============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. HIS 22 0.900 12.537 -19.989 -5.390 -99.200 -91.000 PHE 24 1.000 17.503 -22.759 -7.998 -99.200 -91.000 TRP 32 1.040 21.824 -24.453 -12.461 -99.200 -91.000 TRP6 32 1.020 23.562 -23.120 -11.571 -99.200 -91.000 PHE 35 1.000 23.525 -22.162 -0.420 -99.200 -91.000 HIS 47 0.900 19.513 -8.085 5.017 -99.200 -91.000 PHE 55 1.000 27.940 -17.684 -0.514 -99.200 -91.000 TYR 60 0.840 26.982 -20.680 -3.880 -99.200 -91.000 TYR 69 0.840 7.653 -6.119 -8.055 -99.200 -91.000 TRP 70 1.040 8.032 -6.437 -13.455 -99.200 -91.000 TRP6 70 1.020 7.927 -4.159 -12.827 -99.200 -91.000 PHE 78 1.000 11.869 -10.041 -23.291 -99.200 -91.000 HIS 79 0.900 14.086 -9.901 -18.961 -99.200 -91.000 HIS 81 0.900 14.035 -17.299 -14.380 -99.200 -91.000 PHE 86 1.000 27.004 -15.252 -6.872 -99.200 -91.000 TYR 95 0.840 30.432 -13.074 -2.711 -99.200 -91.000 TYR 104 0.840 8.397 -5.411 -22.608 -99.200 -91.000 TYR 106 0.840 17.463 -9.067 -15.589 -99.200 -91.000