============================================================================= 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. PHE 9 1.000 11.261 25.961 -8.015 -99.200 -91.000 PHE 12 1.000 16.090 20.394 -3.268 -99.200 -91.000 TYR 19 0.840 3.614 28.482 -6.020 -99.200 -91.000 HIS 27 0.900 10.127 12.406 -0.856 -99.200 -91.000 TYR 58 0.840 13.651 29.797 -11.078 -99.200 -91.000 PHE 61 1.000 15.917 26.480 -5.338 -99.200 -91.000