============================================================================= 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 9.158 -2.108 34.472 -99.200 -91.000 TRP6 6 1.020 11.499 -2.367 34.268 -99.200 -91.000 TRP 42 1.040 -15.697 -0.491 4.208 -99.200 -91.000 TRP6 42 1.020 -14.264 -1.276 2.498 -99.200 -91.000 PHE 53 1.000 3.907 0.182 2.140 -99.200 -91.000 TYR 59 0.840 -14.810 0.981 8.897 -99.200 -91.000 HIS 68 0.900 -8.500 9.364 30.213 -99.200 -91.000 PHE 97 1.000 13.315 10.353 28.009 -99.200 -91.000