============================================================================= 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 22 0.900 58.873 -5.789 10.333 -99.200 -91.000 PHE 24 1.000 58.379 -8.419 4.466 -99.200 -91.000 TRP 32 1.040 55.933 -9.976 -1.333 -99.200 -91.000 TRP6 32 1.020 57.350 -8.444 -2.430 -99.200 -91.000 PHE 35 1.000 67.532 -6.908 1.189 -99.200 -91.000 HIS 47 0.900 70.717 6.196 11.374 -99.200 -91.000 PHE 55 1.000 68.646 -1.662 -2.352 -99.200 -91.000 TYR 60 0.840 65.077 -5.086 -2.844 -99.200 -91.000 TYR 69 0.840 54.279 7.135 15.065 -99.200 -91.000 TRP 70 1.040 49.286 6.998 12.875 -99.200 -91.000 TRP6 70 1.020 49.905 9.209 13.393 -99.200 -91.000 PHE 78 1.000 40.996 4.037 6.033 -99.200 -91.000 HIS 79 0.900 45.909 4.721 5.594 -99.200 -91.000 HIS 81 0.900 50.044 -2.814 5.314 -99.200 -91.000 PHE 86 1.000 61.782 0.334 -3.665 -99.200 -91.000 TYR 96 0.840 66.387 2.663 -5.636 -99.200 -91.000 TYR 99 0.840 62.584 12.301 1.550 -99.200 -91.000 TYR 105 0.840 40.790 8.217 10.182 -99.200 -91.000 TYR 107 0.840 50.057 5.389 3.137 -99.200 -91.000