============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 11 rings ring int. center anis. iso. TRP 5 1.040 18.235 68.586 83.251 -99.200 -91.000 TRP6 5 1.020 16.407 68.850 81.738 -99.200 -91.000 PHE 20 1.000 -0.280 52.805 73.378 -99.200 -91.000 PHE 38 1.000 8.772 77.599 75.440 -99.200 -91.000 TYR 39 0.840 10.700 71.276 80.299 -99.200 -91.000 PHE 54 1.000 10.116 55.683 74.605 -99.200 -91.000 TRP 62 1.040 2.409 65.706 81.873 -99.200 -91.000 TRP6 62 1.020 2.736 63.807 83.268 -99.200 -91.000 TYR 77 0.840 13.009 52.186 73.152 -99.200 -91.000 PHE 80 1.000 21.635 61.524 74.710 -99.200 -91.000 HIS 82 0.900 18.522 68.139 73.920 -99.200 -91.000