============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 31 rings ring int. center anis. iso. TYR 1 0.840 34.536 -11.948 35.734 -99.200 -91.000 HIS 9 0.900 29.121 3.084 32.200 -99.200 -91.000 PHE 22 1.000 15.146 10.584 19.665 -99.200 -91.000 TYR 28 0.840 12.394 20.701 15.447 -99.200 -91.000 PHE 43 1.000 19.445 16.250 -5.500 -99.200 -91.000 TYR 62 0.840 17.373 11.115 -6.827 -99.200 -91.000 TYR 63 0.840 23.674 6.260 -3.386 -99.200 -91.000 TRP 68 1.040 17.793 18.198 10.183 -99.200 -91.000 TRP6 68 1.020 17.546 16.339 8.747 -99.200 -91.000 TRP 75 1.040 25.433 13.411 22.922 -99.200 -91.000 TRP6 75 1.020 24.588 12.917 20.769 -99.200 -91.000 TYR 80 0.840 23.824 11.575 27.762 -99.200 -91.000 PHE 86 1.000 21.223 9.229 18.598 -99.200 -91.000 TRP 94 1.040 10.552 18.200 11.273 -99.200 -91.000 TRP6 94 1.020 12.224 19.211 9.949 -99.200 -91.000 TYR 101 0.840 9.265 22.310 -5.725 -99.200 -91.000 HIS 119 0.900 29.816 16.117 19.710 -99.200 -91.000 PHE 125 1.000 16.589 10.425 5.740 -99.200 -91.000 PHE 133 1.000 13.545 13.979 -14.140 -99.200 -91.000 PHE 152 1.000 14.984 16.618 -6.472 -99.200 -91.000 TRP 155 1.040 3.549 20.037 -1.268 -99.200 -91.000 TRP6 155 1.020 3.842 20.039 -3.620 -99.200 -91.000 TYR 157 0.840 8.037 23.640 7.475 -99.200 -91.000 PHE 160 1.000 11.802 35.618 5.067 -99.200 -91.000 TYR 176 0.840 25.397 7.789 -14.828 -99.200 -91.000 TYR 177 0.840 25.570 0.095 -14.641 -99.200 -91.000 TYR 182 0.840 19.233 6.510 -21.714 -99.200 -91.000 HIS 195 0.900 10.230 36.977 -2.998 -99.200 -91.000 TYR 196 0.840 5.724 30.455 -5.810 -99.200 -91.000 TYR 203 0.840 7.134 29.898 -0.504 -99.200 -91.000 PHE 212 1.000 19.017 12.261 -20.453 -99.200 -91.000