============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 9 rings ring int. center anis. iso. TYR 9 0.840 -24.396 35.985 16.685 -99.200 -91.000 HIS 33 0.900 -20.889 46.842 17.828 -99.200 -91.000 HIS 41 0.900 -15.525 37.787 23.795 -99.200 -91.000 PHE 46 1.000 -17.409 29.099 17.070 -99.200 -91.000 HIS 59 0.900 -25.404 22.536 1.535 -99.200 -91.000 PHE 61 1.000 -25.915 29.786 -0.675 -99.200 -91.000 TYR 74 0.840 -10.235 32.171 19.857 -99.200 -91.000 HIS 91 0.900 -16.238 13.810 2.899 -99.200 -91.000 PHE 117 1.000 -21.058 23.987 9.140 -99.200 -91.000