============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 31 rings ring int. center anis. iso. TYR 13 0.840 -25.633 19.762 10.174 -99.200 -91.000 PHE 16 1.000 -29.095 5.123 11.147 -99.200 -91.000 TYR 24 0.840 -37.018 -0.867 2.808 -99.200 -91.000 PHE 29 1.000 -31.033 7.343 6.392 -99.200 -91.000 TYR 32 0.840 -31.246 22.515 7.877 -99.200 -91.000 PHE 46 1.000 -35.593 16.017 -5.920 -99.200 -91.000 TYR 48 0.840 -36.119 12.061 -1.602 -99.200 -91.000 TYR 58 0.840 -18.710 15.439 6.473 -99.200 -91.000 TRP 68 1.040 -11.015 14.960 -5.373 -99.200 -91.000 TRP6 68 1.020 -11.423 16.686 -3.817 -99.200 -91.000 HIS 78 0.900 -21.155 11.578 -13.602 -99.200 -91.000 PHE 99 1.000 -19.862 22.196 -3.200 -99.200 -91.000 PHE 103 1.000 -27.894 23.186 2.922 -99.200 -91.000 TYR 112 0.840 -9.934 24.088 25.867 -99.200 -91.000 TYR 132 0.840 -3.630 23.333 18.081 -99.200 -91.000 PHE 143 1.000 -9.026 28.931 7.474 -99.200 -91.000 PHE 144 1.000 -7.063 25.588 10.991 -99.200 -91.000 TYR 152 0.840 -6.205 31.583 11.203 -99.200 -91.000 TRP 156 1.040 -0.597 22.172 7.508 -99.200 -91.000 TRP6 156 1.020 -2.134 20.394 7.453 -99.200 -91.000 PHE 158 1.000 -0.057 20.734 18.217 -99.200 -91.000 TYR 183 0.840 -8.547 17.186 20.342 -99.200 -91.000 PHE 185 1.000 -13.593 18.275 16.528 -99.200 -91.000 PHE 194 1.000 -27.454 18.938 18.046 -99.200 -91.000 TYR 214 0.840 -22.718 23.076 6.541 -99.200 -91.000 TYR 224 0.840 -32.135 16.808 -11.598 -99.200 -91.000 HIS 242 0.900 -35.554 31.911 11.437 -99.200 -91.000 TRP 248 1.040 -34.502 19.404 12.007 -99.200 -91.000 TRP6 248 1.020 -34.718 17.224 12.980 -99.200 -91.000 TRP 249 1.040 -28.408 23.927 15.228 -99.200 -91.000 TRP6 249 1.020 -28.792 23.073 13.064 -99.200 -91.000