============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 6 rings ring int. center anis. iso. TRP 38 1.040 17.232 37.513 46.390 -99.200 -91.000 TRP6 38 1.020 18.907 35.847 46.163 -99.200 -91.000 TRP 48 1.040 33.116 36.291 56.146 -99.200 -91.000 TRP6 48 1.020 34.039 35.124 54.306 -99.200 -91.000 TRP 50 1.040 34.357 43.862 49.845 -99.200 -91.000 TRP6 50 1.020 35.762 42.575 48.444 -99.200 -91.000