============================================================================= 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. TRP 14 1.040 24.864 23.806 10.496 -99.200 -91.000 TRP6 14 1.020 25.821 24.085 8.337 -99.200 -91.000 TYR 18 0.840 26.610 19.420 8.375 -99.200 -91.000 PHE 27 1.000 24.390 21.345 3.860 -99.200 -91.000 PHE 32 1.000 33.635 23.099 -0.484 -99.200 -91.000 PHE 36 1.000 34.589 23.703 -6.559 -99.200 -91.000 PHE 46 1.000 38.557 24.786 -2.428 -99.200 -91.000 PHE 59 1.000 35.891 18.744 -3.442 -99.200 -91.000 HIS 62 0.900 38.402 21.286 1.414 -99.200 -91.000 HIS 89 0.900 43.286 26.933 14.967 -99.200 -91.000 HIS 94 0.900 40.478 29.278 5.789 -99.200 -91.000 PHE 104 1.000 36.850 34.117 3.204 -99.200 -91.000 HIS 118 0.900 19.647 19.999 1.540 -99.200 -91.000 PHE 122 1.000 17.865 30.311 4.244 -99.200 -91.000 HIS 125 0.900 17.958 40.831 8.376 -99.200 -91.000 TRP 127 1.040 20.196 30.796 7.851 -99.200 -91.000 TRP6 127 1.020 21.916 29.164 7.932 -99.200 -91.000 TYR 131 0.840 29.113 33.307 4.707 -99.200 -91.000