318-L322 WeakPolarHBondContact O-CG 3.46Å; F318-L322 PolarHBondContact O-N 3.09Å; F319-L322 HydrophobicContact CD1-CD1 4.14Å; F319-L322 HydrophobicContact CE1-CD1 4.28Å; F319-L322 PolarHBondContact O-N 3.1Å; D320-L322 VanDerWaalsContact C-N 3.31Å; D320-L322 PolarHBondContact O-N 3.5Å; L322-A324 PolarHBondContact O-N 2.9Å; L322-A327 HydrophobicContact CD2-CB 4.29Å; L322-P329 HydrophobicContact CD2-CB 4.26Å; L322-P329 HydrophobicContact CD2-CG 4.04Å; L322-C332 HydrophobicContact CD2-CB 4.39Å; L322-C332 HydrophobicContact CG-CB 4.35Å; L322-R363 HydrophobicContact CD2-CG 4.36Å; L322-R363 PolarHBondContact O-NE 3.22Å; L322-R363 VanDerWaalsContact O-NE 3.16Å; L322-R363 PolarHBondContact O-NH2 2.68Å; L322-F390 HydrophobicContact CB-CD2 4.15Å; L322-F390 HydrophobicContact CB-CE2 4.38Å; L322-F390 HydrophobicContact CB-CG 4.26Å; L322-F390 HydrophobicContact CD1-CE1 4.22Å; L322-F390 HydrophobicContact CD1-CZ 4.36Å; L322-F390 WeakPolarHBondContact O-CD2 3.4Å
323	R	93.6	Very high	95.9	Very high	82 Å²	82	37.9 Å²	37.9	31%	0.309	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-26.1	176.3	-60	-172.5	-64.4	165	-0.8	111.9	F319 D320 E321 F390 D391	F319-R323 VanDerWaalsContact O-CG 3.29Å; F319-R323 WeakPolarHBondContact O-CG 3.46Å; F319-R323 PolarHBondContact O-N 2.79Å; D320-R323 VanDerWaalsContact O-CB 3.32Å; D320-R323 WeakPolarHBondContact O-CB 3.13Å; D320-R323 WeakPolarHBondContact O-CG 3.39Å; D320-R323 PolarHBondContact O-N 2.78Å; D320-R323 PolarHBondContact O-NE 2.85Å; D320-R323 IonicContact OD1-CZ 2.7Å; D320-R323 VanDerWaalsContact OD1-CZ 3.23Å; D320-R323 IonicContact OD1-NE 3.91Å; D320-R323 PolarHBondContact OD1-NE 2.93Å; D320-R323 VanDerWaalsContact OD1-NE 3.12Å; D320-R323 IonicContact OD1-NH2 3.84Å; D320-R323 PolarHBondContact OD1-NH2 2.91Å; E321-R323 PolarHBondContact O-N 3.06Å; R323-F390 HydrophobicContact CG-CB 4.01Å; R323-D391 IonicContact CZ-OD1 3.06Å; R323-D391 IonicContact NH1-OD1 3.9Å; R323-D391 PolarHBondContact NH1-OD1 2.97Å
324	A	92.6	Very high	95.8	Very high	52 Å²	52	40.4 Å²	40.4	43%	0.43	22%	0.223	S	C	.	.	S	Bend	trans	-63.2	134.4	176.4	0	0	0	0	0	110.7	E321 L322 E326 A327	E321-A324 PolarHBondContact O-N 3.5Å; L322-A324 PolarHBondContact O-N 2.9Å; A324-E326 PolarHBondContact O-N 2.94Å; A324-A327 HydrophobicContact CB-CB 4.21Å; A324-A327 VanDerWaalsContact O-CB 3.28Å; A324-A327 WeakPolarHBondContact O-CB 3.45Å; A324-A327 PolarHBondContact O-N 3.32Å
325	P	87.7	Confident	95.7	Very high	99 Å²	99	42.5 Å²	42.5	64%	0.643	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	137.2	170.8	-21.9	32.9	0	0	0	109.9	A327	P325-A327 PolarHBondContact O-N 2.94Å
326	E	87.5	Confident	95.7	Very high	176 Å²	176	42.5 Å²	42.5	82%	0.822	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	19.9	-177.6	-49.5	-53.7	133.5	0	0	115.4	A324 D328	A324-E326 PolarHBondContact O-N 2.94Å; E326-D328 PolarHBondContact O-N 2.88Å
327	A	93.4	Very high	95.5	Very high	16 Å²	16	41.3 Å²	41.3	13%	0.132	23%	0.23	C	C	.	.			trans	-57	127.4	172.5	0	0	0	0	0	111.3	E321 L322 A324 P325 P329	E321-A327 WeakPolarHBondContact O-CB 3.34Å; L322-A327 HydrophobicContact CD2-CB 4.29Å; A324-A327 HydrophobicContact CB-CB 4.21Å; A324-A327 VanDerWaalsContact O-CB 3.28Å; A324-A327 WeakPolarHBondContact O-CB 3.45Å; A324-A327 PolarHBondContact O-N 3.32Å; P325-A327 PolarHBondContact O-N 2.94Å; A327-P329 WeakPolarHBondContact O-CD 3.28Å
328	D	95.3	Very high	95.3	Very high	87 Å²	87	42.9 Å²	42.9	47%	0.465	24%	0.244	S	C	.	.			trans	-79.1	115.5	172.1	169.9	45.9	0	0	0	110.2	E326 S330 S331 C332	E326-D328 PolarHBondContact O-N 2.88Å; D328-S330 PolarHBondContact O-N 2.97Å; D328-S330 PolarHBondContact OD1-N 3.5Å; D328-S330 WeakPolarHBondContact OD2-CB 3.37Å; D328-S331 WeakPolarHBondContact O-CB 3.2Å; D328-S331 PolarHBondContact O-N 3.07Å; D328-S331 VanDerWaalsContact O-N 3.15Å; D328-S331 WeakPolarHBondContact OD2-CB 3.3Å; D328-S331 PolarHBondContact OD2-N 2.84Å; D328-C332 PolarHBondContact O-N 2.78Å; D328-C332 PolarHBondContact O-SG 2.95Å
329	P	96.7	Very high	95.1	Very high	9 Å²	9	48.8 Å²	48.8	6%	0.058	27%	0.27	C	S	.	.	H	α-helix	trans	-57.5	-33.2	-178.6	-27.3	37.3	0	0	0	114.2	F318 L322 A327 C332 A333 V360 N361 R363 I366	F318-P329 WeakPolarHBondContact CE2-O 3.31Å; F318-P329 HydrophobicContact CZ-CB 4.46Å; L322-P329 HydrophobicContact CD2-CB 4.26Å; L322-P329 HydrophobicContact CD2-CG 4.04Å; A327-P329 WeakPolarHBondContact O-CD 3.28Å; P329-C332 PolarHBondContact O-N 2.83Å; P329-A333 WeakPolarHBondContact O-CB 3.42Å; P329-A333 PolarHBondContact O-N 2.97Å; P329-V360 HydrophobicContact CB-CG1 3.59Å; P329-N361 WeakPolarHBondContact CB-O 3.43Å; P329-N361 WeakPolarHBondContact CG-O 3.46Å; P329-R363 HydrophobicContact CG-CB 4.09Å; P329-I366 HydrophobicContact CB-CD1 4.07Å; P329-I366 HydrophobicContact CG-CD1 4.33Å
330	S	96.7	Very high	94.9	Very high	15 Å²	15	49.2 Å²	49.2	11%	0.105	27%	0.273	C	S	.	.	H	α-helix	trans	-66.5	-45	178.7	-56.3	0	0	0	0	110.9	D328 A333 M334 V357	D328-S330 PolarHBondContact O-N 2.97Å; D328-S330 PolarHBondContact OD1-N 3.5Å; D328-S330 WeakPolarHBondContact OD2-CB 3.37Å; S330-A333 PolarHBondContact O-N 2.9Å; S330-M334 PolarHBondContact O-N 3.13Å; S330-V357 PolarHBondContact OG-O 2.95Å
331	S	96.8	Very high	94.4	Very high	69 Å²	69	46.9 Å²	46.9	48%	0.483	26%	0.261	S	S	.	.	H	α-helix	trans	-62.2	-41.9	173.2	-169.2	0	0	0	0	112.7	D328 A333 M334 T335	D328-S331 WeakPolarHBondContact O-CB 3.2Å; D328-S331 PolarHBondContact O-N 3.07Å; D328-S331 VanDerWaalsContact O-N 3.15Å; D328-S331 WeakPolarHBondContact OD2-CB 3.3Å; D328-S331 PolarHBondContact OD2-N 2.84Å; S331-A333 PolarHBondContact O-N 2.78Å; S331-M334 PolarHBondContact O-N 2.96Å; S331-T335 WeakPolarHBondContact O-CB 3.23Å; S331-T335 PolarHBondContact O-N 3.36Å; S331-T335 PolarHBondContact O-OG1 3.16Å
332	C	97.7	Very high	93.6	Very high	7 Å²	7	47.8 Å²	47.8	5%	0.047	26%	0.264	C	S	.	.	H	α-helix	trans	-59.9	-45.7	174.3	-61.6	0	0	0	0	111.3	F318 E321 L322 D328 P329 T335 A336	F318-C332 HydrophobicContact CD2-CB 3.83Å; F318-C332 HydrophobicContact CE2-CB 3.93Å; E321-C332 HydrophobicContact CB-CB 3.87Å; L322-C332 HydrophobicContact CD2-CB 4.39Å; L322-C332 HydrophobicContact CG-CB 4.35Å; D328-C332 PolarHBondContact O-N 2.78Å; D328-C332 PolarHBondContact O-SG 2.95Å; P329-C332 PolarHBondContact O-N 2.83Å; C332-T335 PolarHBondContact O-N 3.5Å; C332-A336 VanDerWaalsContact O-CB 3.29Å; C332-A336 WeakPolarHBondContact O-CB 3.46Å; C332-A336 PolarHBondContact O-N 3.1Å
333	A	97.4	Very high	92.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-41.8	179.3	0	0	0	0	0	112	M257 F318 P329 S330 S331 A336 Y337 F353 V357 V360	M257-A333 HydrophobicContact CE-CB 4.49Å; F318-A333 HydrophobicContact CD2-CB 4.02Å; F318-A333 HydrophobicContact CE2-CB 3.91Å; P329-A333 WeakPolarHBondContact O-CB 3.42Å; P329-A333 PolarHBondContact O-N 2.97Å; S330-A333 PolarHBondContact O-N 2.9Å; S331-A333 PolarHBondContact O-N 2.78Å; A333-A336 PolarHBondContact O-N 3.05Å; A333-Y337 VanDerWaalsContact O-CB 3.23Å; A333-Y337 WeakPolarHBondContact O-CB 3.45Å; A333-Y337 PolarHBondContact O-N 3Å; A333-F353 HydrophobicContact CB-CZ 4.34Å; A333-V357 HydrophobicContact CB-CG2 3.64Å; A333-V360 HydrophobicContact CB-CG2 4.29Å
334	M	95.9	Very high	91.5	Very high	75 Å²	75	53.2 Å²	53.2	37%	0.369	30%	0.297	S	S	.	.	H	α-helix	trans	-60.3	-45.6	174.1	-80.8	-63.3	-79	0	0	112.4	S330 S331 Y337 A338 F353 V357	S330-M334 PolarHBondContact O-N 3.13Å; S331-M334 PolarHBondContact O-N 2.96Å; M334-Y337 PolarHBondContact O-N 3.19Å; M334-A338 WeakPolarHBondContact O-CB 3.36Å; M334-A338 PolarHBondContact O-N 3.31Å; M334-F353 HydrophobicContact SD-CD1 4.39Å; M334-F353 HydrophobicContact SD-CE1 4.18Å; M334-V357 HydrophobicContact CG-CB 4.31Å; M334-V357 HydrophobicContact CG-CG1 3.71Å; M334-V357 HydrophobicContact CG-CG2 3.91Å; M334-V357 HydrophobicContact SD-CB 4.21Å; M334-V357 HydrophobicContact SD-CG1 3.73Å; M334-V357 HydrophobicContact SD-CG2 4.24Å
