============================================================================= 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 4 1.000 10.651 42.123 14.680 -99.200 -91.000 PHE 25 1.000 -0.848 30.510 18.697 -99.200 -91.000 PHE 34 1.000 -5.590 35.330 5.836 -99.200 -91.000 TRP 51 1.040 0.161 32.197 4.598 -99.200 -91.000 TRP6 51 1.020 -1.617 33.066 3.308 -99.200 -91.000 PHE 59 1.000 -6.089 20.332 -3.146 -99.200 -91.000 TYR 66 0.840 -0.470 30.699 -0.561 -99.200 -91.000 TYR 67 0.840 5.763 24.425 1.103 -99.200 -91.000 TYR 77 0.840 5.355 12.752 13.571 -99.200 -91.000 PHE 85 1.000 8.437 9.224 11.692 -99.200 -91.000 TRP 91 1.040 4.203 16.142 3.962 -99.200 -91.000 TRP6 91 1.020 2.976 17.537 2.484 -99.200 -91.000 TYR 98 0.840 7.921 24.016 -4.776 -99.200 -91.000 PHE 128 1.000 12.062 13.017 9.144 -99.200 -91.000 PHE 137 1.000 9.591 15.264 18.001 -99.200 -91.000 PHE 146 1.000 1.793 18.630 27.033 -99.200 -91.000 PHE 152 1.000 0.763 27.759 15.655 -99.200 -91.000