============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 12 rings ring int. center anis. iso. HIS 4 0.900 49.970 -2.206 45.091 -99.200 -91.000 PHE 8 1.000 51.112 11.325 48.434 -99.200 -91.000 PHE 10 1.000 55.778 5.450 55.978 -99.200 -91.000 HIS 14 0.900 55.702 3.996 63.966 -99.200 -91.000 TYR 35 0.840 41.201 0.939 55.895 -99.200 -91.000 TRP 36 1.040 49.102 0.626 58.996 -99.200 -91.000 TRP6 36 1.020 51.151 1.792 59.171 -99.200 -91.000 TYR 37 0.840 47.948 -1.480 50.456 -99.200 -91.000 TYR 40 0.840 61.950 -6.710 47.116 -99.200 -91.000 PHE 49 1.000 53.208 0.724 51.227 -99.200 -91.000 TYR 52 0.840 43.731 5.692 51.497 -99.200 -91.000 TYR 53 0.840 52.425 8.127 52.763 -99.200 -91.000