============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. TYR 3 0.840 31.390 -20.441 22.452 -99.200 -91.000 TRP 21 1.040 31.799 0.080 32.761 -99.200 -91.000 TRP6 21 1.020 33.711 0.661 31.484 -99.200 -91.000 PHE 40 1.000 49.987 4.541 22.715 -99.200 -91.000 TYR 49 0.840 51.782 -4.068 16.833 -99.200 -91.000 PHE 50 1.000 47.812 1.393 19.340 -99.200 -91.000 HIS 68 0.900 42.398 3.690 19.793 -99.200 -91.000 TYR 74 0.840 30.776 5.127 24.592 -99.200 -91.000 PHE 79 1.000 34.590 -6.646 25.005 -99.200 -91.000 PHE 96 1.000 34.450 -4.271 19.834 -99.200 -91.000 HIS 100 0.900 42.004 -5.160 18.922 -99.200 -91.000 PHE 110 1.000 43.311 -7.558 23.569 -99.200 -91.000 PHE 126 1.000 37.552 0.586 42.072 -99.200 -91.000 TYR 130 0.840 37.564 -4.167 43.021 -99.200 -91.000 TRP 134 1.040 38.269 -4.522 35.167 -99.200 -91.000 TRP6 134 1.020 36.985 -3.922 33.271 -99.200 -91.000