============================================================================= 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. TYR 30 0.840 13.883 -2.619 45.123 -99.200 -91.000 TYR 36 0.840 16.072 -6.964 41.081 -99.200 -91.000 TRP 39 1.040 26.647 -8.016 32.037 -99.200 -91.000 TRP6 39 1.020 27.700 -6.253 30.863 -99.200 -91.000 TYR 53 0.840 19.592 -15.319 36.414 -99.200 -91.000 PHE 66 1.000 30.234 -15.835 27.176 -99.200 -91.000 PHE 75 1.000 26.579 -3.333 38.475 -99.200 -91.000 TYR 90 0.840 29.036 -10.429 24.118 -99.200 -91.000 TYR 91 0.840 22.862 -4.449 22.750 -99.200 -91.000 HIS 97 0.900 17.580 3.345 40.049 -99.200 -91.000 PHE 98 1.000 8.746 2.176 35.235 -99.200 -91.000 PHE 102 1.000 17.106 -2.569 27.157 -99.200 -91.000 PHE 120 1.000 33.504 -19.103 -5.921 -99.200 -91.000 PHE 122 1.000 27.499 -16.826 -9.052 -99.200 -91.000 PHE 143 1.000 36.373 -10.818 2.148 -99.200 -91.000 TYR 144 0.840 40.192 -11.161 9.899 -99.200 -91.000 TRP 152 1.040 31.574 -4.836 -10.784 -99.200 -91.000 TRP6 152 1.020 31.076 -6.995 -11.613 -99.200 -91.000 TYR 177 0.840 34.300 -9.714 8.418 -99.200 -91.000 TYR 190 0.840 24.933 -8.778 -20.305 -99.200 -91.000 HIS 193 0.900 29.749 -1.896 -23.291 -99.200 -91.000 TYR 196 0.840 29.512 -7.324 -19.608 -99.200 -91.000 HIS 202 0.900 41.776 -10.067 1.595 -99.200 -91.000 PHE 213 1.000 30.253 -12.675 -17.799 -99.200 -91.000