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A Standard Reference Frame for the Description
of Nucleic Acid Base-pair Geometry
Supplementary Material

Example: kinked AA/TT (base-pairs 8 and 9) from PDT012

          bp     Shear    Stretch   Stagger    Buckle  Propeller  Opening

stnd     8 A-T   -0.17      0.05      0.31     32.13    -15.56      8.20

stnd     9 A-T    0.03     -0.10      0.04      4.50     -1.30      6.12

dO-N     8 A-T   -0.18      0.15      0.30     32.13    -15.55      8.18

dO-N     9 A-T    0.03      0.00      0.04      4.50     -1.30      6.10

lambda0  8 A-T   -0.17      0.05      0.28     32.13    -15.56      6.17

lambda0  9 A-T    0.03     -0.09      0.04      4.50     -1.30      4.09

both     8 A-T   -0.18      0.15      0.28     32.13    -15.56      6.17

both     9 A-T    0.03      0.01      0.04      4.50     -1.30      4.09

        

               

         step    Shift     Slide      Rise      Tilt      Roll     Twist

stnd    8 AA/TT   0.68      0.69      4.81      2.10     38.46     19.59

dO-N    8 AA/TT   0.69      0.68      4.80      2.10     38.47     19.59

lambda0 8 AA/TT   0.68      0.65      4.87      2.10     38.46     19.59

both    8 AA/TT   0.69      0.65      4.86      2.10     38.46     19.59

        

               

         step    X-disp    Y-disp     Rise     Incl.       Tip     Twist

stnd    8 AA/TT  -5.40     -0.59      2.87     63.94     -3.49     43.05

dO-N    8 AA/TT  -5.39     -0.60      2.87     63.94     -3.48     43.05

lambda0 8 AA/TT  -5.48     -0.58      2.87     63.94     -3.49     43.05

both    8 AA/TT  -5.47     -0.59      2.86     63.94     -3.49     43.05





Note:

             dN...H-N(A)     dO...H-N(A)     lambda0(degrees)

----------------------------------------------------------------

stnd           3.0              3.0             54.5

dO-N           3.0              2.9             54.5

lambda0        3.0              3.0             55.5

both           3.0              2.9             55.5

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