============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 12 rings ring int. center anis. iso. PHE 6 1.000 12.574 26.037 -0.489 -99.200 -91.000 TYR 14 0.840 15.288 16.868 -8.360 -99.200 -91.000 HIS 24 0.900 46.308 10.732 0.481 -99.200 -91.000 PHE 36 1.000 25.147 19.021 -3.261 -99.200 -91.000 TRP 37 1.040 29.355 16.224 -10.029 -99.200 -91.000 TRP6 37 1.020 31.509 15.775 -9.147 -99.200 -91.000 TYR 58 0.840 41.209 11.503 -0.043 -99.200 -91.000 TYR 64 0.840 40.970 20.082 10.832 -99.200 -91.000 PHE 71 1.000 36.900 14.016 -0.550 -99.200 -91.000 PHE 74 1.000 35.301 18.168 3.361 -99.200 -91.000 TYR 82 0.840 30.944 29.260 -2.919 -99.200 -91.000 TYR 116 0.840 33.629 27.920 14.147 -99.200 -91.000