============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 31 rings ring int. center anis. iso. TYR 2 0.840 37.154 11.696 28.285 -99.200 -91.000 HIS 10 0.900 32.121 -0.425 30.457 -99.200 -91.000 PHE 23 1.000 18.620 -10.377 44.215 -99.200 -91.000 TYR 29 0.840 15.934 -21.648 49.473 -99.200 -91.000 PHE 44 1.000 23.054 -15.864 69.353 -99.200 -91.000 TYR 63 0.840 20.960 -10.892 70.706 -99.200 -91.000 TYR 64 0.840 27.133 -5.980 66.785 -99.200 -91.000 TRP 69 1.040 21.154 -18.367 53.845 -99.200 -91.000 TRP6 69 1.020 20.953 -16.480 55.269 -99.200 -91.000 TRP 76 1.040 28.444 -13.835 40.887 -99.200 -91.000 TRP6 76 1.020 27.603 -13.486 43.048 -99.200 -91.000 TYR 81 0.840 26.861 -12.007 36.112 -99.200 -91.000 PHE 87 1.000 24.648 -9.600 45.178 -99.200 -91.000 TRP 95 1.040 14.017 -18.411 52.820 -99.200 -91.000 TRP6 95 1.020 15.689 -19.340 54.203 -99.200 -91.000 TYR 102 0.840 11.935 -22.165 69.765 -99.200 -91.000 HIS 120 0.900 32.962 -16.547 44.046 -99.200 -91.000 PHE 126 1.000 20.023 -10.208 58.112 -99.200 -91.000 PHE 134 1.000 17.245 -13.787 78.312 -99.200 -91.000 PHE 153 1.000 18.683 -16.280 70.473 -99.200 -91.000 TRP 156 1.040 7.095 -19.948 65.511 -99.200 -91.000 TRP6 156 1.020 7.383 -20.039 67.834 -99.200 -91.000 TYR 158 0.840 11.263 -23.642 56.920 -99.200 -91.000 PHE 161 1.000 14.517 -35.374 60.601 -99.200 -91.000 TYR 177 0.840 29.188 -7.356 78.491 -99.200 -91.000 TYR 178 0.840 29.309 0.278 78.185 -99.200 -91.000 TYR 183 0.840 23.060 -6.146 85.364 -99.200 -91.000 HIS 196 0.900 13.569 -35.546 70.025 -99.200 -91.000 TYR 197 0.840 10.313 -27.889 71.029 -99.200 -91.000 TYR 204 0.840 10.404 -27.997 65.086 -99.200 -91.000 PHE 213 1.000 22.930 -11.817 84.262 -99.200 -91.000