=============================================================================
          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.
       TYR  1     0.840    -7.645  64.707  28.760  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
2r1rP1 TYR   1 HA     0.00  -0.02   0.14  -0.75   4.56     3.93
2r1rP1 TYR   1 HB2    0.00  -0.25   0.06  -0.04   3.06     2.82
2r1rP1 TYR   1 HB3    0.00   0.03   0.04  -0.04   2.98     3.01
2r1rP1 TYR   1 HD2    0.00  -0.03  -0.05  -0.04   7.15     7.03
2r1rP1 TYR   1 HE2    0.00   0.02  -0.01  -0.04   6.85     6.82
2r1rP1 LEU   2 H      0.21   0.11  -0.04  -0.55   8.37     8.10
2r1rP1 LEU   2 HA    -0.03   0.23   0.85  -0.75   4.35     4.64
2r1rP1 LEU   2 HB2    0.05  -0.02  -0.07  -0.04   1.64     1.56
2r1rP1 LEU   2 HB3    0.04  -0.05   0.24  -0.04   1.64     1.83
2r1rP1 LEU   2 HG     0.01   0.02  -0.06  -0.04   1.64     1.57
2r1rP1 LEU   2 HD13   0.01  -0.01   0.03  -0.04   0.93     0.92
2r1rP1 LEU   2 HD23  -0.02   0.03  -0.00  -0.04   0.89     0.86
2r1rP1 VAL   3 H      0.03   0.21  -0.05  -0.55   8.24     7.88
2r1rP1 VAL   3 HA     0.11   0.04   0.43  -0.75   4.13     3.95
2r1rP1 VAL   3 HB     0.01   0.08  -0.29  -0.04   2.12     1.88
2r1rP1 VAL   3 HG13   0.02  -0.03  -0.16  -0.04   0.97     0.76
2r1rP1 VAL   3 HG23  -0.02   0.01  -0.02  -0.04   0.95     0.89
2r1rP1 GLY   4 H      0.04   0.45   0.31  -0.55   8.43     8.68
2r1rP1 GLY   4 HA2    0.03   0.04   0.20  -0.51   4.01     3.77
2r1rP1 GLY   4 HA3    0.04   0.16   0.47  -0.51   4.01     4.17