Assignment  	    w1		    w2

D3H-N     		122.059		 8.885
E4H-N     		119.487		 8.217
E5H-N     		120.402		 8.049
I6H-N     		119.06		 8.077
R7H-N     		120.844		  8.34
K8H-N     		118.119		 7.987
K9H-N     		118.858		 7.906
L10H-N    		121.434		 8.652
E11H-N    		120.194		 8.406
E12H-N    		119.716		 7.889
L13H-N    		122.114		 7.833
A14H-N    		121.005		 8.407
K15H-N    		117.215		 7.845
R16H-N    		119.591		  8.15
K17H-N    		115.03		 8.201
G18H-N    		110.141		  8.01
K19H-N    		117.666		 7.878
D20H-N    		120.524		 8.395
L21H-N    		123.933		 7.952
Q22H-N    		120.777		 7.702
Q22HE21-NE2		112.811		 6.848
Q22HE22-NE2		112.811		 7.833
L23H-N    		125.314		 8.664
R24H-N    		125.375		 9.109
R25H-N    		121.966		 8.268
Y26H-N    		121.527		 8.227
N27H-N    		119.893		 7.691
N27HD21-ND2		113.356		  6.95
N27HD22-ND2		113.356		 7.721
D28H-N    		119.925		 7.694
N30H-N    		117.086		 8.716
N30HD21-ND2		114.684		 7.033
N30HD22-ND2		114.684		 8.015
E31H-N    		119.899		 7.605
V32H-N    		119.031		 7.374
E33H-N    		119.522		 8.188
K34H-N    		116.597		 7.602
S35H-N    		114.463		  7.88
I36H-N    		122.176		 8.507
R37H-N    		118.062		 8.272
E38H-N    		117.94		 7.772
A39H-N    		121.862		 7.988
L40H-N    		116.549		  8.33
K41H-N    		119.184		 7.757
K42H-N    		115.055		 7.978
G43H-N    		109.922		 7.854
R44H-N    		119.652		 8.213
T45H-N    		118.768		 8.395
L46H-N    		129.913		 9.094
I47H-N    		124.358		 8.956
I48H-N    		127.092		 9.443
I49H-N    		125.966		 8.468
I50H-N    		125.138		 8.747
N51H-N    		126.141		 9.268
N51HD21-ND2		111.419		 6.942
N51HD22-ND2		111.419		 7.411
G52H-N    		102.699		 8.249
V53H-N    		122.156		 8.043
F54H-N    		123.213		 8.481
V55H-N    		124.816		 9.742
V56H-N    		128.001		 9.154
V57H-N    		128.673		 9.212
S58H-N    		116.261		 8.088
T59H-N    		110.449		 8.058
D60H-N    		123.765		 8.376
E61H-N    		125.259		 8.761
D62H-N    		119.532		 8.206
L63H-N    		122.147		 7.758
I64H-N    		118.484		 8.353
R65H-N    		118.183		 7.633
E66H-N    		119.72		 7.788
I67H-N    		121.035		 8.789
K68H-N    		117.693		 8.532
R69H-N    		119.393		 7.747
L70H-N    		120.027		 7.838
I71H-N    		120.45		 8.222
K72H-N    		119.291		 7.991
E73H-N    		116.229		 7.976
S74H-N    		112.732		 7.414
N75H-N    		117.209		 8.375
N75HD21-ND2		112.263		 7.131
N75HD22-ND2		112.263		 7.666
N77H-N    		114.674		 8.256
N77HD21-ND2		 114.0		 7.096
N77HD22-ND2		 114.0		 7.654
K78H-N    		120.036		  7.37
K79H-N    		125.366		 8.956
T80H-N    		113.988		 8.165
L81H-N    		124.996		 8.992
D82H-N    		121.064		 8.394
V83H-N    		121.225		  9.03
T84H-N    		116.604		 9.475
T85H-N    		111.039		 7.693
E86H-N    		122.007		 9.151
E87H-N    		120.139		 8.626
D88H-N    		119.242		 7.855
L89H-N    		119.795		 7.679
E90H-N    		117.913		 8.158
E91H-N    		118.92		  7.87
V92H-N    		120.187		 7.961
L93H-N    		118.275		 8.534
R94H-N    		118.155		 7.726
R95H-N    		117.956		  7.84
I96H-N    		116.324		 8.207
K97H-N    		119.933		 7.945
K98H-N    		118.805		 7.859
G99H-N    		108.525		 8.091
S100H-N   		114.995		 8.013
W101H-N   		122.661		 8.138
W101HE1-NE1		129.447		  10.2
S102H-N   		115.982		 8.137
L103H-N   		123.515		 8.147
E104H-N   		120.441		 8.232