============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 29 rings ring int. center anis. iso. TYR 27 0.840 -28.249 16.917 -18.673 -99.200 -91.000 PHE 29 1.000 -34.547 15.581 -15.587 -99.200 -91.000 TYR 32 0.840 -28.384 14.425 -23.291 -99.200 -91.000 TYR 33 0.840 -34.080 6.918 -22.627 -99.200 -91.000 TRP 36 1.040 -32.033 6.263 -10.844 -99.200 -91.000 TRP6 36 1.020 -31.429 7.293 -8.803 -99.200 -91.000 TRP 47 1.040 -29.939 -0.486 -16.116 -99.200 -91.000 TRP6 47 1.020 -31.880 -1.600 -16.870 -99.200 -91.000 TRP 50 1.040 -34.106 2.556 -19.779 -99.200 -91.000 TRP6 50 1.020 -35.915 3.697 -20.775 -99.200 -91.000 TYR 60 0.840 -38.765 0.537 -12.521 -99.200 -91.000 PHE 64 1.000 -31.800 -4.181 -7.800 -99.200 -91.000 TYR 80 0.840 -37.429 13.497 -6.807 -99.200 -91.000 TYR 93 0.840 -28.873 1.612 -3.821 -99.200 -91.000 PHE 94 1.000 -21.801 4.945 -7.886 -99.200 -91.000 TYR 102 0.840 -25.565 12.058 -31.452 -99.200 -91.000 TYR 103 0.840 -21.120 9.544 -29.747 -99.200 -91.000 TYR 107 0.840 -20.707 14.700 -18.431 -99.200 -91.000 TRP 108 1.040 -21.288 7.287 -14.584 -99.200 -91.000 TRP6 108 1.020 -21.747 5.142 -13.708 -99.200 -91.000 TYR 127 0.840 -11.221 2.233 24.978 -99.200 -91.000 TYR 150 0.840 -17.304 3.950 14.372 -99.200 -91.000 PHE 151 1.000 -25.184 1.260 12.883 -99.200 -91.000 TRP 159 1.040 -3.350 10.950 14.046 -99.200 -91.000 TRP6 159 1.020 -3.047 9.575 15.939 -99.200 -91.000 HIS 169 0.900 0.046 4.939 7.061 -99.200 -91.000 PHE 171 1.000 -4.202 1.022 9.236 -99.200 -91.000 TYR 180 0.840 -19.694 0.347 10.483 -99.200 -91.000 HIS 204 0.900 -20.749 8.401 16.211 -99.200 -91.000