============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. TYR 10 0.840 4.985 2.618 45.147 -99.200 -91.000 HIS 13 0.900 -5.533 1.293 40.925 -99.200 -91.000 PHE 22 1.000 -1.028 -3.790 37.387 -99.200 -91.000 TYR 26 0.840 10.763 5.346 41.919 -99.200 -91.000 PHE 30 1.000 19.376 2.142 40.981 -99.200 -91.000 HIS 31 0.900 26.176 6.262 38.752 -99.200 -91.000 HIS 51 0.900 13.281 -4.395 34.126 -99.200 -91.000 PHE 56 1.000 20.582 9.608 33.025 -99.200 -91.000 TRP 60 1.040 24.985 13.590 36.268 -99.200 -91.000 TRP6 60 1.020 24.455 13.661 33.959 -99.200 -91.000 PHE 62 1.000 22.242 4.903 36.240 -99.200 -91.000 TYR 63 0.840 13.739 7.590 37.130 -99.200 -91.000 TYR 66 0.840 13.148 -4.175 38.910 -99.200 -91.000 TYR 67 0.840 5.226 -2.984 35.768 -99.200 -91.000 PHE 70 1.000 -0.488 -6.591 45.490 -99.200 -91.000 TYR 78 0.840 1.781 -10.011 48.025 -99.200 -91.000 HIS 84 0.900 23.840 -0.415 43.952 -99.200 -91.000 TRP 95 1.040 2.204 -3.291 50.081 -99.200 -91.000 TRP6 95 1.020 0.149 -4.459 50.291 -99.200 -91.000