============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. TYR 20 0.840 -16.907 0.576 17.394 -99.200 -91.000 TYR 22 0.840 -20.934 6.326 14.995 -99.200 -91.000 TYR 29 0.840 -17.018 9.247 21.205 -99.200 -91.000 TRP 40 1.040 -7.279 10.889 25.840 -99.200 -91.000 TRP6 40 1.020 -8.581 9.492 27.239 -99.200 -91.000 TYR 63 0.840 11.881 16.214 20.571 -99.200 -91.000 TYR 65 0.840 6.037 11.591 19.496 -99.200 -91.000 PHE 68 1.000 -3.448 22.613 17.211 -99.200 -91.000 TYR 72 0.840 3.293 18.723 20.662 -99.200 -91.000 TRP 106 1.040 4.329 39.900 -1.272 -99.200 -91.000 TRP6 106 1.020 1.965 39.920 -1.157 -99.200 -91.000 PHE 108 1.000 7.235 34.522 3.520 -99.200 -91.000 PHE 115 1.000 -0.745 34.163 3.914 -99.200 -91.000 TYR 144 0.840 -5.640 22.026 -6.211 -99.200 -91.000 TYR 157 0.840 -14.214 21.695 -9.785 -99.200 -91.000