============================================================================= 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. HIS 23 0.900 19.001 -1.957 -7.422 -99.200 -91.000 TYR 27 0.840 13.472 5.223 -3.996 -99.200 -91.000 HIS 32 0.900 21.768 -1.334 10.116 -99.200 -91.000 TYR 33 0.840 26.548 -5.607 7.453 -99.200 -91.000 HIS 34 0.900 24.306 -6.259 15.617 -99.200 -91.000 PHE 79 1.000 22.274 13.338 2.769 -99.200 -91.000 PHE 82 1.000 23.954 5.083 -3.075 -99.200 -91.000 PHE 95 1.000 9.548 -11.599 17.724 -99.200 -91.000 TYR 96 0.840 15.685 -10.378 23.181 -99.200 -91.000 PHE 122 1.000 14.352 10.778 19.383 -99.200 -91.000 PHE 128 1.000 14.997 11.244 5.602 -99.200 -91.000 PHE 154 1.000 7.683 -12.557 22.217 -99.200 -91.000 TYR 157 0.840 8.056 -7.024 19.118 -99.200 -91.000 HIS 162 0.900 1.309 -0.183 22.142 -99.200 -91.000 TYR 178 0.840 11.556 21.040 8.935 -99.200 -91.000 TRP 204 1.040 2.162 -17.856 15.531 -99.200 -91.000 TRP6 204 1.020 0.993 -16.054 16.528 -99.200 -91.000 PHE 226 1.000 -0.266 3.755 -1.223 -99.200 -91.000 TYR 234 0.840 -3.666 15.685 1.896 -99.200 -91.000 HIS 250 0.900 -14.126 -14.024 18.269 -99.200 -91.000