============================================================================= 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. TYR 8 0.840 40.958 5.767 0.534 -99.200 -91.000 TYR 15 0.840 38.558 18.479 12.033 -99.200 -91.000 TRP 18 1.040 42.315 15.701 16.999 -99.200 -91.000 TRP6 18 1.020 41.759 17.911 16.378 -99.200 -91.000 TRP 22 1.040 36.001 7.278 17.937 -99.200 -91.000 TRP6 22 1.020 35.195 5.286 16.959 -99.200 -91.000 PHE 23 1.000 38.406 4.187 13.094 -99.200 -91.000 PHE 30 1.000 43.669 3.032 11.788 -99.200 -91.000 TYR 38 0.840 45.227 20.913 -3.675 -99.200 -91.000 PHE 44 1.000 40.567 9.217 -2.844 -99.200 -91.000 TYR 45 0.840 39.591 14.951 -2.382 -99.200 -91.000 PHE 55 1.000 30.121 13.013 2.737 -99.200 -91.000 PHE 64 1.000 35.170 4.998 1.680 -99.200 -91.000 HIS 69 0.900 31.684 8.496 2.035 -99.200 -91.000 PHE 73 1.000 36.818 13.518 14.923 -99.200 -91.000