============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. PHE 27 1.000 12.355 22.467 46.280 -99.200 -91.000 PHE 29 1.000 6.734 25.587 47.390 -99.200 -91.000 TYR 32 0.840 13.307 21.413 51.456 -99.200 -91.000 TYR 33 0.840 12.902 28.059 57.471 -99.200 -91.000 TRP 36 1.040 9.808 36.257 46.504 -99.200 -91.000 TRP6 36 1.020 10.330 35.925 44.216 -99.200 -91.000 TRP 47 1.040 15.187 38.513 54.135 -99.200 -91.000 TRP6 47 1.020 14.102 39.751 55.835 -99.200 -91.000 TYR 58 0.840 3.033 26.276 55.255 -99.200 -91.000 TYR 62 0.840 6.020 40.330 54.535 -99.200 -91.000 PHE 70 1.000 7.958 44.890 47.287 -99.200 -91.000 TYR 82 0.840 2.121 32.469 42.965 -99.200 -91.000 TYR 95 0.840 12.572 42.506 43.072 -99.200 -91.000 TYR 96 0.840 19.244 37.018 41.761 -99.200 -91.000 TYR 101 0.840 22.091 22.103 53.385 -99.200 -91.000 TYR 103 0.840 22.296 18.380 56.872 -99.200 -91.000 TRP 106 1.040 18.111 32.215 56.820 -99.200 -91.000 TRP6 106 1.020 15.745 32.357 56.951 -99.200 -91.000 PHE 107 1.000 18.861 34.077 51.681 -99.200 -91.000 TYR 109 0.840 19.787 23.506 46.327 -99.200 -91.000 TRP 110 1.040 20.978 31.903 45.951 -99.200 -91.000 TRP6 110 1.020 20.676 34.165 46.548 -99.200 -91.000