============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 26 rings ring int. center anis. iso. TYR 30 0.840 -26.672 1.012 -6.003 -99.200 -91.000 HIS 36 0.900 -22.560 1.284 -3.502 -99.200 -91.000 TRP 39 1.040 -15.136 -0.638 7.792 -99.200 -91.000 TRP6 39 1.020 -15.913 -0.319 10.004 -99.200 -91.000 TYR 53 0.840 -12.893 1.166 -2.980 -99.200 -91.000 PHE 66 1.000 -5.502 0.122 8.575 -99.200 -91.000 PHE 75 1.000 -21.786 -4.686 5.946 -99.200 -91.000 TYR 90 0.840 -9.530 3.121 12.695 -99.200 -91.000 PHE 91 1.000 -16.143 9.017 12.571 -99.200 -91.000 HIS 97 0.900 -30.757 1.173 0.507 -99.200 -91.000 PHE 98 1.000 -27.800 8.728 -2.426 -99.200 -91.000 PHE 102 1.000 -20.574 9.802 7.809 -99.200 -91.000 PHE 122 1.000 5.690 26.397 33.978 -99.200 -91.000 PHE 139 1.000 1.999 23.637 31.258 -99.200 -91.000 PHE 143 1.000 -1.268 12.130 32.971 -99.200 -91.000 TYR 144 0.840 -1.447 4.165 29.870 -99.200 -91.000 TRP 152 1.040 -4.080 23.534 41.498 -99.200 -91.000 TRP6 152 1.020 -2.200 24.772 40.789 -99.200 -91.000 TRP 167 1.040 -6.630 14.476 31.412 -99.200 -91.000 TRP6 167 1.020 -8.096 15.403 33.033 -99.200 -91.000 TYR 177 0.840 -4.187 9.116 27.472 -99.200 -91.000 TYR 190 0.840 0.597 35.110 43.131 -99.200 -91.000 HIS 193 0.900 -3.887 33.112 51.000 -99.200 -91.000 TYR 196 0.840 0.350 30.839 45.794 -99.200 -91.000 HIS 202 0.900 -4.028 5.973 38.625 -99.200 -91.000 PHE 213 1.000 4.618 29.763 42.994 -99.200 -91.000