=============================================================================
          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  5     1.000   301.771  -6.139   9.398  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
2b0fB1 LEU   2 H     -0.01   0.22   0.10  -0.55   8.37     8.13
2b0fB1 LEU   2 HA    -0.01  -0.08   0.17  -0.75   4.35     3.67
2b0fB1 LEU   2 HB2   -0.01  -0.02  -0.01  -0.04   1.64     1.56
2b0fB1 LEU   2 HB3   -0.01  -0.02  -0.18  -0.04   1.64     1.39
2b0fB1 LEU   2 HG    -0.01   0.00  -0.03  -0.04   1.64     1.57
2b0fB1 LEU   2 HD13  -0.01   0.00   0.01  -0.04   0.93     0.89
2b0fB1 LEU   2 HD23  -0.01   0.00   0.01  -0.04   0.89     0.86
2b0fB1 GLU   3 H     -0.02   0.18  -0.02  -0.55   8.60     8.19
2b0fB1 GLU   3 HA    -0.04   0.23   1.01  -0.75   4.29     4.73
2b0fB1 GLU   3 HB2   -0.03   0.01   0.04  -0.04   2.09     2.07
2b0fB1 GLU   3 HB3   -0.03  -0.02   0.19  -0.04   1.99     2.09
2b0fB1 GLU   3 HG2   -0.07  -0.01  -0.23  -0.04   2.34     1.99
2b0fB1 GLU   3 HG3   -0.06   0.04  -0.02  -0.04   2.34     2.26
2b0fB1 ALA   4 H     -0.05   0.27  -0.14  -0.55   8.40     7.94
2b0fB1 ALA   4 HA    -0.04   0.12   0.89  -0.75   4.34     4.56
2b0fB1 ALA   4 HB3   -0.02   0.01   0.01  -0.04   1.41     1.37
2b0fB1 LEU   5 H     -0.05   0.13   0.14  -0.55   8.37     8.05
2b0fB1 LEU   5 HA    -0.23   0.07   0.53  -0.75   4.35     3.97
2b0fB1 LEU   5 HB2   -0.07  -0.01   0.04  -0.04   1.64     1.55
2b0fB1 LEU   5 HB3   -0.03  -0.01   0.08  -0.04   1.64     1.64
2b0fB1 LEU   5 HG     0.01   0.48  -0.19  -0.04   1.64     1.90
2b0fB1 LEU   5 HD13  -0.14  -0.06   0.06  -0.04   0.93     0.75
2b0fB1 LEU   5 HD23   0.00  -0.03  -0.03  -0.04   0.89     0.80
2b0fB1 PHE   6 H     -0.35   0.07   0.06  -0.55   8.34     7.57
2b0fB1 PHE   6 HA     0.00   0.05   0.31  -0.75   4.62     4.23
2b0fB1 PHE   6 HB2    0.00  -0.01   0.08  -0.04   3.15     3.18
2b0fB1 PHE   6 HB3    0.00  -0.00   0.07  -0.04   3.06     3.09
2b0fB1 PHE   6 HD2    0.00   0.01   0.01  -0.04   7.28     7.25
2b0fB1 PHE   6 HE2    0.00   0.01   0.00  -0.04   7.38     7.35
2b0fB1 PHE   6 HZ     0.00   0.00   0.01  -0.04   7.32     7.29
2b0fB1 GLN   7 H      0.15   0.00   0.07  -0.55   8.47     8.15
2b0fB1 GLN   7 HA     0.07   0.32  -0.05  -0.75   4.36     3.94
2b0fB1 GLN   7 HB2    0.05  -0.01   0.01  -0.04   2.15     2.16
2b0fB1 GLN   7 HB3    0.03  -0.00  -0.01  -0.04   2.02     2.00
2b0fB1 GLN   7 HG2    0.03   0.02  -0.05  -0.04   2.40     2.36
2b0fB1 GLN   7 HG3    0.05   0.22  -0.02  -0.04   2.39     2.59
2b0fB1 GLN   7 HE21   0.01   0.00   0.00  -0.04   6.97     6.95
2b0fB1 GLN   7 HE22   0.01  -0.03   0.01  -0.04   7.69     7.64