335	T	96.7	Very high	90.6	Very high	43 Å²	43	51.1 Å²	51.1	26%	0.264	28%	0.278	S	S	.	.	H	α-helix	trans	-65.3	-45.2	179.3	-59.7	0	0	0	0	111.3	E321 S331 C332 A338 K339	E321-T335 HydrophobicContact CG-CG2 4.34Å; E321-T335 WeakPolarHBondContact OE1-CG2 3.49Å; S331-T335 WeakPolarHBondContact O-CB 3.23Å; S331-T335 PolarHBondContact O-N 3.36Å; S331-T335 PolarHBondContact O-OG1 3.16Å; C332-T335 PolarHBondContact O-N 3.5Å; T335-A338 PolarHBondContact O-N 2.9Å; T335-K339 HydrophobicContact CG2-CD 3.97Å; T335-K339 WeakPolarHBondContact O-CG 2.99Å; T335-K339 PolarHBondContact O-N 3.26Å
336	A	97.4	Very high	89.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.1	-46.8	175.8	0	0	0	0	0	111.8	F314 T317 F318 C332 A333 A338 K339 S340	F314-A336 HydrophobicContact CD2-CB 3.63Å; F314-A336 HydrophobicContact CE2-CB 3.73Å; F314-A336 HydrophobicContact CG-CB 4.36Å; F314-A336 WeakPolarHBondContact O-CB 3.42Å; T317-A336 HydrophobicContact CG2-CB 4.08Å; F318-A336 HydrophobicContact CB-CB 3.86Å; C332-A336 VanDerWaalsContact O-CB 3.29Å; C332-A336 WeakPolarHBondContact O-CB 3.46Å; C332-A336 PolarHBondContact O-N 3.1Å; A333-A336 PolarHBondContact O-N 3.05Å; A336-A338 PolarHBondContact O-N 2.76Å; A336-K339 PolarHBondContact O-N 3.48Å; A336-S340 WeakPolarHBondContact O-CB 3.44Å; A336-S340 PolarHBondContact O-N 3.3Å; A336-S340 PolarHBondContact O-OG 3.34Å
337	Y	95.5	Very high	89.2	Confident	6 Å²	6	43.2 Å²	43.2	2%	0.024	24%	0.237	C	C	.	.	H	α-helix	trans	-59.8	-47	179.6	-177	-97.1	0	0	0	111.8	I260 A333 M334 K339 S340 V341 K342 Q345 Q350 F353	I260-Y337 HydrophobicContact CD1-CD2 4.33Å; A333-Y337 VanDerWaalsContact O-CB 3.23Å; A333-Y337 WeakPolarHBondContact O-CB 3.45Å; A333-Y337 PolarHBondContact O-N 3Å; M334-Y337 PolarHBondContact O-N 3.19Å; Y337-K339 VanDerWaalsContact C-N 3.27Å; Y337-K339 PolarHBondContact O-N 3.2Å; Y337-S340 PolarHBondContact O-N 3.39Å; Y337-V341 HydrophobicContact CD2-CB 4.2Å; Y337-V341 HydrophobicContact CE2-CB 4.17Å; Y337-V341 HydrophobicContact CE2-CG1 4.03Å; Y337-V341 PolarHBondContact O-N 3.08Å; Y337-K342 HydrophobicContact CD1-CB 3.99Å; Y337-K342 HydrophobicContact CD1-CG 4.44Å; Y337-K342 HydrophobicContact CE1-CB 3.76Å; Y337-K342 HydrophobicContact CE1-CG 3.97Å; Y337-K342 VanDerWaalsContact O-CB 3.29Å; Y337-K342 WeakPolarHBondContact O-CB 3.15Å; Y337-K342 PolarHBondContact O-N 3.44Å; Y337-K342 VanDerWaalsContact O-N 3.14Å; Y337-Q345 VanDerWaalsContact CE2-OE1 3.31Å; Y337-Q345 PolarHBondContact OH-OE1 3.46Å; Y337-Q350 HydrophobicContact CE1-CB 4.44Å; Y337-Q350 HydrophobicContact CE1-CG 4.24Å; Y337-Q350 VanDerWaalsContact OH-CA 3.28Å; Y337-Q350 WeakPolarHBondContact OH-CA 3.38Å; Y337-Q350 WeakPolarHBondContact OH-CG 3.37Å; Y337-F353 AromaticContact CD1-CD1 3.67Å; Y337-F353 HydrophobicContact CD1-CD1 3.67Å; Y337-F353 AromaticContact CD1-CE1 3.98Å; Y337-F353 HydrophobicContact CD1-CE1 3.98Å; Y337-F353 HydrophobicContact CD1-CG 4.35Å; Y337-F353 HydrophobicContact CD2-CB 4.46Å; Y337-F353 AromaticContact CD2-CD1 3.6Å; Y337-F353 HydrophobicContact CD2-CD1 3.6Å; Y337-F353 AromaticContact CD2-CD2 3.82Å; Y337-F353 HydrophobicContact CD2-CD2 3.82Å; Y337-F353 AromaticContact CD2-CE1 3.68Å; Y337-F353 HydrophobicContact CD2-CE1 3.68Å; Y337-F353 AromaticContact CD2-CE2 3.87Å; Y337-F353 HydrophobicContact CD2-CE2 3.87Å; Y337-F353 AromaticContact CD2-CG 3.67Å; Y337-F353 HydrophobicContact CD2-CG 3.67Å; Y337-F353 AromaticContact CD2-CZ 3.81Å; Y337-F353 HydrophobicContact CD2-CZ 3.81Å; Y337-F353 HydrophobicContact CE1-CB 4.45Å; Y337-F353 HydrophobicContact CE1-CD1 4.05Å; Y337-F353 HydrophobicContact CE1-CG 4.38Å; Y337-F353 HydrophobicContact CE2-CB 4.01Å; Y337-F353 AromaticContact CE2-CD1 3.98Å; Y337-F353 HydrophobicContact CE2-CD1 3.98Å; Y337-F353 AromaticContact CE2-CD2 3.98Å; Y337-F353 HydrophobicContact CE2-CD2 3.98Å; Y337-F353 HydrophobicContact CE2-CE2 4.48Å; Y337-F353 AromaticContact CE2-CG 3.7Å; Y337-F353 HydrophobicContact CE2-CG 3.7Å; Y337-F353 AromaticContact CG-CD1 3.44Å; Y337-F353 HydrophobicContact CG-CD1 3.44Å; Y337-F353 VanDerWaalsContact CG-CD1 3.44Å; Y337-F353 HydrophobicContact CG-CD2 4.47Å; Y337-F353 AromaticContact CG-CE1 3.38Å; Y337-F353 HydrophobicContact CG-CE1 3.38Å; Y337-F353 HydrophobicContact CG-CE2 4.41Å; Y337-F353 HydrophobicContact CG-CG 4.02Å; Y337-F353 AromaticContact CG-CZ 3.89Å; Y337-F353 HydrophobicContact CG-CZ 3.89Å
338	A	93	Very high	88.4	Confident	49 Å²	49	42.7 Å²	42.7	41%	0.405	23%	0.232	S	C	.	.	H	α-helix	trans	-62.2	-31.6	178.8	0	0	0	0	0	113.5	M334 T335 A336 K342	M334-A338 WeakPolarHBondContact O-CB 3.36Å; M334-A338 PolarHBondContact O-N 3.31Å; T335-A338 PolarHBondContact O-N 2.9Å; A336-A338 PolarHBondContact O-N 2.76Å; A338-K342 HydrophobicContact CB-CD 4.46Å
339	K	94	Very high	87.9	Confident	125 Å²	125	38.6 Å²	38.6	54%	0.543	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-1.6	-178.7	-71.3	170.7	176.3	174.1	0	114.2	T317 E321 T335 A336 Y337	T317-K339 HydrophobicContact CG2-CB 4.48Å; T317-K339 HydrophobicContact CG2-CD 3.72Å; E321-K339 IonicContact OE1-NZ 3.19Å; E321-K339 PolarHBondContact OE1-NZ 3.44Å; T335-K339 HydrophobicContact CG2-CD 3.97Å; T335-K339 WeakPolarHBondContact O-CG 2.99Å; T335-K339 PolarHBondContact O-N 3.26Å; A336-K339 PolarHBondContact O-N 3.48Å; Y337-K339 VanDerWaalsContact C-N 3.27Å; Y337-K339 PolarHBondContact O-N 3.2Å
340	S	93.7	Very high	87.3	Confident	9 Å²	9	39.9 Å²	39.9	6%	0.063	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.9	-79	-167.8	61.4	0	0	0	0	114.9	S310 F314 A336 Y337	S310-S340 WeakPolarHBondContact O-CB 3.46Å; F314-S340 VanDerWaalsContact CA-OG 3.31Å; F314-S340 WeakPolarHBondContact CA-OG 3.48Å; F314-S340 VanDerWaalsContact CB-OG 3.28Å; F314-S340 WeakPolarHBondContact CB-OG 3.35Å; A336-S340 WeakPolarHBondContact O-CB 3.44Å; A336-S340 PolarHBondContact O-N 3.3Å; A336-S340 PolarHBondContact O-OG 3.34Å; Y337-S340 PolarHBondContact O-N 3.39Å
341	V	87.1	Confident	86.7	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.018	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-30.6	-169.1	176	0	0	0	0	111.5	V311 F314 Y337 D343 H344 Q345	V311-V341 HydrophobicContact CG2-CG2 4.3Å; F314-V341 HydrophobicContact CB-CG2 3.9Å; Y337-V341 HydrophobicContact CD2-CB 4.2Å; Y337-V341 HydrophobicContact CE2-CB 4.17Å; Y337-V341 HydrophobicContact CE2-CG1 4.03Å; Y337-V341 PolarHBondContact O-N 3.08Å; V341-D343 VanDerWaalsContact C-N 3.34Å; V341-D343 PolarHBondContact O-N 3.37Å; V341-H344 PolarHBondContact O-N 3.03Å; V341-H344 VanDerWaalsContact O-N 3.07Å; V341-Q345 VanDerWaalsContact CG1-CD 3.41Å; V341-Q345 HydrophobicContact CG1-CG 3.73Å; V341-Q345 VanDerWaalsContact CG1-NE2 3.33Å
342	K	81.4	Confident	86.2	Confident	81 Å²	81	39.4 Å²	39.4	35%	0.352	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-48	-48.9	-172.9	-177.6	-179.8	177.1	-177.5	0	114.1	Y337 A338 H344 Q345 Q350	Y337-K342 HydrophobicContact CD1-CB 3.99Å; Y337-K342 HydrophobicContact CD1-CG 4.44Å; Y337-K342 HydrophobicContact CE1-CB 3.76Å; Y337-K342 HydrophobicContact CE1-CG 3.97Å; Y337-K342 VanDerWaalsContact O-CB 3.29Å; Y337-K342 WeakPolarHBondContact O-CB 3.15Å; Y337-K342 PolarHBondContact O-N 3.44Å; Y337-K342 VanDerWaalsContact O-N 3.14Å; A338-K342 HydrophobicContact CB-CD 4.46Å; K342-H344 PolarHBondContact O-N 3.48Å; K342-H344 VanDerWaalsContact O-N 3.14Å; K342-Q345 PolarHBondContact O-N 2.83Å; K342-Q350 VanDerWaalsContact CE-OE1 3.25Å; K342-Q350 HydrophobicContact CG-CG 4.12Å; K342-Q350 PolarHBondContact O-NE2 2.82Å; K342-Q350 VanDerWaalsContact O-NE2 3.15Å
343	D	74	Confident	85.9	Confident	135 Å²	135	39 Å²	39	72%	0.722	20%	0.199	S	C	*	.	G	3₁₀ helix	trans	-67.4	-17.3	-172.6	-66.1	-21.3	0	0	0	113.7	V341	V341-D343 VanDerWaalsContact C-N 3.34Å; V341-D343 PolarHBondContact O-N 3.37Å
