============================================================================= 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 4 0.840 -22.753 -26.839 -33.925 -99.200 -91.000 TYR 20 0.840 -35.871 -28.272 -44.192 -99.200 -91.000 PHE 21 1.000 -32.907 -26.766 -37.107 -99.200 -91.000 TYR 42 0.840 -20.325 -22.099 -36.589 -99.200 -91.000 PHE 44 1.000 -24.148 -20.962 -32.171 -99.200 -91.000 TYR 47 0.840 -36.334 -24.310 -31.356 -99.200 -91.000 HIS 48 0.900 -40.279 -17.802 -27.955 -99.200 -91.000 HIS 51 0.900 -42.006 -30.660 -25.296 -99.200 -91.000 TRP 74 1.040 -29.646 -30.812 -26.151 -99.200 -91.000 TRP6 74 1.020 -31.647 -29.562 -25.978 -99.200 -91.000 PHE 76 1.000 -21.389 -28.769 -23.625 -99.200 -91.000 PHE 87 1.000 0.945 -14.887 -21.643 -99.200 -91.000 PHE 90 1.000 -9.935 -27.791 -17.889 -99.200 -91.000 PHE 107 1.000 -3.745 -23.249 -9.412 -99.200 -91.000 PHE 110 1.000 2.274 -22.133 -7.917 -99.200 -91.000 TYR 113 0.840 -4.231 -16.245 -8.734 -99.200 -91.000 HIS 117 0.900 -12.799 -15.522 -12.612 -99.200 -91.000 TRP 120 1.040 -19.275 -20.557 -9.850 -99.200 -91.000 TRP6 120 1.020 -19.128 -22.063 -8.032 -99.200 -91.000 TYR 130 0.840 -15.421 -26.569 -16.833 -99.200 -91.000 PHE 132 1.000 -11.404 -22.083 -18.338 -99.200 -91.000 PHE 135 1.000 -0.701 -18.265 -12.984 -99.200 -91.000 TRP 162 1.040 0.257 -24.034 -22.081 -99.200 -91.000 TRP6 162 1.020 0.933 -22.107 -20.888 -99.200 -91.000