============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. TYR 37 0.840 -55.794 6.427 30.383 -99.200 -91.000 PHE 42 1.000 -60.472 3.692 34.115 -99.200 -91.000 TRP 47 1.040 -50.017 9.919 37.954 -99.200 -91.000 TRP6 47 1.020 -49.541 11.504 39.627 -99.200 -91.000 HIS 51 0.900 -44.252 6.134 32.252 -99.200 -91.000 PHE 52 1.000 -45.886 15.183 37.244 -99.200 -91.000 PHE 79 1.000 -48.198 8.782 44.416 -99.200 -91.000 PHE 81 1.000 -40.716 6.818 41.488 -99.200 -91.000 TYR 97 0.840 -40.787 3.814 46.786 -99.200 -91.000 PHE 118 1.000 -37.398 -8.494 47.405 -99.200 -91.000 TYR 130 0.840 -48.220 8.980 57.468 -99.200 -91.000 HIS 132 0.900 -52.818 -0.674 56.259 -99.200 -91.000 HIS 134 0.900 -52.424 9.788 57.860 -99.200 -91.000 HIS 143 0.900 -43.880 -4.864 38.383 -99.200 -91.000 PHE 145 1.000 -40.719 -4.959 33.815 -99.200 -91.000 HIS 146 0.900 -33.915 -8.510 31.976 -99.200 -91.000 TYR 195 0.840 -48.439 -21.108 51.899 -99.200 -91.000 PHE 219 1.000 -55.601 -21.249 36.285 -99.200 -91.000 PHE 225 1.000 -52.102 -2.970 36.681 -99.200 -91.000 HIS 250 0.900 -68.924 -13.705 36.247 -99.200 -91.000