344	H	71.7	Confident	85.5	Confident	61 Å²	61	40.9 Å²	40.9	28%	0.282	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-95.6	-9.1	178.5	-56.3	86.6	0	0	0	112.4	L18 I19 S310 V341 K342	L18-H344 WeakPolarHBondContact CB-O 3.2Å; L18-H344 HydrophobicContact CD1-CB 4.44Å; I19-H344 WeakPolarHBondContact CG1-O 3.26Å; S310-H344 PolarHBondContact OG-CE1 3.42Å; S310-H344 VanDerWaalsContact OG-CE1 3.25Å; S310-H344 PolarHBondContact OG-ND1 2.84Å; V341-H344 PolarHBondContact O-N 3.03Å; V341-H344 VanDerWaalsContact O-N 3.07Å; K342-H344 PolarHBondContact O-N 3.48Å; K342-H344 VanDerWaalsContact O-N 3.14Å
345	Q	73.6	Confident	85.1	Confident	9 Å²	9	42.8 Å²	42.8	4%	0.042	22%	0.22	C	C	.	.	S	Bend	trans	-103.9	145	-174.4	-63.6	-159.6	-28.8	0	0	113	L18 V259 Y337 V341 K342 L349 Q350	L18-Q345 HydrophobicContact CB-CG 4.49Å; L18-Q345 HydrophobicContact CD1-CG 3.79Å; L18-Q345 HydrophobicContact CD2-CG 3.79Å; L18-Q345 HydrophobicContact CG-CG 4.22Å; V259-Q345 VanDerWaalsContact CG1-NE2 3.31Å; Y337-Q345 VanDerWaalsContact CE2-OE1 3.31Å; Y337-Q345 PolarHBondContact OH-OE1 3.46Å; V341-Q345 VanDerWaalsContact CG1-CD 3.41Å; V341-Q345 HydrophobicContact CG1-CG 3.73Å; V341-Q345 VanDerWaalsContact CG1-NE2 3.33Å; K342-Q345 PolarHBondContact O-N 2.83Å; Q345-L349 HydrophobicContact CB-CB 4.3Å; Q345-Q350 HydrophobicContact CB-CG 4.27Å; Q345-Q350 PolarHBondContact O-NE2 3.21Å
346	S	70.8	Confident	84.8	Confident	25 Å²	25	42 Å²	42	18%	0.175	22%	0.216	C	C	.	.			trans	-62.8	156.1	171.7	57.3	0	0	0	0	110.3	L18 V348 L349 Q350	L18-S346 WeakPolarHBondContact O-CA 3.32Å; L18-S346 WeakPolarHBondContact O-CB 3.43Å; L18-S346 PolarHBondContact O-N 3.47Å; L18-S346 PolarHBondContact O-OG 3.13Å; S346-V348 PolarHBondContact O-N 3.09Å; S346-V348 VanDerWaalsContact O-N 3.08Å; S346-L349 PolarHBondContact O-N 2.88Å; S346-L349 VanDerWaalsContact O-N 3.09Å; S346-Q350 WeakPolarHBondContact O-CG 3.39Å; S346-Q350 PolarHBondContact O-N 2.78Å
347	I	74.2	Confident	84.7	Confident	84 Å²	84	42 Å²	42	43%	0.431	22%	0.216	S	C	.	.	H	α-helix	trans	-52.4	-33.2	174.3	-163.6	62.2	0	0	0	112.3	A151 Q350 Y351	A151-I347 HydrophobicContact CB-CG2 3.74Å; I347-Q350 PolarHBondContact O-N 3.19Å; I347-Y351 HydrophobicContact CD1-CD2 4.12Å; I347-Y351 HydrophobicContact CD1-CE2 3.82Å; I347-Y351 HydrophobicContact CG1-CD2 4.05Å; I347-Y351 HydrophobicContact CG1-CE2 3.87Å; I347-Y351 VanDerWaalsContact O-CD2 3.28Å; I347-Y351 WeakPolarHBondContact O-CD2 3.47Å; I347-Y351 PolarHBondContact O-N 3.43Å
348	V	77.2	Confident	84.5	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.03	25%	0.247	C	C	.	.	H	α-helix	trans	-60	-52.8	178.4	-175.6	0	0	0	0	111.2	I129 A151 F155 S346 Q350 Y351 V352	I129-V348 HydrophobicContact CD1-CG1 3.7Å; I129-V348 HydrophobicContact CG1-CG1 3.91Å; I129-V348 HydrophobicContact CG2-CG1 4.23Å; A151-V348 HydrophobicContact CB-CG2 3.35Å; A151-V348 VanDerWaalsContact O-CG2 3.3Å; A151-V348 WeakPolarHBondContact O-CG2 3.35Å; F155-V348 HydrophobicContact CB-CG1 4.33Å; F155-V348 HydrophobicContact CB-CG2 4.32Å; F155-V348 HydrophobicContact CG-CG1 4.4Å; S346-V348 PolarHBondContact O-N 3.09Å; S346-V348 VanDerWaalsContact O-N 3.08Å; V348-Q350 VanDerWaalsContact C-N 3.33Å; V348-Q350 PolarHBondContact O-N 2.77Å; V348-Y351 PolarHBondContact O-N 2.92Å; V348-V352 WeakPolarHBondContact O-CG2 3.25Å; V348-V352 PolarHBondContact O-N 2.83Å
349	L	84	Confident	84.5	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-70.1	-31.6	-177.3	-63.7	-176.5	0	0	0	112.4	L18 V125 I129 F155 V259 Q345 S346 Y351 V352 F353	L18-L349 HydrophobicContact CD2-CD1 3.32Å; L18-L349 HydrophobicContact CG-CD1 4.47Å; V125-L349 HydrophobicContact CG1-CD2 3.62Å; I129-L349 HydrophobicContact CD1-CD2 4.27Å; F155-L349 HydrophobicContact CE2-CD2 4.22Å; F155-L349 HydrophobicContact CZ-CD2 4.41Å; V259-L349 HydrophobicContact CG1-CB 3.83Å; V259-L349 HydrophobicContact CG1-CD1 4.42Å; V259-L349 HydrophobicContact CG1-CG 4.49Å; V259-L349 HydrophobicContact CG2-CD2 4.29Å; Q345-L349 HydrophobicContact CB-CB 4.3Å; S346-L349 PolarHBondContact O-N 2.88Å; S346-L349 VanDerWaalsContact O-N 3.09Å; L349-Y351 VanDerWaalsContact C-N 3.33Å; L349-Y351 PolarHBondContact O-N 2.97Å; L349-V352 PolarHBondContact O-N 3.41Å; L349-F353 WeakPolarHBondContact O-CB 3.5Å; L349-F353 PolarHBondContact O-N 3.33Å
350	Q	84.2	Confident	84.5	Confident	37 Å²	37	43.7 Å²	43.7	17%	0.173	23%	0.228	C	C	.	.	H	α-helix	trans	-60.1	-41.9	173.1	-67.5	-178.4	34.9	0	0	112.3	Y337 K342 Q345 S346 I347 V348 S354	Y337-Q350 HydrophobicContact CE1-CB 4.44Å; Y337-Q350 HydrophobicContact CE1-CG 4.24Å; Y337-Q350 VanDerWaalsContact OH-CA 3.28Å; Y337-Q350 WeakPolarHBondContact OH-CA 3.38Å; Y337-Q350 WeakPolarHBondContact OH-CG 3.37Å; K342-Q350 VanDerWaalsContact CE-OE1 3.25Å; K342-Q350 HydrophobicContact CG-CG 4.12Å; K342-Q350 PolarHBondContact O-NE2 2.82Å; K342-Q350 VanDerWaalsContact O-NE2 3.15Å; Q345-Q350 HydrophobicContact CB-CG 4.27Å; Q345-Q350 PolarHBondContact O-NE2 3.21Å; S346-Q350 WeakPolarHBondContact O-CG 3.39Å; S346-Q350 PolarHBondContact O-N 2.78Å; I347-Q350 PolarHBondContact O-N 3.19Å; V348-Q350 VanDerWaalsContact C-N 3.33Å; V348-Q350 PolarHBondContact O-N 2.77Å; Q350-S354 WeakPolarHBondContact O-CB 3.47Å; Q350-S354 PolarHBondContact O-N 3.02Å; Q350-S354 PolarHBondContact O-OG 2.67Å
351	Y	83.6	Confident	84.5	Confident	71 Å²	71	45 Å²	45	28%	0.278	24%	0.235	S	C	.	.	H	α-helix	trans	-71.2	-43.2	174.8	-88	-104.3	0	0	0	112	F148 I347 V348 L349 F353 S354 E355	F148-Y351 HydrophobicContact CD1-CD1 4.33Å; F148-Y351 AromaticContact CD2-CD1 3.95Å; F148-Y351 HydrophobicContact CD2-CD1 3.95Å; F148-Y351 AromaticContact CD2-CD2 3.45Å; F148-Y351 HydrophobicContact CD2-CD2 3.45Å; F148-Y351 VanDerWaalsContact CD2-CD2 3.45Å; F148-Y351 HydrophobicContact CD2-CE1 4.29Å; F148-Y351 AromaticContact CD2-CE2 3.82Å; F148-Y351 HydrophobicContact CD2-CE2 3.82Å; F148-Y351 AromaticContact CD2-CG 3.5Å; F148-Y351 HydrophobicContact CD2-CG 3.5Å; F148-Y351 HydrophobicContact CE1-CD1 4.27Å; F148-Y351 HydrophobicContact CE1-CG 4.4Å; F148-Y351 AromaticContact CE2-CD1 3.92Å; F148-Y351 HydrophobicContact CE2-CD1 3.92Å; F148-Y351 AromaticContact CE2-CD2 3.59Å; F148-Y351 HydrophobicContact CE2-CD2 3.59Å; F148-Y351 HydrophobicContact CE2-CE2 4.41Å; F148-Y351 AromaticContact CE2-CG 3.28Å; F148-Y351 HydrophobicContact CE2-CG 3.28Å; F148-Y351 HydrophobicContact CG-CD1 4.16Å; F148-Y351 HydrophobicContact CG-CD2 4.3Å; F148-Y351 HydrophobicContact CG-CE1 4.24Å; F148-Y351 HydrophobicContact CG-CE2 4.36Å; F148-Y351 HydrophobicContact CG-CG 4.18Å; F148-Y351 VanDerWaalsContact CZ-CB 3.41Å; F148-Y351 HydrophobicContact CZ-CD1 4.07Å; F148-Y351 HydrophobicContact CZ-CD2 4.49Å; F148-Y351 AromaticContact CZ-CG 3.77Å; F148-Y351 HydrophobicContact CZ-CG 3.77Å; I347-Y351 HydrophobicContact CD1-CD2 4.12Å; I347-Y351 HydrophobicContact CD1-CE2 3.82Å; I347-Y351 HydrophobicContact CG1-CD2 4.05Å; I347-Y351 HydrophobicContact CG1-CE2 3.87Å; I347-Y351 VanDerWaalsContact O-CD2 3.28Å; I347-Y351 WeakPolarHBondContact O-CD2 3.47Å; I347-Y351 PolarHBondContact O-N 3.43Å; V348-Y351 PolarHBondContact O-N 2.92Å; L349-Y351 VanDerWaalsContact C-N 3.33Å; L349-Y351 PolarHBondContact O-N 2.97Å; Y351-F353 PolarHBondContact O-N 2.7Å; Y351-S354 PolarHBondContact O-N 2.73Å; Y351-S354 VanDerWaalsContact O-N 3.08Å; Y351-E355 WeakPolarHBondContact O-CG 3.29Å; Y351-E355 PolarHBondContact O-N 2.82Å
352	V	86.5	Confident	84.8	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.012	26%	0.259	C	S	.	.	H	α-helix	trans	-55.6	-44.1	177.5	173.8	0	0	0	0	110.8	Q128 I129 L132 V259 V348 L349 S356	Q128-V352 HydrophobicContact CB-CG1 3.86Å; I129-V352 HydrophobicContact CD1-CG2 4.25Å; I129-V352 HydrophobicContact CG1-CG2 3.39Å; L132-V352 HydrophobicContact CD2-CG2 4.42Å; V259-V352 HydrophobicContact CG2-CB 3.92Å; V259-V352 HydrophobicContact CG2-CG1 3.53Å; V348-V352 WeakPolarHBondContact O-CG2 3.25Å; V348-V352 PolarHBondContact O-N 2.83Å; L349-V352 PolarHBondContact O-N 3.41Å; V352-S356 VanDerWaalsContact O-CB 3.31Å; V352-S356 WeakPolarHBondContact O-CB 3.46Å; V352-S356 PolarHBondContact O-N 3.39Å; V352-S356 VanDerWaalsContact O-N 3.12Å; V352-S356 PolarHBondContact O-OG 3.47Å
