============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. PHE 12 1.000 -31.888 -20.845 -14.351 -99.200 -91.000 TYR 26 0.840 -19.329 -34.050 9.014 -99.200 -91.000 HIS 35 0.900 -14.569 -18.138 5.683 -99.200 -91.000 TYR 53 0.840 -27.123 -18.034 6.310 -99.200 -91.000 HIS 56 0.900 -32.127 -31.279 12.600 -99.200 -91.000 HIS 65 0.900 -19.385 -29.315 12.937 -99.200 -91.000 TYR 77 0.840 -24.722 -14.535 16.646 -99.200 -91.000 PHE 81 1.000 -34.530 -16.311 11.247 -99.200 -91.000 PHE 90 1.000 -37.344 -24.998 5.169 -99.200 -91.000 PHE 97 1.000 -27.096 -23.033 -1.900 -99.200 -91.000 TYR 118 0.840 -40.835 -43.225 13.602 -99.200 -91.000 TRP 126 1.040 -41.408 -31.924 2.253 -99.200 -91.000 TRP6 126 1.020 -43.705 -31.440 1.984 -99.200 -91.000 PHE 133 1.000 -31.373 -32.355 -0.790 -99.200 -91.000 TYR 142 0.840 -23.627 -40.446 12.913 -99.200 -91.000 PHE 150 1.000 -30.440 -37.001 -1.528 -99.200 -91.000 PHE 151 1.000 -34.021 -41.215 -5.355 -99.200 -91.000 PHE 159 1.000 -25.363 -35.645 -7.925 -99.200 -91.000