============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. TRP 6 1.040 15.235 33.114 33.589 -99.200 -91.000 TRP6 6 1.020 15.360 31.053 34.745 -99.200 -91.000 TRP 42 1.040 41.802 29.297 4.408 -99.200 -91.000 TRP6 42 1.020 40.402 30.194 2.723 -99.200 -91.000 PHE 53 1.000 22.481 29.834 1.999 -99.200 -91.000 TYR 59 0.840 40.916 28.096 9.117 -99.200 -91.000 HIS 69 0.900 34.088 20.483 30.040 -99.200 -91.000 PHE 99 1.000 12.337 18.824 27.979 -99.200 -91.000