============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. PHE 26 1.000 0.061 24.546 11.317 -99.200 -91.000 HIS 39 0.900 12.292 17.866 29.810 -99.200 -91.000 PHE 58 1.000 6.153 25.133 26.933 -99.200 -91.000 PHE 59 1.000 -1.034 23.297 29.243 -99.200 -91.000 HIS 61 0.900 -0.283 17.195 27.625 -99.200 -91.000 TRP 69 1.040 -3.335 14.540 25.313 -99.200 -91.000 TRP6 69 1.020 -3.110 15.675 23.274 -99.200 -91.000 PHE 73 1.000 -7.850 19.822 22.276 -99.200 -91.000 PHE 80 1.000 -3.398 31.504 21.136 -99.200 -91.000 TRP 106 1.040 5.354 -3.044 23.912 -99.200 -91.000 TRP6 106 1.020 5.430 -3.271 21.570 -99.200 -91.000 PHE 118 1.000 -7.533 6.288 22.597 -99.200 -91.000 PHE 119 1.000 -4.296 8.760 26.594 -99.200 -91.000 PHE 146 1.000 3.094 4.638 3.907 -99.200 -91.000 TYR 155 0.840 9.861 6.008 15.284 -99.200 -91.000 TYR 178 0.840 -18.653 13.421 14.931 -99.200 -91.000 HIS 186 0.900 2.755 8.200 6.942 -99.200 -91.000 TYR 189 0.840 16.386 8.283 7.369 -99.200 -91.000 HIS 215 0.900 19.004 16.566 -0.657 -99.200 -91.000 TYR 224 0.840 6.919 25.719 3.149 -99.200 -91.000 TYR 228 0.840 -3.116 19.897 0.772 -99.200 -91.000 PHE 236 1.000 -13.640 14.822 -1.989 -99.200 -91.000 PHE 242 1.000 -2.167 13.985 2.337 -99.200 -91.000 TYR 248 0.840 13.965 4.980 3.882 -99.200 -91.000