=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 1 rings
        ring        int.           center             anis.    iso.
       HIS  2     0.900    26.313 -30.180 -32.281  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
3ewfK1 ARG   2 HA    -0.16  -0.11   0.20  -0.75   4.34     3.51
3ewfK1 ARG   2 HB2   -0.04  -0.03   0.05  -0.04   1.90     1.83
3ewfK1 ARG   2 HB3   -0.02   0.01  -0.02  -0.04   1.80     1.72
3ewfK1 ARG   2 HG2   -0.02   0.09  -0.06  -0.04   1.67     1.64
3ewfK1 ARG   2 HG3   -0.05  -0.05   0.03  -0.04   1.67     1.56
3ewfK1 ARG   2 HD2   -0.01   0.02  -0.03  -0.04   3.22     3.15
3ewfK1 ARG   2 HD3   -0.01  -0.01  -0.01  -0.04   3.22     3.14
3ewfK1 HIS   3 H     -0.17   0.04   0.00  -0.55   8.41     7.74
3ewfK1 HIS   3 HA     0.00   0.16   0.31  -0.75   4.63     4.34
3ewfK1 HIS   3 HB2    0.00  -0.01   0.08  -0.04   3.26     3.30
3ewfK1 HIS   3 HB3    0.00   0.02   0.07  -0.04   3.20     3.24
3ewfK1 HIS   3 HD2    0.00  -0.01   0.02  -0.04   6.97     6.94
3ewfK1 HIS   3 HE1    0.00   0.00  -0.02  -0.04   7.75     7.69