Assignment  	    w1		    w2

S5H-N     		116.816		  8.35
Q9H-N     		121.973		 8.479
A11H-N    		124.566		 8.421
A12H-N    		123.47		 8.297
Q13H-N    		119.718		 8.302
A14H-N    		127.291		 8.405
E16H-N    		120.957		 8.656
T17H-N    		115.763		 8.202
K18H-N    		123.975		 8.373
Q19H-N    		121.48		 8.387
Q19HE21-NE2		112.988		 7.557
Q19HE22-NE2		112.988		 6.913
A20H-N    		125.974		 8.505
F21H-N    		124.486		 8.851
R23H-N    		126.815		 8.356
K24H-N    		116.573		 8.555
F25H-N    		118.123		 7.575
V26H-N    		117.081		 8.024
L27H-N    		118.748		  8.22
A28H-N    		124.088		 8.014
A29H-N    		120.431		 8.259
L30H-N    		120.849		 8.098
E31H-N    		120.752		 8.115
Q32H-N    		114.711		 7.812
Q32HE21-NE2		110.93		  7.39
Q32HE22-NE2		110.93		 6.673
S33H-N    		110.604		  7.46
S34H-N    		117.544		 7.429
D35H-N    		121.575		 8.822
D36H-N    		117.398		 8.483
A37H-N    		122.052		 8.242
G38H-N    		107.721		 8.155
W39H-N    		119.797		 8.449
W39HE1-NE1		128.725		10.138
A40H-N    		124.618		 9.855
N41H-N    		121.05		 8.794
N41HD21-ND2		 112.3		  7.05
N41HD22-ND2		 112.3		  6.73
L42H-N    		126.418		 8.493
G43H-N    		 106.8		  8.44
N44H-N    		121.472		 7.916
N44HD21-ND2		113.299		 7.989
N44HD22-ND2		113.299		 7.236
F45H-N    		121.835		 8.563
G46H-N    		106.269		 8.933
N47H-N    		120.03		 7.812
N47HD21-ND2		112.055		 7.583
N47HD22-ND2		112.055		 6.847
Y48H-N    		121.03		 8.093
L49H-N    		121.024		  8.48
N50H-N    		114.582		 7.564
N50HD21-ND2		111.057		 7.516
N50HD22-ND2		111.057		 7.028
K51H-N    		118.289		  7.37
L52H-N    		117.841		 7.518
Q53H-N    		118.578		 8.438
Q53HE21-NE2		111.075		 7.103
Q53HE22-NE2		111.075		 6.344
D55H-N    		114.766		 8.349
F56H-N    		122.323		 8.187
D57H-N    		127.342		 6.887
S58H-N    		123.478		 9.284
R59H-N    		123.207		 8.639
L60H-N    		120.191		  7.46
Y61H-N    		114.72		   7.2
G62H-N    		 104.1		 7.354
Y63H-N    		117.874		 7.377
K64H-N    		123.946		 9.403
K65H-N    		112.461		 7.635
L66H-N    		124.584		  9.09
S67H-N    		112.095		 8.867
D68H-N    		119.72		 6.783
L69H-N    		122.181		 7.153
V70H-N    		116.117		 8.167
K71H-N    		116.326		 7.665
A72H-N    		118.313		 7.506
R73H-N    		118.69		 7.603
R73HE-NE  		108.843		 8.726
T74H-N    		115.95		 8.261
D75H-N    		116.582		 9.542
L76H-N    		117.639		 7.078
F77H-N    		115.989		 7.977
V78H-N    		123.339		 8.863
T79H-N    		113.057		 8.305
E80H-N    		117.934		 8.962
E81H-N    		 122.4		 8.687
R82H-N    		121.851		 9.118
R82HE-NE  		110.81		 6.873
Q83H-N    		121.976		 8.642
V84H-N    		128.548		 8.818
G86H-N    		111.839		 8.815
S87H-N    		114.255		 8.029
T88H-N    		112.921		 8.366
Q89H-N    		122.086		 8.342
K90H-N    		121.945		 8.584
A91H-N    		124.604		 8.975
L92H-N    		123.888		 8.523
Y93H-N    		126.872		 9.289
L94H-N    		117.884		 9.551
R95H-N    		116.939		 8.603
R95HE-NE  		111.784		 6.468
A96H-N    		124.914		 9.072
K97H-N    		123.129		 7.989
L98H-N    		123.816		 8.118
E99H-N    		122.215		 8.376