353	F	91.2	Very high	85.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-62.8	-51.3	174	-176.2	-89.3	0	0	0	111.4	M257 I260 F314 A333 M334 Y337 L349 Y351 E355 S356 V357	M257-F353 HydrophobicContact CE-CD2 4.49Å; M257-F353 HydrophobicContact CE-CE2 3.48Å; M257-F353 VanDerWaalsContact CE-CE2 3.48Å; M257-F353 HydrophobicContact CE-CZ 3.89Å; M257-F353 HydrophobicContact SD-CE2 4.17Å; I260-F353 HydrophobicContact CD1-CD2 4.24Å; I260-F353 HydrophobicContact CD1-CE2 3.62Å; I260-F353 HydrophobicContact CD1-CZ 4.39Å; I260-F353 HydrophobicContact CG1-CD2 4.31Å; I260-F353 HydrophobicContact CG1-CE2 4.18Å; F314-F353 HydrophobicContact CE2-CE2 4.45Å; F314-F353 HydrophobicContact CE2-CZ 4.02Å; F314-F353 HydrophobicContact CZ-CE2 4.48Å; F314-F353 HydrophobicContact CZ-CZ 4.28Å; A333-F353 HydrophobicContact CB-CZ 4.34Å; M334-F353 HydrophobicContact SD-CD1 4.39Å; M334-F353 HydrophobicContact SD-CE1 4.18Å; Y337-F353 AromaticContact CD1-CD1 3.67Å; Y337-F353 HydrophobicContact CD1-CD1 3.67Å; Y337-F353 AromaticContact CD1-CE1 3.98Å; Y337-F353 HydrophobicContact CD1-CE1 3.98Å; Y337-F353 HydrophobicContact CD1-CG 4.35Å; Y337-F353 HydrophobicContact CD2-CB 4.46Å; Y337-F353 AromaticContact CD2-CD1 3.6Å; Y337-F353 HydrophobicContact CD2-CD1 3.6Å; Y337-F353 AromaticContact CD2-CD2 3.82Å; Y337-F353 HydrophobicContact CD2-CD2 3.82Å; Y337-F353 AromaticContact CD2-CE1 3.68Å; Y337-F353 HydrophobicContact CD2-CE1 3.68Å; Y337-F353 AromaticContact CD2-CE2 3.87Å; Y337-F353 HydrophobicContact CD2-CE2 3.87Å; Y337-F353 AromaticContact CD2-CG 3.67Å; Y337-F353 HydrophobicContact CD2-CG 3.67Å; Y337-F353 AromaticContact CD2-CZ 3.81Å; Y337-F353 HydrophobicContact CD2-CZ 3.81Å; Y337-F353 HydrophobicContact CE1-CB 4.45Å; Y337-F353 HydrophobicContact CE1-CD1 4.05Å; Y337-F353 HydrophobicContact CE1-CG 4.38Å; Y337-F353 HydrophobicContact CE2-CB 4.01Å; Y337-F353 AromaticContact CE2-CD1 3.98Å; Y337-F353 HydrophobicContact CE2-CD1 3.98Å; Y337-F353 AromaticContact CE2-CD2 3.98Å; Y337-F353 HydrophobicContact CE2-CD2 3.98Å; Y337-F353 HydrophobicContact CE2-CE2 4.48Å; Y337-F353 AromaticContact CE2-CG 3.7Å; Y337-F353 HydrophobicContact CE2-CG 3.7Å; Y337-F353 AromaticContact CG-CD1 3.44Å; Y337-F353 HydrophobicContact CG-CD1 3.44Å; Y337-F353 VanDerWaalsContact CG-CD1 3.44Å; Y337-F353 HydrophobicContact CG-CD2 4.47Å; Y337-F353 AromaticContact CG-CE1 3.38Å; Y337-F353 HydrophobicContact CG-CE1 3.38Å; Y337-F353 HydrophobicContact CG-CE2 4.41Å; Y337-F353 HydrophobicContact CG-CG 4.02Å; Y337-F353 AromaticContact CG-CZ 3.89Å; Y337-F353 HydrophobicContact CG-CZ 3.89Å; L349-F353 WeakPolarHBondContact O-CB 3.5Å; L349-F353 PolarHBondContact O-N 3.33Å; Y351-F353 PolarHBondContact O-N 2.7Å; F353-E355 VanDerWaalsContact C-N 3.27Å; F353-E355 PolarHBondContact O-N 2.83Å; F353-S356 PolarHBondContact O-N 2.87Å; F353-S356 VanDerWaalsContact O-N 3.11Å; F353-V357 HydrophobicContact CE1-CB 4.23Å; F353-V357 HydrophobicContact CE1-CG2 3.84Å; F353-V357 HydrophobicContact CZ-CG2 4Å; F353-V357 WeakPolarHBondContact O-CB 3.47Å; F353-V357 PolarHBondContact O-N 3.36Å
354	S	89.7	Confident	86.1	Confident	38 Å²	38	46.7 Å²	46.7	27%	0.266	24%	0.239	S	C	.	.	H	α-helix	trans	-58.1	-36.7	-177.7	-58.6	0	0	0	0	113.2	Q350 Y351 V357	Q350-S354 WeakPolarHBondContact O-CB 3.47Å; Q350-S354 PolarHBondContact O-N 3.02Å; Q350-S354 PolarHBondContact O-OG 2.67Å; Y351-S354 PolarHBondContact O-N 2.73Å; Y351-S354 VanDerWaalsContact O-N 3.08Å; S354-V357 VanDerWaalsContact O-CG1 3.3Å; S354-V357 WeakPolarHBondContact O-CG1 3.44Å
355	E	87.9	Confident	87.1	Confident	116 Å²	116	47.9 Å²	47.9	54%	0.542	24%	0.243	S	C	.	.	H	α-helix	trans	-75.8	-36.7	177.5	-69.4	-64.6	125.8	0	0	112.3	L132 Y351 F353	L132-E355 HydrophobicContact CD1-CG 3.82Å; L132-E355 HydrophobicContact CD2-CG 4.08Å; Y351-E355 WeakPolarHBondContact O-CG 3.29Å; Y351-E355 PolarHBondContact O-N 2.82Å; F353-E355 VanDerWaalsContact C-N 3.27Å; F353-E355 PolarHBondContact O-N 2.83Å
356	S	91	Very high	88	Confident	26 Å²	26	47.4 Å²	47.4	18%	0.182	24%	0.241	C	C	.	.	H	α-helix	trans	-84.6	-19.6	-175.2	-50.6	0	0	0	0	112.9	Q128 A256 V352 F353 H358 A359	Q128-S356 PolarHBondContact NE2-OG 2.99Å; A256-S356 WeakPolarHBondContact CB-O 3.4Å; V352-S356 VanDerWaalsContact O-CB 3.31Å; V352-S356 WeakPolarHBondContact O-CB 3.46Å; V352-S356 PolarHBondContact O-N 3.39Å; V352-S356 VanDerWaalsContact O-N 3.12Å; V352-S356 PolarHBondContact O-OG 3.47Å; F353-S356 PolarHBondContact O-N 2.87Å; F353-S356 VanDerWaalsContact O-N 3.11Å; S356-H358 PolarHBondContact O-N 2.81Å; S356-A359 WeakPolarHBondContact O-CB 3.32Å; S356-A359 PolarHBondContact O-N 3.4Å
357	V	93.6	Very high	89	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-58.1	-25.3	-173.1	77.6	0	0	0	0	113.9	S330 A333 M334 F353 S354 A359 V360	S330-V357 PolarHBondContact OG-O 2.95Å; A333-V357 HydrophobicContact CB-CG2 3.64Å; M334-V357 HydrophobicContact CG-CB 4.31Å; M334-V357 HydrophobicContact CG-CG1 3.71Å; M334-V357 HydrophobicContact CG-CG2 3.91Å; M334-V357 HydrophobicContact SD-CB 4.21Å; M334-V357 HydrophobicContact SD-CG1 3.73Å; M334-V357 HydrophobicContact SD-CG2 4.24Å; F353-V357 HydrophobicContact CE1-CB 4.23Å; F353-V357 HydrophobicContact CE1-CG2 3.84Å; F353-V357 HydrophobicContact CZ-CG2 4Å; F353-V357 WeakPolarHBondContact O-CB 3.47Å; F353-V357 PolarHBondContact O-N 3.36Å; S354-V357 VanDerWaalsContact O-CG1 3.3Å; S354-V357 WeakPolarHBondContact O-CG1 3.44Å; V357-A359 PolarHBondContact O-N 3.1Å; V357-V360 HydrophobicContact CG2-CG2 4.3Å; V357-V360 WeakPolarHBondContact O-CB 3.22Å; V357-V360 WeakPolarHBondContact O-CG2 3.28Å; V357-V360 PolarHBondContact O-N 2.97Å
358	H	91.8	Very high	89.7	Confident	143 Å²	143	44.3 Å²	44.3	66%	0.662	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-68.2	-14.1	178.9	-61.3	-59.4	0	0	0	113.7	S356 V360	S356-H358 PolarHBondContact O-N 2.81Å; H358-V360 VanDerWaalsContact C-N 3.32Å
359	A	92.7	Very high	90.3	Very high	58 Å²	58	46.1 Å²	46.1	48%	0.479	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-85.3	-1.9	176.9	0	0	0	0	0	113.5	S356 V357 N361	S356-A359 WeakPolarHBondContact O-CB 3.32Å; S356-A359 PolarHBondContact O-N 3.4Å; V357-A359 PolarHBondContact O-N 3.1Å; A359-N361 PolarHBondContact O-N 3.49Å
360	V	94.6	Very high	90.7	Very high	14 Å²	14	46.1 Å²	46.1	9%	0.085	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-56.6	137.5	-177.3	171.4	0	0	0	0	111.7	I252 D253 A256 M257 P329 A333 V357 H358 I366	I252-V360 HydrophobicContact CG2-CG1 3.9Å; I252-V360 HydrophobicContact CG2-CG2 4.39Å; D253-V360 HydrophobicContact CB-CG2 4.33Å; A256-V360 HydrophobicContact CB-CG2 4.04Å; M257-V360 HydrophobicContact CE-CG2 3.84Å; P329-V360 HydrophobicContact CB-CG1 3.59Å; A333-V360 HydrophobicContact CB-CG2 4.29Å; V357-V360 HydrophobicContact CG2-CG2 4.3Å; V357-V360 WeakPolarHBondContact O-CB 3.22Å; V357-V360 WeakPolarHBondContact O-CG2 3.28Å; V357-V360 PolarHBondContact O-N 2.97Å; H358-V360 VanDerWaalsContact C-N 3.32Å; V360-I366 HydrophobicContact CG1-CD1 4.33Å
361	N	94.5	Very high	90.9	Very high	38 Å²	38	45.3 Å²	45.3	20%	0.203	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-59.8	148.2	-178.9	-73	-50.2	0	0	0	112	V251 I252 P329 A359 F365 I366	V251-N361 PolarHBondContact O-ND2 2.99Å; I252-N361 WeakPolarHBondContact O-CB 3.4Å; I252-N361 PolarHBondContact O-N 3.27Å; I252-N361 PolarHBondContact O-ND2 3.41Å; I252-N361 VanDerWaalsContact O-ND2 3.14Å; P329-N361 WeakPolarHBondContact CB-O 3.43Å; P329-N361 WeakPolarHBondContact CG-O 3.46Å; A359-N361 PolarHBondContact O-N 3.49Å; N361-F365 HydrophobicContact CB-CB 4.28Å; N361-F365 HydrophobicContact CB-CD1 3.55Å; N361-F365 HydrophobicContact CB-CE1 4.23Å; N361-F365 HydrophobicContact CB-CG 4.16Å; N361-F365 VanDerWaalsContact CG-CD1 3.48Å; N361-F365 WeakPolarHBondContact ND2-CE1 3.27Å; N361-I366 HydrophobicContact CB-CD1 4.46Å; N361-I366 HydrophobicContact CB-CG1 3.94Å; N361-I366 VanDerWaalsContact O-CD1 3.26Å; N361-I366 WeakPolarHBondContact O-CD1 3.17Å
