============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. HIS 13 0.900 25.276 25.840 1.450 -99.200 -91.000 PHE 17 1.000 23.846 36.296 10.737 -99.200 -91.000 PHE 20 1.000 30.306 45.864 8.940 -99.200 -91.000 PHE 26 1.000 15.987 49.766 9.886 -99.200 -91.000 HIS 27 0.900 15.668 54.539 7.142 -99.200 -91.000 TYR 53 0.840 22.556 36.331 23.661 -99.200 -91.000 TYR 55 0.840 29.580 37.733 14.687 -99.200 -91.000 TRP 67 1.040 20.287 49.941 13.904 -99.200 -91.000 TRP6 67 1.020 18.459 50.997 15.013 -99.200 -91.000 TRP 79 1.040 6.582 44.969 14.342 -99.200 -91.000 TRP6 79 1.020 8.443 46.430 14.635 -99.200 -91.000 TYR 89 0.840 12.637 33.512 15.642 -99.200 -91.000 TRP 92 1.040 8.210 41.190 18.784 -99.200 -91.000 TRP6 92 1.020 9.335 43.154 18.143 -99.200 -91.000 TRP 119 1.040 14.312 39.701 18.345 -99.200 -91.000 TRP6 119 1.020 12.964 39.154 16.453 -99.200 -91.000 PHE 120 1.000 14.241 44.571 24.820 -99.200 -91.000 TYR 130 0.840 26.315 48.626 10.805 -99.200 -91.000 PHE 134 1.000 27.932 40.802 3.985 -99.200 -91.000