============================================================================= 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 2 0.900 20.823 26.082 23.796 -99.200 -91.000 HIS 22 0.900 37.144 13.410 4.092 -99.200 -91.000 TYR 43 0.840 46.811 19.912 22.538 -99.200 -91.000 TRP 71 1.040 43.875 24.954 16.352 -99.200 -91.000 TRP6 71 1.020 42.018 25.323 17.762 -99.200 -91.000 PHE 75 1.000 42.990 17.029 12.363 -99.200 -91.000 PHE 77 1.000 39.335 10.761 13.530 -99.200 -91.000 TRP 93 1.040 42.999 18.150 26.002 -99.200 -91.000 TRP6 93 1.020 43.503 17.466 28.202 -99.200 -91.000 TRP 95 1.040 52.674 22.228 24.717 -99.200 -91.000 TRP6 95 1.020 54.159 24.011 25.131 -99.200 -91.000 PHE 103 1.000 38.309 19.410 29.144 -99.200 -91.000 PHE 109 1.000 29.939 16.921 17.095 -99.200 -91.000 TRP 122 1.040 30.929 29.661 14.798 -99.200 -91.000 TRP6 122 1.020 33.032 30.109 15.753 -99.200 -91.000 TYR 123 0.840 28.301 21.890 16.986 -99.200 -91.000 TYR 133 0.840 28.649 10.100 28.984 -99.200 -91.000 TYR 134 0.840 24.645 14.660 27.174 -99.200 -91.000