============================================================================= 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 -92.621 -38.136 -40.783 -99.200 -91.000 TYR 25 0.840 -82.975 -26.439 -24.543 -99.200 -91.000 PHE 26 1.000 -73.158 -23.121 -26.140 -99.200 -91.000 HIS 28 0.900 -83.283 -19.356 -24.365 -99.200 -91.000 PHE 32 1.000 -81.274 -18.763 -18.511 -99.200 -91.000 TRP 35 1.040 -78.724 -11.563 -17.788 -99.200 -91.000 TRP6 35 1.020 -80.650 -12.499 -18.788 -99.200 -91.000 TYR 45 0.840 -72.349 -26.847 -21.732 -99.200 -91.000 HIS 46 0.900 -74.380 -30.299 -17.832 -99.200 -91.000 HIS 54 0.900 -82.189 -35.948 -28.006 -99.200 -91.000 TYR 58 0.840 -83.408 -37.329 -34.861 -99.200 -91.000 PHE 64 1.000 -77.887 -48.850 -41.551 -99.200 -91.000 TYR 107 0.840 -94.183 -43.140 -42.998 -99.200 -91.000 HIS 112 0.900 -93.932 -53.776 -41.356 -99.200 -91.000 TYR 114 0.840 -91.486 -52.790 -36.848 -99.200 -91.000 HIS 130 0.900 -84.330 -32.305 -23.261 -99.200 -91.000 TRP 133 1.040 -85.142 -28.477 -15.164 -99.200 -91.000 TRP6 133 1.020 -84.523 -26.541 -16.343 -99.200 -91.000 TYR 149 0.840 -86.605 -19.712 -11.167 -99.200 -91.000