============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. HIS 24 0.900 16.762 15.397 -22.836 -99.200 -91.000 PHE 28 1.000 19.257 19.291 -17.809 -99.200 -91.000 TYR 32 0.840 17.283 23.024 -7.770 -99.200 -91.000 HIS 57 0.900 26.551 26.895 -11.678 -99.200 -91.000 PHE 58 1.000 20.566 22.040 -13.717 -99.200 -91.000 TRP 70 1.040 28.812 18.729 -28.518 -99.200 -91.000 TRP6 70 1.020 30.790 18.193 -27.344 -99.200 -91.000 PHE 85 1.000 26.655 20.858 -12.727 -99.200 -91.000 PHE 111 1.000 26.435 15.462 -6.493 -99.200 -91.000 TRP 128 1.040 40.243 10.383 -6.467 -99.200 -91.000 TRP6 128 1.020 41.081 8.924 -4.814 -99.200 -91.000 HIS 140 0.900 41.427 6.764 -19.095 -99.200 -91.000 TYR 144 0.840 38.961 10.095 -23.071 -99.200 -91.000 PHE 165 1.000 43.360 13.191 -20.464 -99.200 -91.000 HIS 214 0.900 34.507 35.179 -25.422 -99.200 -91.000 TYR 228 0.840 54.986 19.425 -23.926 -99.200 -91.000 HIS 238 0.900 58.078 25.992 -13.237 -99.200 -91.000