Assignment  	    w1		    w2

Q3H-N     		119.903		 8.595
Q3HE21-NE2		112.696		 6.884
Q3HE22-NE2		112.696		 7.557
S4H-N     		117.501		 8.446
G5H-N     		111.321		 8.578
G6H-N     		108.906		 8.318
E7H-N     		120.693		 8.404
A8H-N     		125.454		 8.381
R9H-N     		122.643		 8.344
G11H-N    		109.451		 8.356
K13H-N    		121.489		 8.547
T14H-N    		115.349		 8.094
A15H-N    		126.581		 8.383
V16H-N    		119.723		 8.103
Q17H-N    		124.386		 8.411
Q17HE21-NE2		112.63		  6.89
Q17HE22-NE2		112.63		 7.551
I18H-N    		123.268		 8.266
R19H-N    		125.596		 8.404
V20H-N    		122.322		 8.219
A21H-N    		127.807		 8.361
I22H-N    		120.616		 8.139
Q23H-N    		124.431		 8.439
Q23HE21-NE2		112.673		 6.872
Q23HE22-NE2		112.673		 7.592
E24H-N    		122.969		 8.513
A25H-N    		124.846		 8.332
E26H-N    		120.128		 8.401
D27H-N    		121.725		 8.402
V28H-N    		119.796		  8.07
D29H-N    		124.186		 8.416
E30H-N    		121.559		 8.342
L31H-N    		123.397		 8.308
E32H-N    		122.173		 8.412
D33H-N    		121.962		 8.403
E34H-N    		121.855		 8.447
E35H-N    		 122.2		 8.493
E36H-N    		122.906		 8.508
G37H-N    		110.828		 8.579
A38H-N    		123.708		 8.161
E39H-N    		119.444		 8.651
T40H-N    		114.652		 8.122
R41H-N    		123.594		 8.314
G42H-N    		110.18		 8.473
A43H-N    		123.735		 8.245
G44H-N    		107.785		  8.39
D45H-N    		121.348		 8.139
A47H-N    		122.151		 8.358
R48H-N    		118.726		 7.879
Y49H-N    		119.423		 7.807
L50H-N    		123.089		 7.817
S51H-N    		117.785		 8.081
G53H-N    		109.256		 8.449
W54H-N    		121.179		 7.978
W54HE1-NE1		129.376		10.123
G55H-N    		111.354		 8.263
S56H-N    		115.656		  8.07
A57H-N    		125.955		 8.415
S58H-N    		114.963		 8.259
E59H-N    		122.508		 8.392
E60H-N    		121.389		 8.309
E61H-N    		123.547		 8.393
S63H-N    		115.658		 8.436
R64H-N    		123.042		 8.356
G65H-N    		109.423		 8.366
H66H-N    		119.135		 8.286
S67H-N    		117.51		 8.445
G68H-N    		111.085		 8.543
T69H-N    		113.675		 8.155
T70H-N    		116.685		 8.264
A71H-N    		126.967		  8.44
S72H-N    		115.479		  8.39
G73H-N    		111.195		 8.506
G74H-N    		108.906		 8.331
E75H-N    		120.635		 8.544
N76H-N    		118.889		 8.531
N76HD21-ND2		113.365		 7.627
N76HD22-ND2		113.365		 6.939
E77H-N    		121.155		 8.345
R78H-N    		121.579		 8.295
E79H-N    		122.338		 8.528
D80H-N    		121.138		 8.468
L81H-N    		122.177		 8.112
E82H-N    		122.033		 8.379
Q83H-N    		126.463		  7.97
Q83HE21-NE2		112.697		 6.831
Q83HE22-NE2		112.697		 7.569