============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. PHE 2 1.000 56.015 27.073 23.665 -99.200 -91.000 PHE 51 1.000 44.031 28.409 22.466 -99.200 -91.000 TYR 79 0.840 45.494 17.252 22.898 -99.200 -91.000 TRP 101 1.040 64.303 20.572 0.243 -99.200 -91.000 TRP6 101 1.020 64.018 19.113 2.080 -99.200 -91.000 PHE 102 1.000 68.061 28.688 -2.403 -99.200 -91.000 TYR 121 0.840 64.806 13.497 10.311 -99.200 -91.000 TYR 122 0.840 65.155 15.114 5.578 -99.200 -91.000 PHE 233 1.000 65.080 35.938 5.687 -99.200 -91.000 HIS 261 0.900 45.520 33.887 13.272 -99.200 -91.000 TYR 268 0.840 57.897 21.822 6.048 -99.200 -91.000 PHE 269 1.000 62.711 18.620 9.808 -99.200 -91.000 PHE 282 1.000 55.870 22.013 16.121 -99.200 -91.000 TYR 283 0.840 56.610 14.180 15.558 -99.200 -91.000