============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. TYR 4 0.840 -7.522 39.272 22.506 -99.200 -91.000 TYR 14 0.840 -5.206 29.539 2.099 -99.200 -91.000 TYR 25 0.840 11.939 32.808 4.231 -99.200 -91.000 PHE 37 1.000 -2.319 26.154 5.783 -99.200 -91.000 HIS 38 0.900 -6.016 19.748 6.491 -99.200 -91.000 TRP 41 1.040 6.853 19.701 13.330 -99.200 -91.000 TRP6 41 1.020 5.260 20.007 15.029 -99.200 -91.000 TYR 59 0.840 -7.819 20.894 17.042 -99.200 -91.000 TRP 60 1.040 -2.824 15.263 15.785 -99.200 -91.000 TRP6 60 1.020 -1.927 14.607 13.691 -99.200 -91.000 TYR 70 0.840 -0.913 25.952 11.867 -99.200 -91.000 TRP 74 1.040 -4.811 14.713 8.191 -99.200 -91.000 TRP6 74 1.020 -2.976 16.136 7.725 -99.200 -91.000 HIS 78 0.900 -11.546 11.587 -0.285 -99.200 -91.000 TRP 80 1.040 -1.865 6.593 -6.056 -99.200 -91.000 TRP6 80 1.020 0.083 5.244 -5.971 -99.200 -91.000 PHE 107 1.000 9.943 4.774 -5.117 -99.200 -91.000 PHE 121 1.000 7.602 20.589 -9.241 -99.200 -91.000 TYR 141 0.840 6.950 17.653 -3.738 -99.200 -91.000 TYR 152 0.840 17.305 15.030 -3.515 -99.200 -91.000