============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 7 rings ring int. center anis. iso. HIS 4 0.900 9.361 50.994 19.517 -99.200 -91.000 TYR 24 0.840 11.943 40.415 15.099 -99.200 -91.000 TRP 28 1.040 13.048 41.987 3.307 -99.200 -91.000 TRP6 28 1.020 11.906 41.725 5.358 -99.200 -91.000 PHE 32 1.000 7.589 49.061 -4.447 -99.200 -91.000 TYR 54 0.840 22.406 38.253 -0.929 -99.200 -91.000 HIS 68 0.900 10.510 53.282 10.596 -99.200 -91.000