============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 12 rings ring int. center anis. iso. PHE 6 1.000 1.539 44.859 29.021 -99.200 -91.000 TYR 14 0.840 4.045 35.692 21.379 -99.200 -91.000 HIS 24 0.900 35.557 29.028 27.235 -99.200 -91.000 PHE 36 1.000 13.561 38.483 26.436 -99.200 -91.000 TRP 37 1.040 18.020 34.930 19.705 -99.200 -91.000 TRP6 37 1.020 20.269 34.583 20.375 -99.200 -91.000 TYR 58 0.840 30.460 30.303 29.506 -99.200 -91.000 TYR 64 0.840 29.905 39.023 40.433 -99.200 -91.000 PHE 71 1.000 25.855 32.625 28.981 -99.200 -91.000 PHE 74 1.000 24.218 37.054 32.981 -99.200 -91.000 TYR 82 0.840 19.863 48.063 26.541 -99.200 -91.000 TYR 116 0.840 22.909 47.053 43.351 -99.200 -91.000