============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. TYR 2 0.840 78.774 5.530 29.573 -99.200 -91.000 PHE 9 1.000 88.748 7.796 32.870 -99.200 -91.000 PHE 16 1.000 80.323 13.908 30.205 -99.200 -91.000 TYR 20 0.840 77.395 16.775 34.856 -99.200 -91.000 PHE 36 1.000 101.550 45.494 40.665 -99.200 -91.000 TYR 67 0.840 106.659 37.688 52.598 -99.200 -91.000 PHE 85 1.000 95.818 20.567 51.872 -99.200 -91.000 TYR 97 0.840 111.794 21.940 52.538 -99.200 -91.000 TYR 117 0.840 88.725 14.871 48.759 -99.200 -91.000 TYR 120 0.840 91.886 7.556 45.730 -99.200 -91.000 TYR 126 0.840 88.111 19.560 48.258 -99.200 -91.000 PHE 132 1.000 96.250 28.906 45.766 -99.200 -91.000 PHE 143 1.000 101.731 29.220 39.965 -99.200 -91.000 TYR 154 0.840 95.986 31.503 33.790 -99.200 -91.000 PHE 169 1.000 88.910 45.842 29.671 -99.200 -91.000 TYR 174 0.840 98.693 41.888 31.625 -99.200 -91.000 TYR 215 0.840 99.224 39.649 48.690 -99.200 -91.000 TYR 218 0.840 95.081 48.949 46.713 -99.200 -91.000 PHE 226 1.000 92.757 52.737 42.380 -99.200 -91.000