============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. HIS 5 0.900 37.752 28.194 43.179 -99.200 -91.000 PHE 20 1.000 23.634 19.610 27.013 -99.200 -91.000 PHE 32 1.000 33.537 15.124 35.784 -99.200 -91.000 TRP 37 1.040 42.987 19.247 49.310 -99.200 -91.000 TRP6 37 1.020 44.577 17.521 49.633 -99.200 -91.000 PHE 44 1.000 27.425 14.730 35.886 -99.200 -91.000 TYR 45 0.840 19.536 17.467 39.135 -99.200 -91.000 TRP 54 1.040 15.702 12.705 40.610 -99.200 -91.000 TRP6 54 1.020 17.451 12.155 42.114 -99.200 -91.000 PHE 55 1.000 23.886 10.272 36.779 -99.200 -91.000 HIS 69 0.900 12.618 8.566 41.441 -99.200 -91.000 HIS 71 0.900 9.175 7.179 33.202 -99.200 -91.000 TRP 72 1.040 12.801 1.952 31.790 -99.200 -91.000 TRP6 72 1.020 13.126 4.085 30.823 -99.200 -91.000 TRP 88 1.040 44.357 18.741 38.660 -99.200 -91.000 TRP6 88 1.020 42.252 19.794 38.395 -99.200 -91.000 HIS 89 0.900 41.822 11.292 41.571 -99.200 -91.000 HIS 120 0.900 10.454 11.259 28.872 -99.200 -91.000 PHE 132 1.000 16.231 16.795 43.311 -99.200 -91.000 TRP 154 1.040 30.052 19.512 31.268 -99.200 -91.000 TRP6 154 1.020 29.945 18.031 33.112 -99.200 -91.000