============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. PHE 6 1.000 42.432 45.170 -15.954 -99.200 -91.000 TYR 7 0.840 45.525 37.215 -13.313 -99.200 -91.000 PHE 25 1.000 47.409 47.315 -2.854 -99.200 -91.000 TYR 47 0.840 39.424 48.771 -12.387 -99.200 -91.000 TYR 49 0.840 44.561 55.544 -7.483 -99.200 -91.000 TRP 57 1.040 55.726 32.404 -19.961 -99.200 -91.000 TRP6 57 1.020 56.311 30.130 -19.668 -99.200 -91.000 TRP 66 1.040 49.536 41.107 -19.783 -99.200 -91.000 TRP6 66 1.020 48.401 43.185 -19.749 -99.200 -91.000 TYR 70 0.840 52.858 46.126 -27.145 -99.200 -91.000 PHE 78 1.000 46.995 52.664 -20.430 -99.200 -91.000 TYR 85 0.840 53.864 48.996 -15.485 -99.200 -91.000 PHE 86 1.000 51.743 41.307 -10.480 -99.200 -91.000 TYR 94 0.840 64.677 31.502 -19.852 -99.200 -91.000 PHE 98 1.000 64.825 38.428 -13.047 -99.200 -91.000 TYR 119 0.840 60.141 53.934 -11.089 -99.200 -91.000 TRP 120 1.040 61.575 45.129 -5.779 -99.200 -91.000 TRP6 120 1.020 60.487 45.507 -3.716 -99.200 -91.000 TYR 125 0.840 65.233 40.886 -7.751 -99.200 -91.000 PHE 127 1.000 69.074 42.036 -13.395 -99.200 -91.000 PHE 138 1.000 64.502 44.203 -11.673 -99.200 -91.000 TRP 159 1.040 55.873 46.833 -5.574 -99.200 -91.000 TRP6 159 1.020 53.997 46.127 -6.832 -99.200 -91.000 PHE 167 1.000 48.300 52.268 -6.824 -99.200 -91.000