============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 12 rings ring int. center anis. iso. TYR 37 0.840 -1.956 -21.851 14.447 -99.200 -91.000 TYR 42 0.840 -24.220 -30.663 17.467 -99.200 -91.000 TYR 44 0.840 -29.091 -32.887 22.888 -99.200 -91.000 PHE 50 1.000 -33.967 -16.380 19.976 -99.200 -91.000 TYR 57 0.840 -31.096 -20.163 20.071 -99.200 -91.000 PHE 59 1.000 -24.377 -17.930 22.104 -99.200 -91.000 HIS 87 0.900 -23.951 -29.592 7.177 -99.200 -91.000 TYR 96 0.840 -29.869 -14.199 19.357 -99.200 -91.000 PHE 99 1.000 -19.213 -13.222 14.340 -99.200 -91.000 PHE 107 1.000 -6.698 -18.884 23.055 -99.200 -91.000 PHE 109 1.000 -0.359 -24.697 20.211 -99.200 -91.000 PHE 114 1.000 -1.763 -19.065 20.068 -99.200 -91.000