THR
sasa= 144.176
numAtoms= 7
numHAtoms= 7
numBonds= 6
numBonds_H= 7
numAngles= 7
numDihedrals= 1
numImpropers= 0
Atom   N     -1.4200    0.3440   -1.2700    10.820	-0.245382	*N 	
Atom   C      0.1040   -1.5580   -0.4720    11.490	0.559878        *C 
Atom   CA    -0.1000   -0.0260   -0.7310    10.940	-0.271249       *CT
Atom   O      1.1880   -2.0940   -0.7200    11.840	-0.552020       *O 
Atom   CB     0.2250    0.8150    0.5030    10.560	0.237868	*CT
Atom   OG1    0.6900    2.0940    0.0900    10.260	-0.601931	*OH
Atom   CG2    1.4200    0.2540    1.2690    10.640	-0.176489	*CT
HAtom  HN 						0.255339	*H
HAtom  HA 						0.163757	*H1
HAtom  HB 						0.044688	*H1
HAtom  HG1						0.405484	*HO
HAtom 1HG2						0.060019	*HC
HAtom 2HG2						0.060019	*HC
HAtom 3HG2						0.060019	*HC
BOND  C   +N			1.3290    !0.0170	490.0    1.335	//checked
Bond  N    CA  			1.4583    !0.0201	337.0    1.475
Bond  CA   C  			1.5231    !0.0201	317.0    1.522
Bond  C    O  			1.2329    !0.0200	570.0    1.229
Bond  CA   CB 			1.5397    !0.0243	310.0    1.526
Bond  CB   OG1			1.4336    !0.0169	320.0    1.410
Bond  CB   CG2			1.5215    !0.0235	310.0    1.526
Bond_H  N    HN 					434.0    1.010
Bond_H  CA   HA   					340.0    1.090
Bond_H  CB   HB   					340.0    1.090
Bond_H  OG1  HG1  					340.0    1.090
Bond_H  CG2 1HG2  					340.0    1.090
Bond_H  CG2 2HG2  					340.0    1.090
Bond_H  CG2 3HG2  					340.0    1.090
Angle  O    C   +N              122.7229  !2.2381	80.0      122.90		//checked
Angle  CA   C   +N              116.6920  !2.9819	70.0      116.60		//checked
Angle -C    N    CA             121.4197  !3.4990 	50.0      121.90		//checked
Angle  N    CA   C   		110.6827  !4.1978	63.0      110.10 	//error
Angle  CA   C    O   		120.5440  !2.3373	80.0      120.40
Angle  N    CA   CB   		110.8739  !3.3215	80.0      109.70
Angle  C    CA   CB 		109.1978  !3.4079	63.0      111.10
Angle  CA   CB   OG1  		109.1976  !2.6348	50.0      109.50
Angle  CA   CB   CG2  		111.3831  !2.5953	40.0      109.50
Angle  OG1  CB   CG2  		108.5185  !4.1767	50.0      109.50
Dihedral -CA  -C    N    CA     180.0     !2.0000	////added 
Dihedral  N    CA   CB   OG1