============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 9 rings ring int. center anis. iso. TYR 3 0.840 -7.029 49.394 16.481 -99.200 -91.000 HIS 17 0.900 -3.330 40.589 28.234 -99.200 -91.000 PHE 18 1.000 -8.684 38.233 22.427 -99.200 -91.000 HIS 25 0.900 -21.586 45.116 15.562 -99.200 -91.000 TYR 33 0.840 -11.024 33.298 25.837 -99.200 -91.000 PHE 46 1.000 -16.201 35.382 25.399 -99.200 -91.000 PHE 48 1.000 -16.735 46.335 31.107 -99.200 -91.000 HIS 57 0.900 -23.881 44.820 24.732 -99.200 -91.000 TYR 73 0.840 -18.075 33.520 34.604 -99.200 -91.000