============================================================================= 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 13.523 51.536 64.191 -99.200 -91.000 TRP6 9 1.020 12.463 49.833 65.452 -99.200 -91.000 TYR 12 0.840 14.033 61.691 57.759 -99.200 -91.000 HIS 16 0.900 18.095 57.102 67.627 -99.200 -91.000 TYR 27 0.840 17.583 39.671 70.626 -99.200 -91.000 TYR 31 0.840 13.374 43.050 65.497 -99.200 -91.000 TYR 33 0.840 21.746 45.830 57.715 -99.200 -91.000 TYR 55 0.840 21.484 29.391 47.979 -99.200 -91.000 PHE 56 1.000 21.304 33.804 43.730 -99.200 -91.000 PHE 74 1.000 38.981 36.717 46.957 -99.200 -91.000 TYR 75 0.840 34.363 36.850 48.498 -99.200 -91.000 TRP 77 1.040 42.814 30.828 48.918 -99.200 -91.000 TRP6 77 1.020 43.311 33.092 49.416 -99.200 -91.000 PHE 87 1.000 38.554 37.864 61.947 -99.200 -91.000 TRP 88 1.040 34.737 32.192 67.772 -99.200 -91.000 TRP6 88 1.020 32.999 33.810 67.848 -99.200 -91.000 TYR 102 0.840 24.215 42.078 62.586 -99.200 -91.000 PHE 106 1.000 19.652 38.864 59.013 -99.200 -91.000 PHE 109 1.000 12.417 41.569 59.972 -99.200 -91.000 TRP 125 1.040 18.199 33.729 47.508 -99.200 -91.000 TRP6 125 1.020 17.867 35.954 48.265 -99.200 -91.000 PHE 150 1.000 46.158 42.609 42.731 -99.200 -91.000