============================================================================= 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. PHE 11 1.000 1.700 -11.226 46.390 -99.200 -91.000 PHE 13 1.000 0.859 -2.073 50.123 -99.200 -91.000 PHE 28 1.000 0.858 21.032 55.395 -99.200 -91.000 TYR 29 0.840 2.522 14.011 57.860 -99.200 -91.000 PHE 35 1.000 11.819 12.576 49.089 -99.200 -91.000 TYR 52 0.840 28.267 -9.800 58.599 -99.200 -91.000 HIS 68 0.900 27.584 3.201 43.073 -99.200 -91.000 PHE 109 1.000 5.687 6.944 61.932 -99.200 -91.000 PHE 125 1.000 8.200 4.557 65.947 -99.200 -91.000 PHE 129 1.000 9.277 1.481 50.068 -99.200 -91.000 TYR 130 0.840 5.596 0.898 53.660 -99.200 -91.000 TYR 133 0.840 3.659 5.148 48.437 -99.200 -91.000 HIS 145 0.900 20.045 -11.796 47.551 -99.200 -91.000 TYR 151 0.840 12.058 -11.530 41.274 -99.200 -91.000 TRP 153 1.040 6.486 -3.687 46.234 -99.200 -91.000 TRP6 153 1.020 6.059 -1.387 46.573 -99.200 -91.000 PHE 161 1.000 2.838 -5.975 47.583 -99.200 -91.000 HIS 180 0.900 6.621 6.395 38.594 -99.200 -91.000 TYR 188 0.840 11.100 17.480 47.877 -99.200 -91.000 HIS 201 0.900 17.342 16.538 56.867 -99.200 -91.000 PHE 204 1.000 26.950 13.191 60.953 -99.200 -91.000 TYR 207 0.840 28.081 2.196 52.232 -99.200 -91.000 PHE 212 1.000 25.354 9.170 37.823 -99.200 -91.000