A0A077Z7N2_TRITR Loading...

Pleckstrin homology domain-containing family A member 8

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 168.4 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).