362	N	93.5	Very high	90.6	Very high	98 Å²	98	45 Å²	45	52%	0.524	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-65	156.5	177.2	67.7	64.3	0	0	0	112.3	K364 F365 I366	N362-K364 VanDerWaalsContact C-N 3.25Å; N362-K364 PolarHBondContact O-N 3.25Å; N362-K364 VanDerWaalsContact O-N 3.14Å; N362-K364 PolarHBondContact OD1-N 2.97Å; N362-F365 WeakPolarHBondContact O-CB 3.43Å; N362-F365 PolarHBondContact O-N 3.05Å; N362-F365 WeakPolarHBondContact OD1-CB 3.5Å; N362-F365 PolarHBondContact OD1-N 2.99Å; N362-I366 PolarHBondContact O-N 3.18Å
363	R	92.3	Very high	89.3	Confident	40 Å²	40	52.5 Å²	52.5	15%	0.151	27%	0.265	C	S	.	.	H	α-helix	trans	-53.2	-39.6	-175.4	-172.8	175.3	-178	-106.9	0.6	113.2	L322 P329 A367 E387 F390	L322-R363 HydrophobicContact CD2-CG 4.36Å; L322-R363 PolarHBondContact O-NE 3.22Å; L322-R363 VanDerWaalsContact O-NE 3.16Å; L322-R363 PolarHBondContact O-NH2 2.68Å; P329-R363 HydrophobicContact CG-CB 4.09Å; R363-A367 WeakPolarHBondContact O-CB 3.48Å; R363-A367 PolarHBondContact O-N 2.87Å; R363-E387 IonicContact CZ-OE1 3.3Å; R363-E387 VanDerWaalsContact CZ-OE1 3.3Å; R363-E387 IonicContact NH1-OE1 2.87Å; R363-E387 PolarHBondContact NH1-OE1 2.79Å; R363-E387 IonicContact NH2-OE1 2.78Å; R363-E387 PolarHBondContact NH2-OE1 2.95Å; R363-F390 HydrophobicContact CG-CE2 3.71Å; R363-F390 HydrophobicContact CG-CZ 3.94Å
364	K	90.1	Very high	87.3	Confident	115 Å²	115	54.6 Å²	54.6	50%	0.5	29%	0.286	S	S	.	.	H	α-helix	trans	-68.5	-41.4	179.6	-174.5	177.4	-179.7	-178.8	0	111.9	N362 T368	N362-K364 VanDerWaalsContact C-N 3.25Å; N362-K364 PolarHBondContact O-N 3.25Å; N362-K364 VanDerWaalsContact O-N 3.14Å; N362-K364 PolarHBondContact OD1-N 2.97Å; K364-T368 WeakPolarHBondContact O-CB 3.26Å; K364-T368 PolarHBondContact O-N 3.49Å; K364-T368 PolarHBondContact O-OG1 3.21Å
365	F	91.4	Very high	85.1	Confident	86 Å²	86	62.3 Å²	62.3	38%	0.377	32%	0.318	S	S	.	.	H	α-helix	trans	-63.4	-46.3	176.6	-177	-83.1	0	0	0	111.1	N361 N362 T368 N369	N361-F365 HydrophobicContact CB-CB 4.28Å; N361-F365 HydrophobicContact CB-CD1 3.55Å; N361-F365 HydrophobicContact CB-CE1 4.23Å; N361-F365 HydrophobicContact CB-CG 4.16Å; N361-F365 VanDerWaalsContact CG-CD1 3.48Å; N361-F365 WeakPolarHBondContact ND2-CE1 3.27Å; N362-F365 WeakPolarHBondContact O-CB 3.43Å; N362-F365 PolarHBondContact O-N 3.05Å; N362-F365 WeakPolarHBondContact OD1-CB 3.5Å; N362-F365 PolarHBondContact OD1-N 2.99Å; F365-T368 PolarHBondContact O-N 3.25Å; F365-N369 WeakPolarHBondContact CD1-ND2 3.26Å; F365-N369 WeakPolarHBondContact CD2-ND2 3.5Å; F365-N369 HydrophobicContact CE1-CB 4.33Å; F365-N369 VanDerWaalsContact CE1-ND2 3.32Å; F365-N369 WeakPolarHBondContact CE1-ND2 3.47Å; F365-N369 VanDerWaalsContact CE2-ND2 3.35Å; F365-N369 WeakPolarHBondContact CE2-ND2 3.32Å; F365-N369 VanDerWaalsContact CZ-ND2 3.28Å; F365-N369 WeakPolarHBondContact CZ-ND2 3.31Å; F365-N369 PolarHBondContact O-N 2.78Å; F365-N369 PolarHBondContact O-ND2 3.15Å
366	I	93.6	Very high	82.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-58	-52.8	177.5	-65.4	174.3	0	0	0	109.8	V251 F318 F319 P329 V360 N361 N362 T368 N369 L370 F390	V251-I366 HydrophobicContact CG1-CG2 4.4Å; F318-I366 HydrophobicContact CE1-CD1 4.33Å; F318-I366 HydrophobicContact CZ-CD1 3.88Å; F319-I366 HydrophobicContact CE1-CG2 4.4Å; P329-I366 HydrophobicContact CB-CD1 4.07Å; P329-I366 HydrophobicContact CG-CD1 4.33Å; V360-I366 HydrophobicContact CG1-CD1 4.33Å; N361-I366 HydrophobicContact CB-CD1 4.46Å; N361-I366 HydrophobicContact CB-CG1 3.94Å; N361-I366 VanDerWaalsContact O-CD1 3.26Å; N361-I366 WeakPolarHBondContact O-CD1 3.17Å; N362-I366 PolarHBondContact O-N 3.18Å; I366-T368 VanDerWaalsContact C-N 3.26Å; I366-T368 PolarHBondContact O-N 3.42Å; I366-N369 PolarHBondContact O-N 3.18Å; I366-L370 HydrophobicContact CG2-CD1 3.78Å; I366-L370 HydrophobicContact CG2-CG 4.23Å; I366-L370 VanDerWaalsContact O-CG 3.28Å; I366-L370 WeakPolarHBondContact O-CG 3.13Å; I366-L370 PolarHBondContact O-N 3.47Å; I366-F390 HydrophobicContact CG2-CE1 4.23Å
367	A	91.2	Very high	80.3	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-57.2	-39.4	179.5	0	0	0	0	0	112.9	R363 A386 L389 F390	R363-A367 WeakPolarHBondContact O-CB 3.48Å; R363-A367 PolarHBondContact O-N 2.87Å; A367-A386 HydrophobicContact CB-CB 3.85Å; A367-L389 HydrophobicContact CB-CD2 4.09Å; A367-L389 WeakPolarHBondContact O-CD2 3.39Å; A367-F390 HydrophobicContact CB-CE1 4.23Å; A367-F390 HydrophobicContact CB-CZ 3.85Å
368	T	89.2	Confident	77.8	Confident	44 Å²	44	76.5 Å²	76.5	27%	0.27	39%	0.386	S	S	.	.	H	α-helix	trans	-72.6	-36.8	-177.7	-54.5	0	0	0	0	112.5	K364 F365 I366	K364-T368 WeakPolarHBondContact O-CB 3.26Å; K364-T368 PolarHBondContact O-N 3.49Å; K364-T368 PolarHBondContact O-OG1 3.21Å; F365-T368 PolarHBondContact O-N 3.25Å; I366-T368 VanDerWaalsContact C-N 3.26Å; I366-T368 PolarHBondContact O-N 3.42Å
369	N	90.7	Very high	75.4	Confident	43 Å²	43	78.1 Å²	78.1	23%	0.23	39%	0.394	C	S	.	.	H	α-helix	trans	-94	-8.1	-174.9	-67.7	-77	0	0	0	113.9	V251 F365 I366 I371	V251-N369 HydrophobicContact CG1-CB 3.87Å; V251-N369 HydrophobicContact CG2-CB 4.25Å; F365-N369 WeakPolarHBondContact CD1-ND2 3.26Å; F365-N369 WeakPolarHBondContact CD2-ND2 3.5Å; F365-N369 HydrophobicContact CE1-CB 4.33Å; F365-N369 VanDerWaalsContact CE1-ND2 3.32Å; F365-N369 WeakPolarHBondContact CE1-ND2 3.47Å; F365-N369 VanDerWaalsContact CE2-ND2 3.35Å; F365-N369 WeakPolarHBondContact CE2-ND2 3.32Å; F365-N369 VanDerWaalsContact CZ-ND2 3.28Å; F365-N369 WeakPolarHBondContact CZ-ND2 3.31Å; F365-N369 PolarHBondContact O-N 2.78Å; F365-N369 PolarHBondContact O-ND2 3.15Å; I366-N369 PolarHBondContact O-N 3.18Å; N369-I371 VanDerWaalsContact C-N 3.32Å
370	L	91.3	Very high	73	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-72.1	-27.9	167.6	-76.6	172.5	0	0	0	112.8	N214 L215 V216 I248 V251 F319 I366 L389 F390	N214-L370 CarbonylContact C-O 3.47Å; N214-L370 VanDerWaalsContact CA-O 3.23Å; N214-L370 WeakPolarHBondContact CA-O 3.37Å; N214-L370 VanDerWaalsContact CB-O 3.29Å; N214-L370 WeakPolarHBondContact CB-O 3.48Å; L215-L370 PolarHBondContact N-O 3.31Å; V216-L370 HydrophobicContact CG2-CD2 4.18Å; I248-L370 HydrophobicContact CG2-CD2 4.41Å; V251-L370 HydrophobicContact CB-CD2 4.3Å; V251-L370 HydrophobicContact CG1-CD2 3.99Å; V251-L370 HydrophobicContact CG1-CG 3.92Å; F319-L370 HydrophobicContact CE1-CD1 3.51Å; F319-L370 HydrophobicContact CZ-CD1 3.67Å; F319-L370 HydrophobicContact CZ-CD2 4.22Å; I366-L370 HydrophobicContact CG2-CD1 3.78Å; I366-L370 HydrophobicContact CG2-CG 4.23Å; I366-L370 VanDerWaalsContact O-CG 3.28Å; I366-L370 WeakPolarHBondContact O-CG 3.13Å; I366-L370 PolarHBondContact O-N 3.47Å; L370-L389 HydrophobicContact CB-CD2 4.4Å; L370-F390 HydrophobicContact CD1-CE1 4.34Å
371	I	88.9	Confident	70.7	Confident	19 Å²	19	83.5 Å²	83.5	10%	0.097	42%	0.42	C	S	.	.	B	Isolated β-bridge	trans	-79.5	132.2	-179.6	-61.1	173.3	0	0	0	108.9	L209 Q212 N369 K373 L389	L209-I371 HydrophobicContact CD2-CD1 4.48Å; Q212-I371 HydrophobicContact CB-CG2 3.85Å; N369-I371 VanDerWaalsContact C-N 3.32Å; I371-K373 PolarHBondContact O-N 3.19Å; I371-K373 VanDerWaalsContact O-N 3.14Å; I371-L389 HydrophobicContact CD1-CD2 4.31Å; I371-L389 HydrophobicContact CG1-CD1 4.4Å; I371-L389 HydrophobicContact CG1-CD2 4.14Å
372	H	76.4	Confident	68.5	Low	64 Å²	64	88.5 Å²	88.5	30%	0.296	44%	0.44	S	S	.	.			trans	-61.4	118.9	174.1	-69.6	93.1	0	0	0	110	P213 N214 E218 G374	P213-H372 VanDerWaalsContact C-ND1 3.33Å; P213-H372 PolarHBondContact O-N 3.43Å; P213-H372 VanDerWaalsContact O-N 3.13Å; P213-H372 PolarHBondContact O-ND1 2.6Å; N214-H372 VanDerWaalsContact C-CE1 3.47Å; E218-H372 IonicContact OE2-CE1 3.43Å; E218-H372 PolarHBondContact OE2-CE1 3.43Å; E218-H372 IonicContact OE2-NE2 3.12Å; E218-H372 PolarHBondContact OE2-NE2 3.02Å; E218-H372 VanDerWaalsContact OE2-NE2 3.12Å; H372-G374 VanDerWaalsContact C-N 3.34Å; H372-G374 PolarHBondContact O-N 3.24Å
