============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. HIS 7 0.900 22.320 65.219 17.384 -99.200 -91.000 HIS 18 0.900 29.982 47.363 25.389 -99.200 -91.000 TYR 29 0.840 29.863 55.723 36.644 -99.200 -91.000 TRP 32 1.040 31.702 54.221 19.919 -99.200 -91.000 TRP6 32 1.020 33.464 55.547 19.071 -99.200 -91.000 HIS 55 0.900 40.858 75.781 30.188 -99.200 -91.000 PHE 66 1.000 48.867 55.518 17.616 -99.200 -91.000 TYR 83 0.840 34.011 67.464 11.669 -99.200 -91.000 PHE 92 1.000 44.359 58.174 25.073 -99.200 -91.000 PHE 110 1.000 45.124 64.012 25.929 -99.200 -91.000 TRP 124 1.040 36.012 74.731 17.485 -99.200 -91.000 TRP6 124 1.020 36.462 75.001 15.186 -99.200 -91.000 TYR 135 0.840 50.474 49.810 17.118 -99.200 -91.000 PHE 141 1.000 39.470 50.216 17.729 -99.200 -91.000 PHE 145 1.000 36.180 59.117 31.260 -99.200 -91.000 PHE 148 1.000 34.970 66.586 24.066 -99.200 -91.000 HIS 149 0.900 36.154 69.189 31.887 -99.200 -91.000