=============================================================================
          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.
       PHE  4     1.000    19.934  15.774  13.047  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
1obxB1 ASP   5 HA     0.01  -0.08   0.18  -0.75   4.63     3.99
1obxB1 ASP   5 HB2    0.01  -0.01  -0.07  -0.04   2.71     2.60
1obxB1 ASP   5 HB3    0.03   0.01  -0.00  -0.04   2.70     2.70
1obxB1 SER   6 H      0.03   0.06   0.09  -0.55   8.46     8.09
1obxB1 SER   6 HA    -0.15   0.08   0.56  -0.75   4.49     4.23
1obxB1 SER   6 HB2    0.12  -0.04   0.08  -0.04   3.95     4.06
1obxB1 SER   6 HB3   -0.47   0.06  -0.01  -0.04   3.93     3.47
1obxB1 VAL   7 H     -0.28   0.16   0.22  -0.55   8.24     7.80
1obxB1 VAL   7 HA    -0.09   0.15   0.87  -0.75   4.13     4.31
1obxB1 VAL   7 HB    -0.07   0.05   0.03  -0.04   2.12     2.09
1obxB1 VAL   7 HG13  -0.12  -0.01   0.02  -0.04   0.97     0.82
1obxB1 VAL   7 HG23  -0.04   0.00  -0.05  -0.04   0.95     0.82
1obxB1 PHE   8 H      0.06   0.23   0.03  -0.55   8.34     8.11
1obxB1 PHE   8 HA     0.00   0.23   0.65  -0.75   4.62     4.74
1obxB1 PHE   8 HB2    0.00   0.02   0.02  -0.04   3.15     3.14
1obxB1 PHE   8 HB3    0.00   0.02   0.03  -0.04   3.06     3.07
1obxB1 PHE   8 HD2    0.00   0.02  -0.11  -0.04   7.28     7.14
1obxB1 PHE   8 HE2    0.00   0.01  -0.09  -0.04   7.38     7.25
1obxB1 PHE   8 HZ     0.00  -0.02  -0.07  -0.04   7.32     7.19