============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. PHE 20 1.000 22.050 41.966 23.172 -99.200 -91.000 TRP 32 1.040 30.042 39.328 19.828 -99.200 -91.000 TRP6 32 1.020 29.859 41.278 21.131 -99.200 -91.000 HIS 43 0.900 15.444 29.743 11.841 -99.200 -91.000 PHE 45 1.000 18.830 37.802 17.196 -99.200 -91.000 HIS 46 0.900 10.645 39.192 16.134 -99.200 -91.000 HIS 48 0.900 8.717 38.741 21.346 -99.200 -91.000 PHE 50 1.000 5.552 42.660 29.588 -99.200 -91.000 HIS 63 0.900 7.518 41.688 17.181 -99.200 -91.000 PHE 64 1.000 11.449 47.985 24.551 -99.200 -91.000 HIS 71 0.900 7.773 43.211 12.607 -99.200 -91.000 HIS 80 0.900 6.633 46.734 16.366 -99.200 -91.000 HIS 110 0.900 14.845 54.125 21.378 -99.200 -91.000 HIS 120 0.900 9.657 34.635 16.688 -99.200 -91.000