============================================================================= 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 66 0.840 15.673 -22.024 -5.489 -99.200 -91.000 HIS 114 0.900 30.956 -15.899 -9.469 -99.200 -91.000 PHE 118 1.000 39.267 -21.876 -5.839 -99.200 -91.000 HIS 125 0.900 33.754 -29.456 -24.820 -99.200 -91.000 HIS 137 0.900 43.163 -21.734 -7.245 -99.200 -91.000 TYR 138 0.840 37.799 -25.734 -9.027 -99.200 -91.000 TYR 140 0.840 39.630 -31.693 -16.542 -99.200 -91.000 PHE 161 1.000 18.837 -37.068 -22.356 -99.200 -91.000 PHE 163 1.000 24.819 -31.295 -14.872 -99.200 -91.000