============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. PHE 6 1.000 74.105 5.711 70.684 -99.200 -91.000 HIS 19 0.900 55.676 12.491 73.768 -99.200 -91.000 PHE 27 1.000 62.526 10.763 62.169 -99.200 -91.000 TYR 29 0.840 55.996 16.674 54.842 -99.200 -91.000 TYR 31 0.840 51.512 14.382 57.674 -99.200 -91.000 TRP 38 1.040 58.454 16.249 64.589 -99.200 -91.000 TRP6 38 1.020 60.297 15.169 65.590 -99.200 -91.000 HIS 46 0.900 52.901 12.381 69.854 -99.200 -91.000 TRP 53 1.040 37.920 3.971 75.272 -99.200 -91.000 TRP6 53 1.020 37.514 5.571 73.587 -99.200 -91.000 TYR 55 0.840 33.191 -5.633 71.989 -99.200 -91.000 TRP 58 1.040 36.203 0.757 71.001 -99.200 -91.000 TRP6 58 1.020 37.190 2.492 69.742 -99.200 -91.000 PHE 63 1.000 24.630 5.062 69.355 -99.200 -91.000 TRP 81 1.040 20.430 -6.306 69.514 -99.200 -91.000 TRP6 81 1.020 22.050 -5.015 70.640 -99.200 -91.000 HIS 94 0.900 22.764 1.148 82.114 -99.200 -91.000