============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. HIS 1 0.900 40.568 13.007 20.649 -99.200 -91.000 HIS 15 0.900 17.070 41.103 21.113 -99.200 -91.000 TYR 24 0.840 17.027 40.227 14.331 -99.200 -91.000 TYR 34 0.840 29.186 32.866 19.599 -99.200 -91.000 PHE 37 1.000 28.758 19.782 16.341 -99.200 -91.000 HIS 53 0.900 31.731 13.589 27.795 -99.200 -91.000 HIS 60 0.900 25.378 16.682 33.939 -99.200 -91.000 PHE 64 1.000 28.825 30.874 31.808 -99.200 -91.000 HIS 66 0.900 24.848 35.168 33.663 -99.200 -91.000 PHE 67 1.000 23.610 30.309 35.048 -99.200 -91.000 PHE 106 1.000 37.383 28.762 7.955 -99.200 -91.000 HIS 107 0.900 42.682 22.831 4.823 -99.200 -91.000 TYR 119 0.840 22.912 23.853 15.137 -99.200 -91.000 PHE 122 1.000 25.157 20.739 21.731 -99.200 -91.000 HIS 124 0.900 15.855 15.301 20.333 -99.200 -91.000 PHE 125 1.000 21.143 13.500 21.942 -99.200 -91.000 TRP 155 1.040 15.013 41.938 31.522 -99.200 -91.000 TRP6 155 1.020 13.328 40.875 32.793 -99.200 -91.000 TYR 158 0.840 14.790 33.783 34.821 -99.200 -91.000 PHE 167 1.000 24.781 23.374 10.130 -99.200 -91.000 PHE 175 1.000 26.028 38.053 24.602 -99.200 -91.000 PHE 181 1.000 33.433 33.584 34.778 -99.200 -91.000 HIS 183 0.900 34.165 29.973 31.786 -99.200 -91.000 PHE 185 1.000 34.427 24.748 29.518 -99.200 -91.000