============================================================================= 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. TYR 6 0.840 -19.641 40.433 45.060 -99.200 -91.000 TYR 17 0.840 -20.143 56.125 53.182 -99.200 -91.000 PHE 20 1.000 -19.005 54.981 58.268 -99.200 -91.000 PHE 28 1.000 -27.004 64.575 56.745 -99.200 -91.000 PHE 30 1.000 -27.998 58.041 54.402 -99.200 -91.000 TRP 39 1.040 -22.393 56.023 46.258 -99.200 -91.000 TRP6 39 1.020 -22.392 56.137 48.626 -99.200 -91.000 HIS 46 0.900 -20.037 49.633 32.006 -99.200 -91.000 PHE 49 1.000 -18.908 46.729 35.864 -99.200 -91.000 TYR 62 0.840 -19.443 45.792 40.579 -99.200 -91.000 PHE 78 1.000 -9.666 50.489 63.414 -99.200 -91.000 PHE 108 1.000 -29.107 66.316 31.120 -99.200 -91.000 TYR 112 0.840 -30.029 59.573 36.047 -99.200 -91.000 PHE 116 1.000 -24.384 60.041 34.590 -99.200 -91.000 TYR 123 0.840 -13.906 48.216 35.327 -99.200 -91.000 PHE 129 1.000 -3.310 59.695 28.315 -99.200 -91.000 TYR 147 0.840 -18.972 54.915 34.491 -99.200 -91.000 TRP 159 1.040 -12.309 73.051 40.196 -99.200 -91.000 TRP6 159 1.020 -12.681 70.776 40.745 -99.200 -91.000 PHE 184 1.000 -1.610 64.467 32.065 -99.200 -91.000 PHE 188 1.000 -3.142 59.029 33.869 -99.200 -91.000 TYR 197 0.840 -19.184 51.735 43.011 -99.200 -91.000 TYR 207 0.840 -17.804 67.152 33.584 -99.200 -91.000 PHE 208 1.000 -21.676 63.894 32.557 -99.200 -91.000