373	K	60	Low	66.5	Low	161 Å²	161	85.4 Å²	85.4	70%	0.7	43%	0.425	S	S	*	.			trans	-69	94	171.1	-68.7	-179.2	-175.5	168.5	0	108.4	I371	I371-K373 PolarHBondContact O-N 3.19Å; I371-K373 VanDerWaalsContact O-N 3.14Å
374	G	49.4	Very low	64.9	Low	43 Å²	43	87.2 Å²	87.2	44%	0.443	45%	0.448	S	S	.	.			trans	-55.5	139.5	166.7	0	0	0	0	0	109.8	H372 D376 N377	H372-G374 VanDerWaalsContact C-N 3.34Å; H372-G374 PolarHBondContact O-N 3.24Å; G374-D376 PolarHBondContact O-N 3.05Å; G374-N377 PolarHBondContact O-N 2.93Å
375	Q	42.3	Very low	64	Low	200 Å²	200	89.2 Å²	89.2	94%	0.935	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-17.8	-172.8	-76.4	-176.8	-47.4	0	0	114.6
376	D	38.7	Very low	63.6	Low	155 Å²	155	85.8 Å²	85.8	83%	0.829	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	0.7	-173.9	-70.9	-38	0	0	0	116.2	G374 K378	G374-D376 PolarHBondContact O-N 3.05Å; D376-K378 PolarHBondContact O-N 2.81Å; D376-K378 VanDerWaalsContact O-N 3.12Å
377	N	39.8	Very low	63.3	Low	87 Å²	87	88.4 Å²	88.4	47%	0.465	46%	0.457	S	S	.	.			trans	-92.5	66	-176	-81.3	-17	0	0	0	113.3	G374 H379	G374-N377 PolarHBondContact O-N 2.93Å; N377-H379 PolarHBondContact O-N 3.36Å
378	K	42.4	Very low	63.2	Low	198 Å²	198	91.2 Å²	91.2	86%	0.861	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-5.6	166.7	-78.4	-174.4	177.8	177.8	0	113.9	D376	D376-K378 PolarHBondContact O-N 2.81Å; D376-K378 VanDerWaalsContact O-N 3.12Å
379	H	39.9	Very low	63.3	Low	178 Å²	178	89.8 Å²	89.8	82%	0.824	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.8	38.5	178.8	-66.2	-47.5	0	0	0	113.1	N377 N381	N377-H379 PolarHBondContact O-N 3.36Å; H379-N381 PolarHBondContact O-N 3.35Å
380	S	44.1	Very low	63.4	Low	72 Å²	72	87.7 Å²	87.7	50%	0.503	46%	0.455	S	S	.	.			trans	-63.9	103.3	171.4	56.9	0	0	0	0	109.3	F382	S380-F382 PolarHBondContact O-N 3.09Å
381	N	45.2	Very low	63.5	Low	113 Å²	113	90.8 Å²	90.8	60%	0.604	47%	0.471	S	S	*	.			trans	-39.4	125.4	163.4	-89.3	-29	0	0	0	108.8	H379	H379-N381 PolarHBondContact O-N 3.35Å
382	F	49.1	Very low	63.7	Low	142 Å²	142	91 Å²	91	62%	0.623	48%	0.476	S	S	*	.			trans	-47.4	143	174	-81.2	-79.7	0	0	0	109.7	S380 A384	S380-F382 PolarHBondContact O-N 3.09Å; F382-A384 PolarHBondContact O-N 3.26Å
383	P	51.5	Low	64.6	Low	33 Å²	33	88 Å²	88	21%	0.214	46%	0.461	C	S	.	.			trans	-53.9	118.6	-177.8	19.8	-30.6	0	0	0	109.9	L209 K385	L209-P383 VanDerWaalsContact CD1-CA 3.47Å; L209-P383 HydrophobicContact CD1-CB 3.74Å; P383-K385 PolarHBondContact O-N 3.36Å; P383-K385 VanDerWaalsContact O-N 3.12Å
384	A	58.6	Low	66.4	Low	78 Å²	78	83.1 Å²	83.1	65%	0.645	44%	0.439	S	S	*	.	S	Bend	trans	-56.6	-30.9	-179.3	0	0	0	0	0	110.4	F382	F382-A384 PolarHBondContact O-N 3.26Å
385	K	71.4	Confident	68.6	Low	158 Å²	158	85 Å²	85	69%	0.687	44%	0.438	S	S	*	.			trans	-154	132.4	173.7	-72.7	-165.4	178	172.1	0	109.8	P383 E387 P388	P383-K385 PolarHBondContact O-N 3.36Å; P383-K385 VanDerWaalsContact O-N 3.12Å; K385-E387 WeakPolarHBondContact CA-OE2 3.25Å; K385-E387 WeakPolarHBondContact CB-OE2 3.48Å; K385-P388 WeakPolarHBondContact O-CD 3.31Å
386	A	82.9	Confident	71.2	Confident	13 Å²	13	76.4 Å²	76.4	11%	0.107	40%	0.399	C	S	.	.	S	Bend	trans	-84.9	-16.4	179.3	0	0	0	0	0	112.5	A367 L389 F390	A367-A386 HydrophobicContact CB-CB 3.85Å; A386-L389 WeakPolarHBondContact O-CB 3.39Å; A386-L389 PolarHBondContact O-N 3.14Å; A386-F390 HydrophobicContact CB-CD2 4.24Å; A386-F390 HydrophobicContact CB-CE2 3.65Å; A386-F390 HydrophobicContact CB-CZ 4.15Å; A386-F390 WeakPolarHBondContact O-CD2 3.23Å; A386-F390 PolarHBondContact O-N 2.99Å
387	E	86.6	Confident	74.1	Confident	56 Å²	56	69 Å²	69	26%	0.262	36%	0.36	S	S	.	.	H	α-helix	trans	-58.6	-44.6	-174.6	-63.2	67.6	-151.6	0	0	113.1	R363 K385 L389 F390 D391	R363-E387 IonicContact CZ-OE1 3.3Å; R363-E387 VanDerWaalsContact CZ-OE1 3.3Å; R363-E387 IonicContact NH1-OE1 2.87Å; R363-E387 PolarHBondContact NH1-OE1 2.79Å; R363-E387 IonicContact NH2-OE1 2.78Å; R363-E387 PolarHBondContact NH2-OE1 2.95Å; K385-E387 WeakPolarHBondContact CA-OE2 3.25Å; K385-E387 WeakPolarHBondContact CB-OE2 3.48Å; E387-L389 VanDerWaalsContact C-N 3.28Å; E387-L389 PolarHBondContact O-N 3.33Å; E387-F390 PolarHBondContact O-N 2.82Å; E387-D391 PolarHBondContact O-N 3.29Å
388	P	88.7	Confident	76.9	Confident	58 Å²	58	66.7 Å²	66.7	38%	0.377	35%	0.349	S	S	.	.	H	α-helix	trans	-63.8	-33.2	178.5	-21.4	34.5	0	0	0	113.1	K385 A392	K385-P388 WeakPolarHBondContact O-CD 3.31Å; P388-A392 PolarHBondContact O-N 2.82Å
389	L	90.9	Very high	79.5	Confident	14 Å²	14	61.7 Å²	61.7	7%	0.073	33%	0.328	C	S	.	.	H	α-helix	trans	-66.9	-46.9	177.2	175.7	68	0	0	0	110.6	N214 A367 L370 I371 A386 E387 D391 A392 C393	N214-L389 HydrophobicContact CB-CD1 4Å; A367-L389 HydrophobicContact CB-CD2 4.09Å; A367-L389 WeakPolarHBondContact O-CD2 3.39Å; L370-L389 HydrophobicContact CB-CD2 4.4Å; I371-L389 HydrophobicContact CD1-CD2 4.31Å; I371-L389 HydrophobicContact CG1-CD1 4.4Å; I371-L389 HydrophobicContact CG1-CD2 4.14Å; A386-L389 WeakPolarHBondContact O-CB 3.39Å; A386-L389 PolarHBondContact O-N 3.14Å; E387-L389 VanDerWaalsContact C-N 3.28Å; E387-L389 PolarHBondContact O-N 3.33Å; L389-D391 VanDerWaalsContact C-N 3.31Å; L389-D391 PolarHBondContact O-N 3.31Å; L389-A392 PolarHBondContact O-N 2.75Å; L389-C393 PolarHBondContact O-N 3.43Å; L389-C393 PolarHBondContact O-SG 2.87Å
390	F	93.9	Very high	82.3	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-66.6	-34.1	179.1	-60.2	-38.8	0	0	0	112.3	F319 L322 R323 R363 I366 A367 L370 A386 E387 C393 Y394	F319-F390 AromaticContact CD1-CD1 3.75Å; F319-F390 HydrophobicContact CD1-CD1 3.75Å; F319-F390 HydrophobicContact CD1-CE1 4.37Å; F319-F390 AromaticContact CE1-CD1 3.94Å; F319-F390 HydrophobicContact CE1-CD1 3.94Å; F319-F390 HydrophobicContact CE1-CE1 4.17Å; L322-F390 HydrophobicContact CB-CD2 4.15Å; L322-F390 HydrophobicContact CB-CE2 4.38Å; L322-F390 HydrophobicContact CB-CG 4.26Å; L322-F390 HydrophobicContact CD1-CE1 4.22Å; L322-F390 HydrophobicContact CD1-CZ 4.36Å; L322-F390 WeakPolarHBondContact O-CD2 3.4Å; R323-F390 HydrophobicContact CG-CB 4.01Å; R363-F390 HydrophobicContact CG-CE2 3.71Å; R363-F390 HydrophobicContact CG-CZ 3.94Å; I366-F390 HydrophobicContact CG2-CE1 4.23Å; A367-F390 HydrophobicContact CB-CE1 4.23Å; A367-F390 HydrophobicContact CB-CZ 3.85Å; L370-F390 HydrophobicContact CD1-CE1 4.34Å; A386-F390 HydrophobicContact CB-CD2 4.24Å; A386-F390 HydrophobicContact CB-CE2 3.65Å; A386-F390 HydrophobicContact CB-CZ 4.15Å; A386-F390 WeakPolarHBondContact O-CD2 3.23Å; A386-F390 PolarHBondContact O-N 2.99Å; E387-F390 PolarHBondContact O-N 2.82Å; F390-C393 PolarHBondContact O-N 2.9Å; F390-Y394 WeakPolarHBondContact O-CB 3.18Å; F390-Y394 PolarHBondContact O-N 2.87Å
391	D	93.2	Very high	84.8	Confident	65 Å²	65	50.2 Å²	50.2	35%	0.348	27%	0.268	S	S	.	.	H	α-helix	trans	-64.2	-44.7	173.1	-161.1	51.6	0	0	0	112	R323 E387 L389 C393 Y394 I395	R323-D391 IonicContact CZ-OD1 3.06Å; R323-D391 IonicContact NH1-OD1 3.9Å; R323-D391 PolarHBondContact NH1-OD1 2.97Å; E387-D391 PolarHBondContact O-N 3.29Å; L389-D391 VanDerWaalsContact C-N 3.31Å; L389-D391 PolarHBondContact O-N 3.31Å; D391-C393 VanDerWaalsContact C-N 3.35Å; D391-C393 PolarHBondContact O-N 3.45Å; D391-Y394 PolarHBondContact O-N 2.71Å; D391-I395 VanDerWaalsContact O-CG1 3.3Å; D391-I395 WeakPolarHBondContact O-CG1 3.45Å; D391-I395 PolarHBondContact O-N 3.5Å
392	A	92.7	Very high	87.3	Confident	23 Å²	23	50 Å²	50	19%	0.19	27%	0.266	C	S	.	.	H	α-helix	trans	-61.3	-41.2	174.1	0	0	0	0	0	112.5	P388 L389 I395 T396	P388-A392 PolarHBondContact O-N 2.82Å; L389-A392 PolarHBondContact O-N 2.75Å; A392-I395 PolarHBondContact O-N 2.86Å; A392-T396 WeakPolarHBondContact O-CB 3.28Å; A392-T396 PolarHBondContact O-N 3.41Å; A392-T396 PolarHBondContact O-OG1 3.12Å
