=============================================================================
          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
=============================================================================
2iaeM1 LEU   7 HA     0.00  -0.01   0.03  -0.75   4.35     3.61
2iaeM1 LEU   7 HB2    0.00  -0.00   0.02  -0.04   1.64     1.61
2iaeM1 LEU   7 HB3    0.00  -0.00   0.02  -0.04   1.64     1.62
2iaeM1 LEU   7 HG     0.00  -0.01   0.01  -0.04   1.64     1.60
2iaeM1 LEU   7 HD13   0.00  -0.00   0.01  -0.04   0.93     0.89
2iaeM1 LEU   7 HD23   0.00   0.00   0.01  -0.04   0.89     0.86
2iaeM1 ARG   2 HA     0.00   0.02   0.12  -0.75   4.34     3.72
2iaeM1 ARG   2 HB2    0.00  -0.01   0.02  -0.04   1.90     1.87
2iaeM1 ARG   2 HB3    0.00   0.01   0.00  -0.04   1.80     1.78
2iaeM1 ARG   2 HG2    0.00  -0.01   0.02  -0.04   1.67     1.65
2iaeM1 ARG   2 HG3    0.00  -0.01   0.01  -0.04   1.67     1.63
2iaeM1 ARG   2 HD2    0.00  -0.01   0.01  -0.04   3.22     3.18
2iaeM1 ARG   2 HD3    0.00   0.01   0.01  -0.04   3.22     3.19