============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 26 rings ring int. center anis. iso. TYR 2 0.840 23.361 30.290 16.126 -99.200 -91.000 HIS 12 0.900 14.719 5.869 9.115 -99.200 -91.000 PHE 24 1.000 2.991 -3.470 12.149 -99.200 -91.000 TYR 28 0.840 1.707 -8.200 23.530 -99.200 -91.000 PHE 75 1.000 15.584 -0.696 30.240 -99.200 -91.000 TYR 76 0.840 10.749 -5.156 24.607 -99.200 -91.000 PHE 79 1.000 17.655 4.122 22.579 -99.200 -91.000 PHE 110 1.000 15.076 21.968 30.100 -99.200 -91.000 TYR 111 0.840 17.007 16.569 25.940 -99.200 -91.000 TRP 129 1.040 -15.811 9.802 29.878 -99.200 -91.000 TRP6 129 1.020 -14.725 11.795 29.234 -99.200 -91.000 PHE 140 1.000 -18.509 26.055 33.326 -99.200 -91.000 PHE 161 1.000 -16.342 26.351 8.352 -99.200 -91.000 HIS 176 0.900 -7.628 4.514 -0.259 -99.200 -91.000 PHE 188 1.000 4.742 5.863 1.470 -99.200 -91.000 PHE 234 1.000 -18.391 9.214 13.035 -99.200 -91.000 PHE 274 1.000 11.080 22.875 15.806 -99.200 -91.000 PHE 277 1.000 4.235 22.362 18.114 -99.200 -91.000 PHE 312 1.000 1.475 23.439 2.876 -99.200 -91.000 PHE 318 1.000 -13.214 12.749 11.174 -99.200 -91.000 PHE 322 1.000 -6.372 17.139 2.742 -99.200 -91.000 TYR 324 0.840 -12.621 25.526 6.760 -99.200 -91.000 HIS 347 0.900 -4.773 10.144 13.023 -99.200 -91.000 HIS 362 0.900 13.672 9.836 4.948 -99.200 -91.000 PHE 373 1.000 11.919 27.693 4.229 -99.200 -91.000 PHE 390 1.000 9.642 19.558 10.980 -99.200 -91.000