============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 30 rings ring int. center anis. iso. TYR 2 0.840 -6.148 -24.011 -3.464 -99.200 -91.000 TRP 6 1.040 -3.859 -31.256 -6.173 -99.200 -91.000 TRP6 6 1.020 -4.059 -28.984 -5.479 -99.200 -91.000 PHE 19 1.000 5.104 -19.849 1.894 -99.200 -91.000 TRP 64 1.040 12.909 -26.962 -3.538 -99.200 -91.000 TRP6 64 1.020 13.366 -27.094 -5.846 -99.200 -91.000 TYR 73 0.840 9.880 -39.340 -14.797 -99.200 -91.000 PHE 74 1.000 14.413 -41.683 -14.247 -99.200 -91.000 TRP 95 1.040 5.730 -30.913 -12.440 -99.200 -91.000 TRP6 95 1.020 7.132 -29.862 -10.811 -99.200 -91.000 TRP 97 1.040 10.633 -27.824 -19.125 -99.200 -91.000 TRP6 97 1.020 10.179 -27.313 -21.407 -99.200 -91.000 TYR 103 0.840 2.096 -19.996 -12.618 -99.200 -91.000 TRP 114 1.040 18.775 -34.272 1.479 -99.200 -91.000 TRP6 114 1.020 21.124 -34.537 1.608 -99.200 -91.000 PHE 116 1.000 21.152 -35.070 -4.515 -99.200 -91.000 PHE 120 1.000 20.682 -28.765 -10.163 -99.200 -91.000 PHE 137 1.000 21.210 -26.252 -4.445 -99.200 -91.000 TRP 144 1.040 21.816 -42.202 -9.534 -99.200 -91.000 TRP6 144 1.020 21.006 -44.129 -8.400 -99.200 -91.000 HIS 162 0.900 31.435 -23.750 -21.852 -99.200 -91.000 TYR 167 0.840 34.412 -29.768 -10.767 -99.200 -91.000 TYR 168 0.840 29.794 -28.064 -9.265 -99.200 -91.000 PHE 175 1.000 25.979 -27.136 -6.692 -99.200 -91.000 HIS 219 0.900 5.498 -14.265 -18.769 -99.200 -91.000 PHE 221 1.000 16.926 -11.280 -18.022 -99.200 -91.000 TRP 229 1.040 21.696 -6.100 -28.225 -99.200 -91.000 TRP6 229 1.020 21.932 -4.189 -26.864 -99.200 -91.000 TYR 235 0.840 9.699 -10.510 -26.696 -99.200 -91.000 TYR 237 0.840 10.103 0.466 -27.678 -99.200 -91.000