393	C	95.6	Very high	89.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-49.3	174.8	-66.6	0	0	0	0	111.1	V216 F319 L389 F390 D391 I395 T396 L397	V216-C393 HydrophobicContact CB-CB 4.17Å; V216-C393 HydrophobicContact CG1-CB 3.96Å; V216-C393 HydrophobicContact CG2-CB 4.14Å; F319-C393 HydrophobicContact CB-CB 4.2Å; F319-C393 HydrophobicContact CD1-CB 3.92Å; F319-C393 HydrophobicContact CD2-CB 4.2Å; F319-C393 HydrophobicContact CE1-CB 4.38Å; F319-C393 HydrophobicContact CG-CB 3.83Å; L389-C393 PolarHBondContact O-N 3.43Å; L389-C393 PolarHBondContact O-SG 2.87Å; F390-C393 PolarHBondContact O-N 2.9Å; D391-C393 VanDerWaalsContact C-N 3.35Å; D391-C393 PolarHBondContact O-N 3.45Å; C393-I395 PolarHBondContact O-N 3.17Å; C393-T396 PolarHBondContact O-N 2.87Å; C393-L397 WeakPolarHBondContact O-CB 2.99Å; C393-L397 WeakPolarHBondContact O-CD1 3.24Å; C393-L397 VanDerWaalsContact O-CG 3.27Å; C393-L397 WeakPolarHBondContact O-CG 2.79Å; C393-L397 PolarHBondContact O-N 2.85Å
394	Y	96.9	Very high	91.7	Very high	60 Å²	60	44.3 Å²	44.3	24%	0.235	24%	0.236	C	C	.	.	H	α-helix	trans	-59.1	-46.3	178.5	170.1	-103.4	0	0	0	112.3	Q316 D320 F390 D391 T396 L397 T398	Q316-Y394 HydrophobicContact CG-CD2 3.88Å; Q316-Y394 HydrophobicContact CG-CE2 3.84Å; D320-Y394 HydrophobicContact CB-CD2 3.65Å; D320-Y394 HydrophobicContact CB-CE2 3.79Å; F390-Y394 WeakPolarHBondContact O-CB 3.18Å; F390-Y394 PolarHBondContact O-N 2.87Å; D391-Y394 PolarHBondContact O-N 2.71Å; Y394-T396 VanDerWaalsContact C-N 3.35Å; Y394-T396 PolarHBondContact O-N 2.92Å; Y394-L397 PolarHBondContact O-N 2.7Å; Y394-T398 WeakPolarHBondContact O-CB 3.32Å; Y394-T398 PolarHBondContact O-N 2.88Å; Y394-T398 PolarHBondContact O-OG1 3.44Å
395	I	96.7	Very high	93.5	Very high	81 Å²	81	43.2 Å²	43.2	42%	0.415	22%	0.22	S	C	.	.	H	α-helix	trans	-60.8	-45.9	178.6	-69.2	165.7	0	0	0	110.5	D391 A392 C393 T398 Q399	D391-I395 VanDerWaalsContact O-CG1 3.3Å; D391-I395 WeakPolarHBondContact O-CG1 3.45Å; D391-I395 PolarHBondContact O-N 3.5Å; A392-I395 PolarHBondContact O-N 2.86Å; C393-I395 PolarHBondContact O-N 3.17Å; I395-T398 WeakPolarHBondContact O-CB 3.42Å; I395-T398 PolarHBondContact O-N 3.35Å; I395-Q399 PolarHBondContact O-N 2.74Å; I395-Q399 VanDerWaalsContact O-N 3.12Å
396	T	97.2	Very high	94.6	Very high	20 Å²	20	37.6 Å²	37.6	12%	0.123	20%	0.203	C	C	.	.	H	α-helix	trans	-62.3	-45.7	179.5	-59.5	0	0	0	0	111.6	V216 A392 C393 Y394 T398 Q399 C400	V216-T396 HydrophobicContact CG1-CG2 4.34Å; V216-T396 WeakPolarHBondContact O-CG2 3.33Å; A392-T396 WeakPolarHBondContact O-CB 3.28Å; A392-T396 PolarHBondContact O-N 3.41Å; A392-T396 PolarHBondContact O-OG1 3.12Å; C393-T396 PolarHBondContact O-N 2.87Å; Y394-T396 VanDerWaalsContact C-N 3.35Å; Y394-T396 PolarHBondContact O-N 2.92Å; T396-T398 VanDerWaalsContact C-N 3.31Å; T396-T398 PolarHBondContact O-N 3.02Å; T396-Q399 WeakPolarHBondContact O-CB 3.27Å; T396-Q399 PolarHBondContact O-N 2.91Å; T396-C400 PolarHBondContact O-N 2.64Å; T396-C400 VanDerWaalsContact O-N 3.09Å; T396-C400 PolarHBondContact O-SG 2.99Å
397	L	98.3	Very high	95.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.2	-36.5	178.1	-70.8	160.7	0	0	0	111.7	V216 F219 V312 L315 Q316 F319 C393 Y394 Q399 C400 V401	V216-L397 HydrophobicContact CG1-CD1 3.91Å; V216-L397 HydrophobicContact CG1-CD2 4.19Å; V216-L397 HydrophobicContact CG1-CG 3.72Å; F219-L397 HydrophobicContact CD1-CD2 4.07Å; F219-L397 HydrophobicContact CE1-CD2 3.79Å; V312-L397 HydrophobicContact CG1-CD2 4.01Å; L315-L397 HydrophobicContact CB-CD1 3.91Å; L315-L397 HydrophobicContact CB-CD2 3.85Å; L315-L397 HydrophobicContact CD1-CD2 4.29Å; Q316-L397 HydrophobicContact CB-CB 3.89Å; Q316-L397 HydrophobicContact CG-CB 4.16Å; F319-L397 HydrophobicContact CB-CD1 4.35Å; F319-L397 HydrophobicContact CD2-CD1 3.44Å; F319-L397 VanDerWaalsContact CD2-CD1 3.44Å; F319-L397 HydrophobicContact CE2-CD1 4.18Å; F319-L397 HydrophobicContact CG-CD1 4.25Å; C393-L397 WeakPolarHBondContact O-CB 2.99Å; C393-L397 WeakPolarHBondContact O-CD1 3.24Å; C393-L397 VanDerWaalsContact O-CG 3.27Å; C393-L397 WeakPolarHBondContact O-CG 2.79Å; C393-L397 PolarHBondContact O-N 2.85Å; Y394-L397 PolarHBondContact O-N 2.7Å; L397-Q399 VanDerWaalsContact C-N 3.32Å; L397-Q399 PolarHBondContact O-N 3.47Å; L397-C400 WeakPolarHBondContact O-CB 3.49Å; L397-C400 PolarHBondContact O-N 3.38Å; L397-C400 VanDerWaalsContact O-N 3.13Å; L397-V401 WeakPolarHBondContact O-CG2 3.38Å; L397-V401 PolarHBondContact O-N 3.01Å
398	T	98.4	Very high	95.3	Very high	38 Å²	38	35.1 Å²	35.1	23%	0.233	19%	0.19	C	C	.	.	H	α-helix	trans	-59.2	-43.4	174	-58.2	0	0	0	0	111.5	Q316 Y394 I395 T396 C400 V401 L402	Q316-T398 PolarHBondContact NE2-OG1 2.77Å; Y394-T398 WeakPolarHBondContact O-CB 3.32Å; Y394-T398 PolarHBondContact O-N 2.88Å; Y394-T398 PolarHBondContact O-OG1 3.44Å; I395-T398 WeakPolarHBondContact O-CB 3.42Å; I395-T398 PolarHBondContact O-N 3.35Å; T396-T398 VanDerWaalsContact C-N 3.31Å; T396-T398 PolarHBondContact O-N 3.02Å; T398-C400 VanDerWaalsContact C-N 3.34Å; T398-C400 PolarHBondContact O-N 3.25Å; T398-V401 PolarHBondContact O-N 3.49Å; T398-L402 WeakPolarHBondContact O-CG 3.5Å; T398-L402 PolarHBondContact O-N 3.29Å; T398-L402 VanDerWaalsContact O-N 3.13Å
399	Q	97.9	Very high	95.4	Very high	93 Å²	93	35.2 Å²	35.2	44%	0.435	20%	0.195	S	C	.	.	H	α-helix	trans	-63.6	-40.1	174.8	-66.5	177.5	-3	0	0	112	I395 T396 L397 L402 W403	I395-Q399 PolarHBondContact O-N 2.74Å; I395-Q399 VanDerWaalsContact O-N 3.12Å; T396-Q399 WeakPolarHBondContact O-CB 3.27Å; T396-Q399 PolarHBondContact O-N 2.91Å; L397-Q399 VanDerWaalsContact C-N 3.32Å; L397-Q399 PolarHBondContact O-N 3.47Å; Q399-L402 PolarHBondContact O-N 3.24Å; Q399-W403 HydrophobicContact CB-CH2 4.17Å; Q399-W403 HydrophobicContact CB-CZ2 4.25Å; Q399-W403 PolarHBondContact O-N 3.42Å
400	C	98.1	Very high	95.2	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.8	-42.2	177.8	-63.2	0	0	0	0	112.5	F219 V312 T396 L397 T398 L402 W403 L404	F219-C400 HydrophobicContact CE1-CB 3.89Å; F219-C400 VanDerWaalsContact CE1-SG 3.54Å; F219-C400 HydrophobicContact CZ-CB 4.3Å; V312-C400 HydrophobicContact CG1-CB 3.9Å; T396-C400 PolarHBondContact O-N 2.64Å; T396-C400 VanDerWaalsContact O-N 3.09Å; T396-C400 PolarHBondContact O-SG 2.99Å; L397-C400 WeakPolarHBondContact O-CB 3.49Å; L397-C400 PolarHBondContact O-N 3.38Å; L397-C400 VanDerWaalsContact O-N 3.13Å; T398-C400 VanDerWaalsContact C-N 3.34Å; T398-C400 PolarHBondContact O-N 3.25Å; C400-L402 VanDerWaalsContact C-N 3.32Å; C400-L402 PolarHBondContact O-N 3.28Å; C400-W403 HydrophobicContact CB-CE3 4.45Å; C400-W403 PolarHBondContact O-N 3.33Å; C400-L404 WeakPolarHBondContact O-CG 3.49Å; C400-L404 PolarHBondContact O-N 2.81Å
401	V	97.9	Very high	94.7	Very high	10 Å²	10	41.4 Å²	41.4	6%	0.061	22%	0.218	C	C	.	.	H	α-helix	trans	-59.8	-44.4	174.2	173.9	0	0	0	0	110.5	V312 V313 L397 T398 W403 L404 D405	V312-V401 HydrophobicContact CB-CG2 4.3Å; V312-V401 HydrophobicContact CG1-CG2 3.69Å; V313-V401 HydrophobicContact CG2-CG1 4.1Å; V313-V401 HydrophobicContact CG2-CG2 3.82Å; L397-V401 WeakPolarHBondContact O-CG2 3.38Å; L397-V401 PolarHBondContact O-N 3.01Å; T398-V401 PolarHBondContact O-N 3.49Å; V401-W403 VanDerWaalsContact C-N 3.33Å; V401-W403 PolarHBondContact O-N 3.1Å; V401-L404 PolarHBondContact O-N 2.83Å; V401-D405 WeakPolarHBondContact O-CB 3.33Å; V401-D405 PolarHBondContact O-N 2.95Å
402	L	97.5	Very high	93.7	Very high	108 Å²	108	41.2 Å²	41.2	57%	0.565	22%	0.222	S	C	*	.	H	α-helix	trans	-61.8	-37.9	177.5	-69.1	173	0	0	0	112.9	T398 Q399 C400 A406	T398-L402 WeakPolarHBondContact O-CG 3.5Å; T398-L402 PolarHBondContact O-N 3.29Å; T398-L402 VanDerWaalsContact O-N 3.13Å; Q399-L402 PolarHBondContact O-N 3.24Å; C400-L402 VanDerWaalsContact C-N 3.32Å; C400-L402 PolarHBondContact O-N 3.28Å; L402-A406 VanDerWaalsContact O-CB 3.31Å; L402-A406 WeakPolarHBondContact O-CB 3.31Å; L402-A406 PolarHBondContact O-N 3.41Å
