=============================================================================
          SHIFTS, version 4.1   [X.-P. Xu and D.A. Case, Mar. 2002]
=============================================================================
   shifts will be computed for atoms matching ::H*
found 0 rings

=============================================================================
        Atom       RingCur  El   P_anis  Const   RC     pred    Obs
=============================================================================
1t3eP1 ALA 302 H      0.00   0.03   0.08  -0.55   8.40     7.97
1t3eP1 ALA 302 HA     0.00   0.00   0.49  -0.75   4.34     4.08
1t3eP1 ALA 302 HB3    0.00  -0.01   0.06  -0.04   1.41     1.41
1t3eP1 ALA 303 H      0.00   0.00   0.13  -0.55   8.40     7.98
1t3eP1 ALA 303 HA     0.00   0.18   0.35  -0.75   4.34     4.12
1t3eP1 ALA 303 HB3    0.00  -0.01   0.12  -0.04   1.41     1.48
1t3eP1 LYS 304 H      0.00   0.01   0.05  -0.55   8.42     7.92
1t3eP1 LYS 305 H      0.00   0.10   0.03  -0.55   8.42     8.00