============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. PHE 27 1.000 11.607 55.974 38.762 -99.200 -91.000 TYR 30 0.840 19.842 49.015 37.808 -99.200 -91.000 TRP 34 1.040 15.632 47.305 54.078 -99.200 -91.000 TRP6 34 1.020 15.558 49.504 54.935 -99.200 -91.000 TYR 35 0.840 23.922 44.995 52.441 -99.200 -91.000 PHE 50 1.000 17.633 39.432 43.965 -99.200 -91.000 TYR 57 0.840 12.842 38.150 53.523 -99.200 -91.000 PHE 65 1.000 13.822 41.450 60.842 -99.200 -91.000 TYR 77 0.840 7.223 51.288 52.658 -99.200 -91.000 TYR 91 0.840 18.603 46.603 61.405 -99.200 -91.000 TYR 92 0.840 24.826 51.586 58.015 -99.200 -91.000 TYR 109 0.840 34.018 43.811 50.259 -99.200 -91.000 TYR 113 0.840 24.203 55.089 43.901 -99.200 -91.000 TRP 114 1.040 27.044 51.898 51.283 -99.200 -91.000 TRP6 114 1.020 26.426 50.067 49.957 -99.200 -91.000