============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. HIS 2 0.900 10.850 -27.805 -6.121 -99.200 -91.000 HIS 15 0.900 9.364 -16.119 -3.143 -99.200 -91.000 TYR 16 0.840 11.002 -9.269 -2.557 -99.200 -91.000 PHE 27 1.000 20.056 -12.047 3.992 -99.200 -91.000 PHE 28 1.000 16.729 -8.396 -2.378 -99.200 -91.000 HIS 36 0.900 22.433 -3.087 1.710 -99.200 -91.000 TYR 38 0.840 23.913 -7.827 6.403 -99.200 -91.000 TYR 61 0.840 22.193 -7.016 -0.146 -99.200 -91.000