============================================================================= 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. TYR 10 0.840 -6.744 -36.331 -38.483 -99.200 -91.000 TYR 25 0.840 -28.862 -37.192 -39.884 -99.200 -91.000 PHE 26 1.000 -34.222 -29.544 -35.296 -99.200 -91.000 HIS 28 0.900 -32.443 -33.771 -45.204 -99.200 -91.000 PHE 32 1.000 -37.893 -36.780 -44.126 -99.200 -91.000 TRP 35 1.040 -43.274 -32.388 -47.398 -99.200 -91.000 TRP6 35 1.020 -41.136 -33.118 -48.071 -99.200 -91.000 TYR 45 0.840 -35.892 -34.104 -32.141 -99.200 -91.000 HIS 46 0.900 -32.291 -41.592 -31.670 -99.200 -91.000 HIS 54 0.900 -22.024 -39.182 -32.660 -99.200 -91.000 TYR 58 0.840 -15.863 -35.551 -32.516 -99.200 -91.000 PHE 64 1.000 -8.163 -33.933 -20.490 -99.200 -91.000 TYR 107 0.840 -1.882 -38.040 -36.026 -99.200 -91.000 HIS 112 0.900 2.305 -44.264 -28.584 -99.200 -91.000 TYR 114 0.840 -2.694 -45.971 -27.417 -99.200 -91.000 HIS 130 0.900 -26.078 -41.771 -36.733 -99.200 -91.000 TRP 133 1.040 -33.404 -45.771 -40.105 -99.200 -91.000 TRP6 133 1.020 -33.820 -43.642 -41.014 -99.200 -91.000 TYR 149 0.840 -39.884 -45.074 -47.318 -99.200 -91.000