============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. HIS 22 0.900 13.875 20.402 5.482 -99.200 -91.000 PHE 24 1.000 19.064 22.873 7.785 -99.200 -91.000 TRP 32 1.040 23.602 24.326 12.411 -99.200 -91.000 TRP6 32 1.020 25.177 22.963 11.313 -99.200 -91.000 PHE 35 1.000 25.305 21.990 0.246 -99.200 -91.000 HIS 47 0.900 19.552 8.127 -5.508 -99.200 -91.000 PHE 55 1.000 28.893 17.137 0.357 -99.200 -91.000 TYR 60 0.840 28.414 20.094 4.073 -99.200 -91.000 TYR 69 0.840 7.787 6.908 7.845 -99.200 -91.000 TRP 70 1.040 8.025 7.222 12.919 -99.200 -91.000 TRP6 70 1.020 7.864 4.948 12.294 -99.200 -91.000 PHE 78 1.000 11.231 10.608 23.071 -99.200 -91.000 HIS 79 0.900 13.943 9.871 18.685 -99.200 -91.000 HIS 81 0.900 14.906 17.408 13.813 -99.200 -91.000 PHE 86 1.000 27.945 14.665 6.879 -99.200 -91.000 TYR 96 0.840 31.098 12.359 2.665 -99.200 -91.000 HIS 105 0.900 8.851 6.039 22.234 -99.200 -91.000 TYR 107 0.840 18.152 9.146 15.207 -99.200 -91.000