============================================================================= 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 36 0.840 -25.347 46.718 75.655 -99.200 -91.000 TRP 39 1.040 -23.093 33.061 73.090 -99.200 -91.000 TRP6 39 1.020 -21.356 31.724 73.963 -99.200 -91.000 TYR 40 0.840 -20.087 37.890 66.806 -99.200 -91.000 TYR 53 0.840 -29.523 40.241 68.050 -99.200 -91.000 TRP 54 1.040 -29.361 43.401 72.836 -99.200 -91.000 TRP6 54 1.020 -31.164 44.103 71.486 -99.200 -91.000 PHE 66 1.000 -26.366 26.779 65.815 -99.200 -91.000 PHE 75 1.000 -23.655 36.701 79.854 -99.200 -91.000 TYR 90 0.840 -20.220 27.069 67.686 -99.200 -91.000 TYR 91 0.840 -13.447 32.796 68.230 -99.200 -91.000 PHE 101 1.000 -14.847 39.476 68.830 -99.200 -91.000 PHE 121 1.000 -0.820 9.934 45.816 -99.200 -91.000 PHE 138 1.000 -5.274 11.873 51.123 -99.200 -91.000 PHE 142 1.000 -7.352 9.771 59.517 -99.200 -91.000 TYR 143 0.840 -14.092 10.748 65.144 -99.200 -91.000 TRP 151 1.040 6.813 7.935 56.128 -99.200 -91.000 TRP6 151 1.020 6.330 7.748 53.826 -99.200 -91.000 TRP 166 1.040 -4.418 14.633 61.267 -99.200 -91.000 TRP6 166 1.020 -2.201 14.642 62.073 -99.200 -91.000 TYR 176 0.840 -10.838 14.925 62.366 -99.200 -91.000 TYR 189 0.840 12.908 8.159 45.385 -99.200 -91.000 HIS 192 0.900 18.371 3.441 51.123 -99.200 -91.000 TYR 195 0.840 11.982 4.981 48.935 -99.200 -91.000 HIS 201 0.900 -7.879 5.652 63.008 -99.200 -91.000 PHE 212 1.000 7.468 4.271 46.045 -99.200 -91.000