=============================================================================
          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  3     0.840     7.895  38.506  65.424  -99.200  -91.000

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
1rfiE1 LEU 721 HA     0.00  -0.04   0.19  -0.75   4.35     3.75
1rfiE1 LEU 721 HB2    0.01  -0.02   0.02  -0.04   1.64     1.62
1rfiE1 LEU 721 HB3   -0.00  -0.02  -0.05  -0.04   1.64     1.53
1rfiE1 LEU 721 HG     0.01   0.00   0.03  -0.04   1.64     1.64
1rfiE1 LEU 721 HD13   0.00  -0.00  -0.00  -0.04   0.93     0.89
1rfiE1 LEU 721 HD23   0.00  -0.00   0.04  -0.04   0.89     0.88
1rfiE1 ASN 722 H      0.04   0.40   0.17  -0.55   8.53     8.60
1rfiE1 ASN 722 HA    -0.03   0.06   0.32  -0.75   4.76     4.35
1rfiE1 ASN 722 HB2   -0.05  -0.17   0.15  -0.04   2.88     2.76
1rfiE1 ASN 722 HB3   -0.05   0.21   0.14  -0.04   2.79     3.06
1rfiE1 ASN 722 HD21   0.00  -0.01  -0.11  -0.04   7.03     6.87
1rfiE1 ASN 722 HD22  -0.02   0.05  -0.13  -0.04   7.74     7.61
1rfiE1 TYR 723 H     -0.03   0.14   0.05  -0.55   8.29     7.90
1rfiE1 TYR 723 HA     0.00   0.14   0.32  -0.75   4.56     4.26
1rfiE1 TYR 723 HB2    0.00   0.00   0.10  -0.04   3.06     3.12
1rfiE1 TYR 723 HB3    0.00   0.03   0.08  -0.04   2.98     3.05
1rfiE1 TYR 723 HD2    0.00   0.00  -0.08  -0.04   7.15     7.03
1rfiE1 TYR 723 HE2    0.00   0.01  -0.02  -0.04   6.85     6.80