============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 25 rings ring int. center anis. iso. HIS 10 0.900 -1.428 23.555 24.328 -99.200 -91.000 TYR 14 0.840 -13.206 20.108 26.790 -99.200 -91.000 TRP 35 1.040 -17.075 28.571 40.738 -99.200 -91.000 TRP6 35 1.020 -17.377 27.467 42.807 -99.200 -91.000 HIS 41 0.900 -12.607 8.958 42.677 -99.200 -91.000 HIS 55 0.900 -0.594 17.559 24.494 -99.200 -91.000 PHE 73 1.000 -17.348 25.609 47.674 -99.200 -91.000 TYR 75 0.840 -24.422 15.357 45.285 -99.200 -91.000 TYR 78 0.840 -17.967 10.423 47.364 -99.200 -91.000 TYR 101 0.840 -3.430 28.640 22.964 -99.200 -91.000 HIS 106 0.900 -20.602 27.095 27.328 -99.200 -91.000 TRP 125 1.040 -2.380 15.085 30.898 -99.200 -91.000 TRP6 125 1.020 -4.287 16.450 31.275 -99.200 -91.000 HIS 129 0.900 -2.823 -3.155 26.325 -99.200 -91.000 TRP 134 1.040 1.347 9.855 36.295 -99.200 -91.000 TRP6 134 1.020 3.034 11.196 35.316 -99.200 -91.000 HIS 156 0.900 -21.208 -5.927 31.053 -99.200 -91.000 TYR 157 0.840 -19.070 -2.211 36.885 -99.200 -91.000 PHE 159 1.000 -28.837 -5.691 39.544 -99.200 -91.000 PHE 193 1.000 -19.213 18.310 32.295 -99.200 -91.000 PHE 199 1.000 -17.862 2.901 39.894 -99.200 -91.000 TYR 214 0.840 -17.292 7.824 32.157 -99.200 -91.000 HIS 221 0.900 -25.793 13.974 40.302 -99.200 -91.000 TRP 224 1.040 -23.958 20.527 45.287 -99.200 -91.000 TRP6 224 1.020 -21.985 19.685 44.299 -99.200 -91.000