403	W	96.2	Very high	91.8	Very high	55 Å²	55	43.3 Å²	43.3	21%	0.208	24%	0.239	C	C	.	.	H	α-helix	trans	-66.5	-41.8	174.8	-65.5	-35.2	0	0	0	112.4	G220 M223 K224 M227 Q399 C400 V401 A406 I407	G220-W403 WeakPolarHBondContact O-CZ3 3.49Å; M223-W403 HydrophobicContact CB-CE3 4.04Å; M223-W403 HydrophobicContact CB-CZ3 4.04Å; K224-W403 HydrophobicContact CB-CH2 3.48Å; K224-W403 VanDerWaalsContact CB-CH2 3.48Å; K224-W403 HydrophobicContact CB-CZ2 4.03Å; K224-W403 HydrophobicContact CB-CZ3 3.79Å; K224-W403 HydrophobicContact CD-CH2 4.2Å; K224-W403 HydrophobicContact CD-CZ2 4.31Å; K224-W403 HydrophobicContact CG-CH2 3.88Å; K224-W403 HydrophobicContact CG-CZ2 3.94Å; M227-W403 HydrophobicContact CG-CB 3.97Å; M227-W403 HydrophobicContact CG-CG 4.42Å; Q399-W403 HydrophobicContact CB-CH2 4.17Å; Q399-W403 HydrophobicContact CB-CZ2 4.25Å; Q399-W403 PolarHBondContact O-N 3.42Å; C400-W403 HydrophobicContact CB-CE3 4.45Å; C400-W403 PolarHBondContact O-N 3.33Å; V401-W403 VanDerWaalsContact C-N 3.33Å; V401-W403 PolarHBondContact O-N 3.1Å; W403-A406 PolarHBondContact O-N 2.96Å; W403-I407 PolarHBondContact O-N 3.14Å
404	L	96.2	Very high	89.2	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65.1	-40.8	176	-70.8	172.5	0	0	0	111.7	M223 V305 V308 R309 V312 C400 V401 I407 L408	M223-L404 HydrophobicContact CE-CD1 4.3Å; M223-L404 HydrophobicContact CE-CD2 3.84Å; M223-L404 HydrophobicContact CE-CG 3.99Å; V305-L404 HydrophobicContact CG1-CD2 4.14Å; V308-L404 HydrophobicContact CG1-CD1 4.23Å; R309-L404 HydrophobicContact CB-CB 4.25Å; R309-L404 HydrophobicContact CB-CD1 4.08Å; R309-L404 HydrophobicContact CG-CB 4.18Å; R309-L404 HydrophobicContact CG-CD1 4.47Å; V312-L404 HydrophobicContact CB-CD1 4.23Å; V312-L404 HydrophobicContact CG2-CD1 3.85Å; C400-L404 WeakPolarHBondContact O-CG 3.49Å; C400-L404 PolarHBondContact O-N 2.81Å; V401-L404 PolarHBondContact O-N 2.83Å; L404-I407 WeakPolarHBondContact O-CG2 3.18Å; L404-I407 PolarHBondContact O-N 2.92Å; L404-L408 WeakPolarHBondContact O-CB 3.14Å; L404-L408 WeakPolarHBondContact O-CD1 3.21Å; L404-L408 VanDerWaalsContact O-CG 3.28Å; L404-L408 WeakPolarHBondContact O-CG 3.37Å; L404-L408 PolarHBondContact O-N 2.84Å
405	D	95.9	Very high	88.8	Confident	55 Å²	55	54.9 Å²	54.9	29%	0.294	29%	0.294	S	S	.	.	H	α-helix	trans	-61.5	-44.6	173.2	-80.1	-28.2	0	0	0	111.5	R309 V401 I407 L408 A409	R309-D405 IonicContact CZ-OD1 3.35Å; R309-D405 IonicContact CZ-OD2 3.89Å; R309-D405 IonicContact NE-OD1 3.97Å; R309-D405 PolarHBondContact NE-OD1 3.46Å; R309-D405 IonicContact NE-OD2 2.8Å; R309-D405 IonicContact NH2-OD1 3.34Å; R309-D405 PolarHBondContact NH2-OD1 3.22Å; R309-D405 IonicContact NH2-OD2 3.44Å; R309-D405 PolarHBondContact NH2-OD2 3.28Å; V401-D405 WeakPolarHBondContact O-CB 3.33Å; V401-D405 PolarHBondContact O-N 2.95Å; D405-I407 PolarHBondContact O-N 3.05Å; D405-L408 PolarHBondContact O-N 2.88Å; D405-A409 VanDerWaalsContact O-CB 3.23Å; D405-A409 WeakPolarHBondContact O-CB 3.44Å; D405-A409 PolarHBondContact O-N 3.25Å
406	A	94.7	Very high	88.4	Confident	41 Å²	41	53.5 Å²	53.5	34%	0.339	29%	0.287	S	S	.	.	H	α-helix	trans	-62.9	-42.7	179.7	0	0	0	0	0	112.2	L402 W403 R410	L402-A406 VanDerWaalsContact O-CB 3.31Å; L402-A406 WeakPolarHBondContact O-CB 3.31Å; L402-A406 PolarHBondContact O-N 3.41Å; W403-A406 PolarHBondContact O-N 2.96Å; A406-R410 VanDerWaalsContact C-NH1 3.34Å; A406-R410 VanDerWaalsContact O-CG 3.3Å; A406-R410 WeakPolarHBondContact O-CG 3.24Å; A406-R410 PolarHBondContact O-N 3.07Å; A406-R410 VanDerWaalsContact O-N 3.09Å; A406-R410 PolarHBondContact O-NH1 3.36Å
407	I	92.6	Very high	87.9	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.015	30%	0.296	C	S	.	.	H	α-helix	trans	-70.8	-39.6	179.2	-168	168.7	0	0	0	112.1	M227 L285 D286 L289 V305 W403 L404 D405 R410 N411	M227-I407 HydrophobicContact SD-CD1 4.18Å; L285-I407 HydrophobicContact CB-CD1 4.13Å; L285-I407 HydrophobicContact CD2-CD1 4.07Å; L285-I407 HydrophobicContact CG-CD1 4.01Å; D286-I407 HydrophobicContact CB-CD1 3.97Å; L289-I407 HydrophobicContact CD1-CD1 3.91Å; L289-I407 HydrophobicContact CD1-CG1 3.68Å; V305-I407 HydrophobicContact CG1-CG2 4.36Å; W403-I407 PolarHBondContact O-N 3.14Å; L404-I407 WeakPolarHBondContact O-CG2 3.18Å; L404-I407 PolarHBondContact O-N 2.92Å; D405-I407 PolarHBondContact O-N 3.05Å; I407-R410 PolarHBondContact O-N 2.78Å; I407-N411 PolarHBondContact O-N 3.04Å; I407-N411 PolarHBondContact O-ND2 3.32Å
408	L	90.9	Very high	87.2	Confident	14 Å²	14	58.6 Å²	58.6	7%	0.073	31%	0.314	C	S	.	.	H	α-helix	trans	-63.3	-43.5	174.9	-75	165.7	0	0	0	111.3	K302 V305 Q306 R309 L404 D405 N411 S412	K302-L408 HydrophobicContact CG-CD2 4.23Å; V305-L408 HydrophobicContact CB-CD2 3.92Å; V305-L408 HydrophobicContact CG1-CD1 4.12Å; V305-L408 HydrophobicContact CG1-CD2 3.67Å; V305-L408 HydrophobicContact CG1-CG 3.75Å; Q306-L408 VanDerWaalsContact OE1-CD1 3.25Å; R309-L408 HydrophobicContact CB-CD1 4.47Å; L404-L408 WeakPolarHBondContact O-CB 3.14Å; L404-L408 WeakPolarHBondContact O-CD1 3.21Å; L404-L408 VanDerWaalsContact O-CG 3.28Å; L404-L408 WeakPolarHBondContact O-CG 3.37Å; L404-L408 PolarHBondContact O-N 2.84Å; D405-L408 PolarHBondContact O-N 2.88Å; L408-N411 CarbonylContact O-C 3.57Å; L408-N411 PolarHBondContact O-N 2.8Å; L408-S412 VanDerWaalsContact O-CB 3.27Å; L408-S412 WeakPolarHBondContact O-CB 3.5Å; L408-S412 PolarHBondContact O-N 2.82Å; L408-S412 PolarHBondContact O-OG 3.35Å
409	A	91.1	Very high	86.6	Confident	59 Å²	59	59.9 Å²	59.9	49%	0.488	32%	0.319	S	S	.	.	H	α-helix	trans	-61.1	-48.2	177.9	0	0	0	0	0	111.6	D405 N411 S412	D405-A409 VanDerWaalsContact O-CB 3.23Å; D405-A409 WeakPolarHBondContact O-CB 3.44Å; D405-A409 PolarHBondContact O-N 3.25Å; A409-N411 PolarHBondContact O-N 3.47Å; A409-S412 WeakPolarHBondContact CA-OG 3.39Å; A409-S412 PolarHBondContact O-N 3.37Å; A409-S412 PolarHBondContact O-OG 3.08Å
410	R	88.1	Confident	85.8	Confident	137 Å²	137	57.7 Å²	57.7	52%	0.517	31%	0.311	S	S	.	.	H	α-helix	trans	-57.7	-33.3	177.4	-74.1	-170.1	-48.2	-91.7	7.8	113.2	D286 A406 I407	D286-R410 IonicContact OD1-CZ 3.56Å; D286-R410 IonicContact OD1-NE 2.98Å; D286-R410 PolarHBondContact OD1-NE 3.22Å; D286-R410 IonicContact OD1-NH2 3.51Å; D286-R410 PolarHBondContact OD1-NH2 3.25Å; A406-R410 VanDerWaalsContact C-NH1 3.34Å; A406-R410 VanDerWaalsContact O-CG 3.3Å; A406-R410 WeakPolarHBondContact O-CG 3.24Å; A406-R410 PolarHBondContact O-N 3.07Å; A406-R410 VanDerWaalsContact O-N 3.09Å; A406-R410 PolarHBondContact O-NH1 3.36Å; I407-R410 PolarHBondContact O-N 2.78Å
411	N	81.6	Confident	84.9	Confident	8 Å²	8	61.8 Å²	61.8	4%	0.043	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	15	-176.2	-66.5	-77.9	0	0	0	113.3	D286 L289 V290 L293 I407 L408 A409	D286-N411 PolarHBondContact OD1-ND2 2.91Å; L289-N411 HydrophobicContact CB-CB 3.89Å; L289-N411 HydrophobicContact CD1-CB 4.23Å; V290-N411 WeakPolarHBondContact CG2-OD1 3.34Å; L293-N411 HydrophobicContact CD1-CB 4.41Å; I407-N411 PolarHBondContact O-N 3.04Å; I407-N411 PolarHBondContact O-ND2 3.32Å; L408-N411 CarbonylContact O-C 3.57Å; L408-N411 PolarHBondContact O-N 2.8Å; A409-N411 PolarHBondContact O-N 3.47Å
412	S	73.5	Confident	83.9	Confident	60 Å²	60	65.8 Å²	65.8	42%	0.42	35%	0.354	S	S	.	.	S	Bend	trans	-105	-8.2	176.4	60.4	0	0	0	0	113.8	L408 A409	L408-S412 VanDerWaalsContact O-CB 3.27Å; L408-S412 WeakPolarHBondContact O-CB 3.5Å; L408-S412 PolarHBondContact O-N 2.82Å; L408-S412 PolarHBondContact O-OG 3.35Å; A409-S412 WeakPolarHBondContact CA-OG 3.39Å; A409-S412 PolarHBondContact O-N 3.37Å; A409-S412 PolarHBondContact O-OG 3.08Å
413	A	51.6	Low	82.8	Confident	68 Å²	68	62.3 Å²	62.3	56%	0.562	34%	0.337	S	S	*	.			trans	-102.1	63.2	-173.5	0	0	0	0	0	112.5
414	F	40.9	Very low	81.6	Confident	247 Å²	247	62.9 Å²	62.9	100%	1.083	35%	0.349	S	S	*	.			trans	-161.9	0	155.7	-76.4	-68.5	0	0	0	107.4

Retrieved 414 of 414 residues in 270.2 ms (Link to these results)

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