============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 23 rings ring int. center anis. iso. HIS 6 0.900 10.182 45.368 58.614 -99.200 -91.000 TYR 16 0.840 -12.910 33.866 59.166 -99.200 -91.000 TRP 48 1.040 -0.280 45.362 54.505 -99.200 -91.000 TRP6 48 1.020 -0.278 46.496 52.429 -99.200 -91.000 HIS 51 0.900 2.564 47.227 60.773 -99.200 -91.000 PHE 55 1.000 1.519 54.428 53.365 -99.200 -91.000 TRP 71 1.040 -10.010 52.270 47.821 -99.200 -91.000 TRP6 71 1.020 -11.914 50.901 47.942 -99.200 -91.000 TYR 81 0.840 -1.428 34.384 48.131 -99.200 -91.000 PHE 86 1.000 -10.713 27.559 46.928 -99.200 -91.000 TYR 92 0.840 -15.486 38.762 46.149 -99.200 -91.000 TYR 96 0.840 -20.457 35.776 50.295 -99.200 -91.000 TYR 122 0.840 -1.211 37.642 39.966 -99.200 -91.000 PHE 132 1.000 -1.229 38.472 48.616 -99.200 -91.000 HIS 147 0.900 -5.892 64.574 43.830 -99.200 -91.000 HIS 162 0.900 11.822 47.732 39.897 -99.200 -91.000 TYR 168 0.840 10.899 35.912 46.528 -99.200 -91.000 HIS 173 0.900 10.771 31.865 41.616 -99.200 -91.000 HIS 200 0.900 -20.988 45.937 39.567 -99.200 -91.000 PHE 201 1.000 -18.798 46.335 44.993 -99.200 -91.000 TYR 202 0.840 -20.294 56.966 42.612 -99.200 -91.000 HIS 213 0.900 -21.094 49.034 57.482 -99.200 -91.000 PHE 216 1.000 -17.337 49.590 49.619 -99.200 -91.000