============================================================================= 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. TYR 17 0.840 -55.622 -47.155 -30.599 -99.200 -91.000 TYR 20 0.840 -58.132 -46.144 -35.750 -99.200 -91.000 TRP 40 1.040 -66.120 -35.302 -47.793 -99.200 -91.000 TRP6 40 1.020 -65.130 -34.274 -45.903 -99.200 -91.000 HIS 42 0.900 -63.845 -45.761 -45.509 -99.200 -91.000 PHE 44 1.000 -60.533 -34.842 -44.484 -99.200 -91.000 TYR 55 0.840 -58.604 -36.901 -38.941 -99.200 -91.000 PHE 60 1.000 -62.431 -26.161 -36.099 -99.200 -91.000 HIS 76 0.900 -68.742 -39.615 -23.158 -99.200 -91.000 PHE 84 1.000 -61.998 -48.068 -15.345 -99.200 -91.000 HIS 104 0.900 -39.195 -67.952 -24.940 -99.200 -91.000