============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 36 rings ring int. center anis. iso. PHE 6 1.000 -5.244 -2.996 14.206 -99.200 -91.000 PHE 8 1.000 -3.689 -7.873 12.661 -99.200 -91.000 PHE 11 1.000 -0.902 -10.920 16.773 -99.200 -91.000 TRP 45 1.040 20.058 -10.788 30.727 -99.200 -91.000 TRP6 45 1.020 21.560 -8.972 30.948 -99.200 -91.000 TYR 53 0.840 -3.221 -1.379 10.857 -99.200 -91.000 HIS 58 0.900 -7.196 12.690 10.055 -99.200 -91.000 TRP 60 1.040 -5.348 15.971 17.062 -99.200 -91.000 TRP6 60 1.020 -5.366 18.335 16.978 -99.200 -91.000 PHE 70 1.000 -8.135 5.726 21.229 -99.200 -91.000 PHE 74 1.000 -3.652 -4.945 24.829 -99.200 -91.000 PHE 76 1.000 -1.339 -8.558 29.304 -99.200 -91.000 TYR 82 0.840 15.294 -17.880 36.419 -99.200 -91.000 PHE 93 1.000 -3.217 0.938 22.347 -99.200 -91.000 PHE 94 1.000 4.011 2.515 20.972 -99.200 -91.000 TYR 106 0.840 17.704 -1.669 29.945 -99.200 -91.000 TYR 108 0.840 13.818 5.299 31.035 -99.200 -91.000 PHE 112 1.000 6.927 7.652 27.688 -99.200 -91.000 TYR 121 0.840 9.428 11.526 25.938 -99.200 -91.000 PHE 128 1.000 -2.050 -3.450 30.536 -99.200 -91.000 PHE 131 1.000 12.566 -3.053 38.824 -99.200 -91.000 TRP 135 1.040 9.336 5.703 36.403 -99.200 -91.000 TRP6 135 1.020 11.555 5.413 35.639 -99.200 -91.000 HIS 142 0.900 2.628 0.231 38.469 -99.200 -91.000 PHE 158 1.000 -1.844 -6.160 36.452 -99.200 -91.000 TYR 172 0.840 -10.057 9.893 24.022 -99.200 -91.000 HIS 180 0.900 -14.452 3.784 28.959 -99.200 -91.000 TYR 185 0.840 -4.619 -12.009 34.824 -99.200 -91.000 TYR 192 0.840 -7.126 -6.610 38.934 -99.200 -91.000 TRP 207 1.040 -2.886 12.196 9.481 -99.200 -91.000 TRP6 207 1.020 -4.087 10.448 8.436 -99.200 -91.000 HIS 226 0.900 7.353 -8.487 28.718 -99.200 -91.000 TYR 229 0.840 -1.332 -15.845 24.167 -99.200 -91.000 TRP 231 1.040 -3.704 -4.569 18.988 -99.200 -91.000 TRP6 231 1.020 -1.919 -3.691 17.708 -99.200 -91.000 PHE 233 1.000 -7.004 1.651 16.890 -99.200 -91.000