#######################################################################
# R2 data on D12 100% 13C/15N NMR sample
#
# Experiment notes:
#
#   collection by George Coker on March 5-12, 1998
#   Sfreq:    800 MHz
#   Temp:     25C
#   sequence: 5'-CGCGAATTCGC-3' duplex DNA
#   [DNA]:    1 mM 
#   Buffer:   20mM phosphate pH 7.0, 150 mM NaCl, 0.05 mM EDTA
#
#######################################################################
# Raw FID data was reprocessed Aug 5, 1999  GC
#  -These are the R2 rates as fit from peak intensity data processed 
#   using nmrview and nmrpipe
#  -Errors are reported as those the came from the fit using the 
#   levenberg marquadt algorithm under Origin v4.1. 
#   I = A1*cos(A2*(x+A3))*cos(A4*(x+A3))*exp(A5*(x+A3)+A6
#  -C2' data are the average of the C2'-H2' and C2'-H2'' values
#  -C5' data are not reported, too overlapped
#  -Completely overlapped peaks (both are reported as identical)
#     C3'-H3' CYT 3 and CYT 11
#     C4'-H4' CYT 3 and CYT 11
#     C3'-H3' GUA 4 and GUA 10
#     C8 -H8  ADE 5 and ADE 6
#     C1'-H1' ADE 6 and GUA 12
#######################################################################

# CYT 1
"A 1 CYT C1'"    : 16.338 :  0.382
"A 1 CYT C2'"    : 38.678 :  6.849
"A 1 CYT C3'"    : 14.032 :  4.908
"A 1 CYT C4'"    : 22.138 :  2.135
"A 1 CYT C5"     : 52.174 :  8.855
"A 1 CYT C6"     : 42.574 :  1.227

# GUA 2
"A 2 GUA C1'"    : 30.204 :  0.707
"A 2 GUA C2'"    : 43.402 :  5.422
"A 2 GUA C3'"    : 21.457 :  4.784
"A 2 GUA C4'"    : 23.436 :  2.402
"A 2 GUA C8"     : 66.772 :  2.782

# CYT 3
"A 3 CYT C1'"    : 25.071 :  1.786
"A 3 CYT C2'"    : 33.495 :  7.434
"A 3 CYT C3'"    : 17.479 :  3.720
"A 3 CYT C4'"    : 19.020 :  1.149
"A 3 CYT C5"     : 50.828 :  7.806
"A 3 CYT C6"     : 50.584 :  1.028

# GUA 4
"A 4 GUA C1'"    : 25.795 :  0.330
"A 4 GUA C2'"    : 51.609 :  6.250
"A 4 GUA C3'"    : 22.550 :  4.516
"A 4 GUA C4'"    : 24.115 :  2.671
"A 4 GUA C8"     : 66.295 :  4.386

# ADE 5
"A 5 ADE C1'"    : 27.632 :  0.488
"A 5 ADE C2'"    : 61.098 :  9.366
"A 5 ADE C3'"    : 27.227 :  4.303
"A 5 ADE C4'"    : 26.069 :  1.715
"A 5 ADE C2"     : 81.055 :  4.426
"A 5 ADE C8"     : 66.926 :  2.690

# ADE 6
"A 6 ADE C1'"    : 23.442 :  0.362
"A 6 ADE C2'"    : 49.258 :  4.569
"A 6 ADE C3'"    : 26.545 :  4.582
"A 6 ADE C4'"    : 28.730 :  1.645
"A 6 ADE C2"     : 66.191 :  5.423
"A 6 ADE C8"     : 66.926 :  2.690

# THY 7
"A 7 THY C1'"    : 25.452 :  0.320
"A 7 THY C2'"    : 46.269 :  7.074
"A 7 THY C3'"    : 53.002 : 26.142
"A 7 THY C4'"    : 31.399 :  2.991
"A 7 THY C6"     : 51.936 :  1.007

# THY 8
"A 8 THY C1'"    : 28.228 :  1.309
"A 8 THY C2'"    : 82.276 : 13.361
"A 8 THY C3'"    : 19.921 :  4.476
"A 8 THY C4'"    : 27.658 :  1.730
"A 8 THY C6"     : 49.790 :  1.494

# CYT 9
"A 9 CYT C1'"    : 24.920 :  1.756
"A 9 CYT C2'"    : 29.303 :  6.419
"A 9 CYT C3'"    : 16.331 :  3.247
"A 9 CYT C4'"    : 27.091 :  2.699
"A 9 CYT C5"     : 55.914 :  6.415
"A 9 CYT C6"     : 46.901 :  1.249

# GUA 10
"A 10 GUA C1'"   : 25.697 :  0.759
"A 10 GUA C2'"   : 46.816 : 11.865
"A 10 GUA C3'"   : 21.457 :  4.784
"A 10 GUA C4'"   : 21.091 :  1.130
"A 10 GUA C8"    : 66.562 :  3.064

# CYT 11
"A 11 CYT C1'"   : 24.605 :  1.597
"A 11 CYT C2'"   : 30.829 :  5.763
"A 11 CYT C3'"   : 17.479 :  3.720
"A 11 CYT C4'"   : 19.020 :  1.149
"A 11 CYT C5"    : 52.201 : 11.015
"A 11 CYT C6"    : 49.694 :  0.910

# GUA 12
"A 12 GUA C1'"   : 23.442 :  0.362
"A 12 GUA C2'"   : 33.456 : 10.509
"A 12 GUA C3'"   : 13.450 :  3.633
"A 12 GUA C4'"   : 26.822 :  1.613
"A 12 GUA C8"    : 66.049 :  3.390

