=============================================================================
          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
=============================================================================
1d5mD1 ARG 805 HA     0.00  -0.09   0.19  -0.75   4.34     3.69
1d5mD1 ARG 805 HB2    0.00  -0.03   0.00  -0.04   1.90     1.83
1d5mD1 ARG 805 HB3    0.00   0.07  -0.06  -0.04   1.80     1.76
1d5mD1 ARG 805 HG2    0.00  -0.01   0.04  -0.04   1.67     1.66
1d5mD1 ARG 805 HG3    0.00  -0.02   0.03  -0.04   1.67     1.64
1d5mD1 ARG 805 HD2    0.00  -0.01  -0.01  -0.04   3.22     3.16
1d5mD1 ARG 805 HD3    0.00   0.02  -0.00  -0.04   3.22     3.19
1d5mD1 ALA 806 H      0.00   0.09   0.11  -0.55   8.40     8.06
1d5mD1 ALA 806 HA     0.00   0.14   0.86  -0.75   4.34     4.59
1d5mD1 ALA 806 HB3    0.00   0.02   0.06  -0.04   1.41     1.44
1d5mD1 MET 807 H      0.00   0.16   0.08  -0.55   8.47     8.16
1d5mD1 MET 807 HA     0.00   0.16   0.49  -0.75   4.52     4.42
1d5mD1 MET 807 HB2    0.00   0.02   0.02  -0.04   2.15     2.15
1d5mD1 MET 807 HB3    0.00  -0.00   0.09  -0.04   2.03     2.08
1d5mD1 MET 807 HG2    0.00  -0.03   0.00  -0.04   2.63     2.56
1d5mD1 MET 807 HG3    0.00   0.04   0.01  -0.04   2.56     2.57
1d5mD1 MET 807 HE3    0.00  -0.00  -0.03  -0.04   2.10     2.03
1d5mD1 SER 809 HA     0.00  -0.01  -0.04  -0.75   4.49     3.68
1d5mD1 SER 809 HB2    0.00  -0.00   0.08  -0.04   3.95     3.98
1d5mD1 SER 809 HB3    0.00  -0.01   0.02  -0.04   3.93     3.90