============================================================================= 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 6 1.000 21.854 -40.096 -3.979 -99.200 -91.000 PHE 30 1.000 24.747 -40.482 -11.792 -99.200 -91.000 PHE 56 1.000 57.520 -29.777 -7.317 -99.200 -91.000 PHE 75 1.000 52.612 -27.031 -0.285 -99.200 -91.000 PHE 90 1.000 52.850 -14.154 8.923 -99.200 -91.000 PHE 92 1.000 46.192 -16.520 3.754 -99.200 -91.000 PHE 99 1.000 43.027 -24.674 -10.284 -99.200 -91.000 PHE 156 1.000 36.796 -9.313 3.578 -99.200 -91.000 PHE 163 1.000 35.023 -21.074 -2.214 -99.200 -91.000 TRP 176 1.040 18.441 -14.410 -9.078 -99.200 -91.000 TRP6 176 1.020 16.252 -15.089 -8.570 -99.200 -91.000 TYR 183 0.840 6.826 -5.054 -1.064 -99.200 -91.000 PHE 201 1.000 23.457 -29.399 1.799 -99.200 -91.000 TYR 233 0.840 38.107 -19.420 -11.492 -99.200 -91.000