============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 11 rings ring int. center anis. iso. HIS 5 0.900 -8.826 53.873 9.044 -99.200 -91.000 PHE 11 1.000 -12.613 52.956 22.348 -99.200 -91.000 PHE 26 1.000 -9.009 47.220 21.240 -99.200 -91.000 TRP 27 1.040 -4.597 47.858 13.609 -99.200 -91.000 TRP6 27 1.020 -2.743 48.372 12.216 -99.200 -91.000 TRP 30 1.040 3.935 45.071 17.622 -99.200 -91.000 TRP6 30 1.020 2.858 43.446 18.967 -99.200 -91.000 TYR 48 0.840 -22.651 40.292 9.656 -99.200 -91.000 TYR 69 0.840 -13.057 49.597 26.745 -99.200 -91.000 PHE 80 1.000 -16.595 48.731 22.712 -99.200 -91.000 PHE 101 1.000 -18.350 37.895 18.227 -99.200 -91.000