Assignment  	    w1		    w2

Q5H-N     		116.744		 7.501
M6H-N     		119.922		 7.841
V7H-N     		116.731		 7.948
Q8H-N     		119.698		 7.748
Q9H-N     		119.329		 7.812
L10H-N    		116.909		 7.475
N11H-N    		113.849		  7.35
S12H-N    		116.219		 7.377
D14H-N    		121.981		 8.318
Q15H-N    		125.715		 8.798
Q16H-N    		118.435		 8.251
E17H-N    		122.77		 7.876
L18H-N    		121.549		 8.188
Q19H-N    		116.869		 8.255
S20H-N    		113.809		 7.898
A21H-N    		125.068		 7.901
L22H-N    		118.478		 8.359
R23H-N    		118.741		 8.103
K24H-N    		120.248		 7.786
L25H-N    		120.651		 8.532
S26H-N    		114.417		 8.454
Q27H-N    		120.028		 7.717
I28H-N    		122.788		 8.318
A29H-N    		119.421		 8.305
S30H-N    		111.026		 7.449
G31H-N    		108.554		 7.869
G32H-N    		107.301		 7.686
E34H-N    		119.967		 9.013
Q35H-N    		120.652		 7.688
I36H-N    		119.182		 8.114
Q37H-N    		118.24		 8.184
A38H-N    		120.428		 7.522
V39H-N    		117.722		 7.637
I40H-N    		 120.9		 7.963
D41H-N    		123.621		 9.363
A42H-N    		119.287		 7.495
G43H-N    		103.956		 7.952
A44H-N    		117.302		 7.217
L45H-N    		113.267		  9.09
A47H-N    		 118.5		 6.986
L48H-N    		117.891		 8.026
V49H-N    		115.627		 8.305
Q50H-N    		119.431		 7.678
L51H-N    		119.959		 7.709
L52H-N    		116.201		 7.391
S53H-N    		 110.9		 7.393
S54H-N    		117.92		 7.492
N56H-N    		120.052		 8.167
E57H-N    		126.643		 8.991
Q58H-N    		118.639		 8.049
I59H-N    		120.544		 7.322
L60H-N    		120.097		 8.115
Q61H-N    		115.377		 7.853
E62H-N    		118.112		 7.524
A63H-N    		123.261		 8.763
L64H-N    		119.433		 8.416
W65H-N    		120.849		 8.221
W65HE1-NE1		128.696		10.047
A66H-N    		121.261		 8.002
L67H-N    		117.561		 8.489
S68H-N    		114.589		 8.794
N69H-N    		118.032		 7.711
I70H-N    		122.308		 7.945
A71H-N    		118.333		 8.336
S72H-N    		111.746		 7.242
G73H-N    		108.686		 7.853
G74H-N    		104.13		 7.875
E76H-N    		118.958		 9.395
Q77H-N    		121.198		 7.409
K78H-N    		118.423		 8.238
Q79H-N    		117.718		 8.143
A80H-N    		121.507		 7.426
V81H-N    		118.478		 7.593
K82H-N    		119.051		 7.884
E83H-N    		121.265		  8.77
A84H-N    		118.678		 7.363
G85H-N    		103.582		 7.724
A86H-N    		117.033		 7.043
L87H-N    		115.955		 8.874
E88H-N    		116.788		 8.185
K89H-N    		115.478		 6.732
L90H-N    		119.49		 8.305
E91H-N    		117.696		 8.259
Q92H-N    		118.015		 7.317
L93H-N    		119.433		 7.778
Q94H-N    		116.081		 7.456
S95H-N    		110.865		 7.502
H96H-N    		124.97		 7.531
E97H-N    		123.946		 7.892
N98H-N    		124.463		11.447
N98HD21-ND2		113.056		  7.97
N98HD22-ND2		113.056		 6.873
E99H-N    		127.719		  8.96
K100H-N   		119.393		 8.146
I101H-N   		120.19		 7.146
Q102H-N   		117.955		 8.028
K103H-N   		117.365		 7.746
E104H-N   		119.493		 7.928
A105H-N   		122.271		 8.801
Q106H-N   		117.972		 8.094
E107H-N   		119.298		 8.151
A108H-N   		121.655		 8.068
L109H-N   		118.27		 8.173
E110H-N   		118.572		 8.022
K111H-N   		118.523		 7.746
L112H-N   		117.047		 7.769
Q113H-N   		116.054		 7.646
S114H-N   		116.322		 7.703
H115H-N   		125.824		 8.029