============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 34 rings ring int. center anis. iso. TRP 10 1.040 3.380 6.772 76.291 -99.200 -91.000 TRP6 10 1.020 5.479 5.677 76.167 -99.200 -91.000 PHE 14 1.000 0.073 -0.542 77.036 -99.200 -91.000 PHE 23 1.000 5.468 2.101 72.000 -99.200 -91.000 TYR 45 0.840 6.533 -11.466 77.283 -99.200 -91.000 PHE 51 1.000 15.071 -16.278 64.698 -99.200 -91.000 HIS 69 0.900 17.261 -7.497 42.783 -99.200 -91.000 PHE 72 1.000 13.348 -16.474 49.806 -99.200 -91.000 TRP 74 1.040 3.306 -23.090 47.192 -99.200 -91.000 TRP6 74 1.020 1.246 -23.199 46.026 -99.200 -91.000 TRP 84 1.040 2.169 -17.532 54.876 -99.200 -91.000 TRP6 84 1.020 2.279 -18.963 56.773 -99.200 -91.000 PHE 102 1.000 11.975 -15.284 56.461 -99.200 -91.000 TYR 117 0.840 26.068 -15.412 61.185 -99.200 -91.000 PHE 121 1.000 22.862 -11.131 63.863 -99.200 -91.000 TYR 123 0.840 16.538 -12.114 68.158 -99.200 -91.000 PHE 135 1.000 15.644 -21.114 66.322 -99.200 -91.000 TRP 136 1.040 10.903 -18.621 64.169 -99.200 -91.000 TRP6 136 1.020 12.185 -20.252 63.014 -99.200 -91.000 PHE 151 1.000 18.350 -7.922 65.589 -99.200 -91.000 TYR 156 0.840 18.794 4.437 61.880 -99.200 -91.000 TYR 182 0.840 5.093 8.998 59.097 -99.200 -91.000 HIS 185 0.900 13.052 1.107 57.465 -99.200 -91.000 PHE 190 1.000 -1.689 -14.633 67.280 -99.200 -91.000 TRP 203 1.040 6.963 -10.272 70.178 -99.200 -91.000 TRP6 203 1.020 8.478 -9.051 71.557 -99.200 -91.000 TRP 204 1.040 4.150 -2.945 64.300 -99.200 -91.000 TRP6 204 1.020 3.618 -0.638 64.493 -99.200 -91.000 TRP 207 1.040 14.326 2.053 61.717 -99.200 -91.000 TRP6 207 1.020 14.814 -0.213 61.219 -99.200 -91.000 TYR 215 0.840 11.120 9.905 67.581 -99.200 -91.000 PHE 216 1.000 16.702 3.208 66.868 -99.200 -91.000 PHE 217 1.000 7.717 0.679 66.321 -99.200 -91.000 PHE 219 1.000 1.717 -3.230 72.154 -99.200 -91.000