============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. TRP 9 1.040 13.525 51.205 63.685 -99.200 -91.000 TRP6 9 1.020 12.441 49.602 65.051 -99.200 -91.000 TYR 12 0.840 14.462 61.310 57.062 -99.200 -91.000 HIS 16 0.900 18.222 56.737 67.117 -99.200 -91.000 TYR 27 0.840 17.300 39.330 70.246 -99.200 -91.000 TYR 31 0.840 13.219 42.700 65.033 -99.200 -91.000 TYR 33 0.840 21.740 45.214 57.348 -99.200 -91.000 TYR 55 0.840 21.166 28.731 47.918 -99.200 -91.000 PHE 56 1.000 21.143 33.148 43.673 -99.200 -91.000 PHE 74 1.000 38.852 35.554 46.813 -99.200 -91.000 TYR 75 0.840 34.230 35.861 48.342 -99.200 -91.000 TRP 77 1.040 42.519 29.695 48.823 -99.200 -91.000 TRP6 77 1.020 43.054 31.945 49.287 -99.200 -91.000 PHE 87 1.000 38.354 37.152 61.858 -99.200 -91.000 TRP 88 1.040 34.253 31.505 67.700 -99.200 -91.000 TRP6 88 1.020 32.623 33.226 67.746 -99.200 -91.000 TYR 102 0.840 24.061 41.429 62.293 -99.200 -91.000 PHE 106 1.000 19.530 38.460 58.659 -99.200 -91.000 PHE 109 1.000 12.305 41.242 59.584 -99.200 -91.000 TRP 125 1.040 18.080 33.055 47.380 -99.200 -91.000 TRP6 125 1.020 17.812 35.316 48.023 -99.200 -91.000 PHE 150 1.000 45.987 41.268 42.600 -99.200 -91.000