Assignment  	    w1		    w2

Q3H-N     		125.37		 8.534
Q3HE21-NE2		112.777		 7.748
Q3HE22-NE2		112.777		 7.208
M4H-N     		124.685		 8.659
A5H-N     		125.422		 8.182
S8H-N     		114.147		 8.521
L9H-N     		126.792		 8.929
N10H-N    		123.368		 9.557
N10HD21-ND2		113.807		 7.578
N10HD22-ND2		113.807		 6.934
V11H-N    		121.155		 8.509
T12H-N    		119.89		 8.843
K13H-N    		124.105		 8.414
D14H-N    		127.951		 8.346
G15H-N    		115.043		 8.739
D16H-N    		125.897		 8.665
S17H-N    		114.779		 7.671
Y18H-N    		122.946		 8.931
S19H-N    		115.464		 8.926
L20H-N    		121.892		 8.577
R21H-N    		119.468		 8.764
R21HE-NE  		112.408		 7.329
W22H-N    		119.837		  7.81
W22HE1-NE1		128.004		  6.72
E23H-N    		117.203		 8.346
T24H-N    		113.567		 8.624
M25H-N    		121.471		 8.568
K26H-N    		122.841		 8.543
M27H-N    		121.998		 8.471
R28H-N    		121.365		 8.402
Y29H-N    		119.468		 8.026
E30H-N    		120.996		 8.252
H31H-N    		118.836		  8.58
I32H-N    		121.37		 7.756
D33H-N    		123.894		 8.251
H34H-N    		120.504		  8.83
T35H-N    		120.206		 8.816
F36H-N    		123.894		 9.599
E37H-N    		121.734		 8.344
I38H-N    		124.421		 9.237
Q39H-N    		122.946		 8.851
Q39HE21-NE2		109.036		  6.88
Q39HE22-NE2		109.036		 6.375
Y40H-N    		115.517		 8.765
R41H-N    		117.572		 9.521
R41HE-NE  		110.775		 5.915
K42H-N    		120.153		 8.368
D43H-N    		121.102		 8.569
T44H-N    		128.32		 7.183
A45H-N    		125.739		 7.464
T46H-N    		109.51		 8.316
W47H-N    		117.835		 8.125
W47HE1-NE1		129.058		 9.969
S50H-N    		115.253		 7.339
K51H-N    		122.946		 8.246
T52H-N    		119.785		 8.534
E53H-N    		127.319		 9.283
T54H-N    		119.31		 8.888
L55H-N    		126.423		 9.377
Q56H-N    		121.049		 9.112
Q56HE21-NE2		111.407		 7.476
Q56HE22-NE2		111.407		 6.841
N57H-N    		118.994		  9.73
N57HD21-ND2		115.569		 7.839
N57HD22-ND2		115.569		 7.839
A58H-N    		119.837		 7.098
H59H-N    		114.041		 8.283
S60H-N    		111.249		 6.689
M61H-N    		117.466		 8.692
A62H-N    		129.796		 8.694
L63H-N    		123.842		 8.368
A65H-N    		119.31		 8.105
L66H-N    		123.578		 8.525
E67H-N    		122.419		   8.4
S69H-N    		119.567		 8.007
T70H-N    		115.886		 8.395
R71H-N    		127.056		  8.23
R71HE-NE  		113.251		 8.685
Y72H-N    		126.95		 8.389
W73H-N    		114.516		 8.782
W73HE1-NE1		130.797		11.244
A74H-N    		119.627		 9.511
R75H-N    		114.041		 9.111
R75HE-NE  		108.95		  3.95
V76H-N    		117.624		 8.762
R77H-N    		123.578		 8.871
R77HE-NE  		 107.5		 2.278
V78H-N    		118.151		 8.722
R79H-N    		125.001		 8.693
T80H-N    		114.832		 8.603
S81H-N    		117.256		 8.273
R82H-N    		121.576		  8.42
T83H-N    		118.836		 8.629
G84H-N    		113.409		 8.782
Y85H-N    		120.312		 8.148
G87H-N    		109.365		 8.121
I88H-N    		118.625		  7.85
W89H-N    		125.001		 8.168
W89HE1-NE1		129.479		 9.958
S90H-N    		117.414		 9.282
E91H-N    		118.731		 9.066
W92H-N    		122.366		 8.476
W92HE1-NE1		128.953		 9.847
S93H-N    		115.886		 9.394
E94H-N    		121.313		 8.694
A95H-N    		130.902		  8.98
R96H-N    		121.945		 9.091
R96HE-NE  		111.407		 7.333
S97H-N    		117.308		 8.462
W98H-N    		120.891		 8.493
W98HE1-NE1		120.628		 6.372
D99H-N    		119.31		 8.347
T100H-N   		114.99		  9.18
E101H-N   		119.732		 8.237
S102H-N   		122.314		 8.285