============================================================================= 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 4.806 2.600 44.831 -99.200 -91.000 HIS 13 0.900 -5.541 1.239 40.300 -99.200 -91.000 PHE 22 1.000 -1.385 -3.868 37.095 -99.200 -91.000 TYR 26 0.840 10.620 5.274 41.800 -99.200 -91.000 PHE 30 1.000 19.165 2.129 40.921 -99.200 -91.000 HIS 31 0.900 25.950 6.444 38.853 -99.200 -91.000 HIS 51 0.900 13.369 -4.802 34.151 -99.200 -91.000 PHE 56 1.000 20.560 9.612 32.895 -99.200 -91.000 TRP 60 1.040 24.653 13.761 36.271 -99.200 -91.000 TRP6 60 1.020 24.369 13.777 33.923 -99.200 -91.000 PHE 62 1.000 22.097 4.936 36.127 -99.200 -91.000 TYR 63 0.840 13.609 7.419 37.050 -99.200 -91.000 TYR 66 0.840 12.919 -4.422 38.885 -99.200 -91.000 TYR 67 0.840 5.336 -3.123 35.384 -99.200 -91.000 PHE 70 1.000 -0.856 -6.444 45.409 -99.200 -91.000 TYR 78 0.840 1.340 -9.847 48.077 -99.200 -91.000 HIS 84 0.900 23.578 -0.227 43.903 -99.200 -91.000 TRP 95 1.040 1.748 -3.086 49.954 -99.200 -91.000 TRP6 95 1.020 -0.313 -4.235 50.153 -99.200 -91.000