=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 0 rings

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
1r1lC1 SER   2 HA     0.00  -0.08   0.21  -0.75   4.49     3.86
1r1lC1 SER   2 HB2    0.00  -0.02   0.02  -0.04   3.95     3.91
1r1lC1 SER   2 HB3    0.00  -0.01  -0.11  -0.04   3.93     3.77
1r1lC1 GLU   3 H      0.00   0.18   0.09  -0.55   8.60     8.33
1r1lC1 GLU   3 HA     0.00   0.17   0.88  -0.75   4.29     4.59
1r1lC1 GLU   3 HB2    0.00   0.05  -0.06  -0.04   2.09     2.04
1r1lC1 GLU   3 HB3    0.00  -0.04   0.11  -0.04   1.99     2.02
1r1lC1 GLU   3 HG2    0.00  -0.02  -0.24  -0.04   2.34     2.04
1r1lC1 GLU   3 HG3    0.00   0.03   0.02  -0.04   2.34     2.34
1r1lC1 ALA   4 H      0.00   0.27   0.13  -0.55   8.40     8.26
1r1lC1 ALA   4 HA     0.00   0.15   0.84  -0.75   4.34     4.58
1r1lC1 ALA   4 HB3    0.00   0.01  -0.06  -0.04   1.41     1.32
1r1lC1 ALA   5 H      0.00   0.31   0.20  -0.55   8.40     8.36
1r1lC1 ALA   5 HA     0.00   0.15   0.73  -0.75   4.34     4.47
1r1lC1 ALA   5 HB3    0.00   0.02  -0.06  -0.04   1.41     1.33
1r1lC1 ALA   6 H      0.00   0.29   0.18  -0.55   8.40     8.33
1r1lC1 ALA   6 HA     0.00   0.12   0.64  -0.75   4.34     4.34
1r1lC1 ALA   6 HB3    0.00   0.03  -0.06  -0.04   1.41     1.34
1r1lC1 SER   7 H      0.00   0.34   0.05  -0.55   8.46     8.30
1r1lC1 SER   7 HA     0.00   0.20   0.45  -0.75   4.49     4.38
1r1lC1 SER   7 HB2    0.00   0.08  -0.19  -0.04   3.95     3.80
1r1lC1 SER   7 HB3    0.00   0.00  -0.01  -0.04   3.93     3.88