============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. HIS 14 0.900 9.737 70.631 0.436 -99.200 -91.000 PHE 25 1.000 -14.719 57.156 11.418 -99.200 -91.000 TRP 34 1.040 -6.029 55.491 10.131 -99.200 -91.000 TRP6 34 1.020 -6.312 57.264 8.587 -99.200 -91.000 PHE 35 1.000 -6.859 48.629 5.455 -99.200 -91.000 PHE 47 1.000 -0.653 52.860 13.432 -99.200 -91.000 TYR 48 0.840 -9.332 46.646 14.811 -99.200 -91.000 PHE 63 1.000 -12.628 55.134 16.510 -99.200 -91.000 TYR 70 0.840 -11.761 63.142 15.896 -99.200 -91.000 HIS 74 0.900 -1.614 63.445 14.347 -99.200 -91.000 TYR 86 0.840 -0.025 56.948 4.091 -99.200 -91.000 PHE 87 1.000 -7.038 53.725 -0.555 -99.200 -91.000 TRP 97 1.040 -20.599 45.120 14.440 -99.200 -91.000 TRP6 97 1.020 -19.636 43.667 16.038 -99.200 -91.000 PHE 101 1.000 -11.782 49.553 2.437 -99.200 -91.000