=============================================================================
          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  2     0.840    -9.551  -3.339  -0.976  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
2nmbB1 ALA   1 HA    -0.27   0.00   0.18  -0.75   4.34     3.50
2nmbB1 ALA   1 HB3   -0.70  -0.03   0.04  -0.04   1.41     0.68
2nmbB1 TYR   2 H     -0.03   0.00  -0.03  -0.55   8.29     7.68
2nmbB1 TYR   2 HA     0.00   0.27   0.90  -0.75   4.56     4.98
2nmbB1 TYR   2 HB2    0.00  -0.09   0.13  -0.04   3.06     3.06
2nmbB1 TYR   2 HB3    0.00   0.09   0.05  -0.04   2.98     3.08
2nmbB1 TYR   2 HD2    0.00  -0.04   0.04  -0.04   7.15     7.11
2nmbB1 TYR   2 HE2    0.00   0.03   0.00  -0.04   6.85     6.84
2nmbB1 ILE   3 H      0.36  -0.01   0.16  -0.55   8.25     8.20
2nmbB1 ILE   3 HA     0.08   0.24   0.90  -0.75   4.18     4.64
2nmbB1 ILE   3 HB     0.02  -0.09   0.13  -0.04   1.89     1.91
2nmbB1 ILE   3 HG12   0.03   0.02  -0.03  -0.04   1.49     1.46
2nmbB1 ILE   3 HG13   0.06   0.25  -0.26  -0.04   1.21     1.22
2nmbB1 ILE   3 HG23   0.02   0.01  -0.08  -0.04   0.93     0.84
2nmbB1 ILE   3 HD13   0.05  -0.03  -0.12  -0.04   0.88     0.74
2nmbB1 GLY   4 H      0.06   0.03   0.17  -0.55   8.43     8.14
2nmbB1 GLY   4 HA2    0.03   0.07   0.36  -0.51   4.01     3.96
2nmbB1 GLY   4 HA3    0.05   0.02   0.36  -0.51   4.01     3.92
2nmbB1 PRO   5 HA     0.05   0.15   0.36  -0.51   4.44     4.49
2nmbB1 PRO   5 HB2    0.02   0.12   0.06  -0.04   2.28     2.44
2nmbB1 PRO   5 HB3    0.07   0.01   0.02  -0.04   2.02     2.08
2nmbB1 PRO   5 HG2    0.04   0.14   0.00  -0.04   2.03     2.16
2nmbB1 PRO   5 HG3    0.13   0.04   0.04  -0.04   2.03     2.21
2nmbB1 PRO   5 HD2    0.32  -0.18  -0.22  -0.04   3.68     3.55
2nmbB1 PRO   5 HD3    0.32   0.09   0.11  -0.04   3.65     4.12
2nmbB1 LEU   7 H      0.04   0.30  -0.00  -0.55   8.37     8.16
2nmbB1 LEU   7 HA     0.02  -0.06   0.09  -0.75   4.35     3.64
2nmbB1 LEU   7 HB2    0.02   0.05  -0.03  -0.04   1.64     1.64
2nmbB1 LEU   7 HB3    0.01  -0.08   0.01  -0.04   1.64     1.55
2nmbB1 LEU   7 HG     0.03   0.14   0.12  -0.04   1.64     1.90
2nmbB1 LEU   7 HD13   0.01  -0.03  -0.02  -0.04   0.93     0.85
2nmbB1 LEU   7 HD23   0.02  -0.00   0.06  -0.04   0.89     0.93