============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 43 rings ring int. center anis. iso. TYR 11 0.840 15.762 4.657 -20.650 -99.200 -91.000 TYR 17 0.840 20.147 13.970 -9.275 -99.200 -91.000 TYR 30 0.840 13.592 11.116 11.097 -99.200 -91.000 PHE 43 1.000 12.358 2.991 -6.853 -99.200 -91.000 PHE 46 1.000 14.451 9.580 -8.814 -99.200 -91.000 HIS 58 0.900 6.919 17.415 -25.573 -99.200 -91.000 TYR 60 0.840 0.430 16.485 -23.882 -99.200 -91.000 HIS 70 0.900 -11.218 7.985 -8.025 -99.200 -91.000 TYR 71 0.840 -5.117 4.001 -14.803 -99.200 -91.000 PHE 74 1.000 2.378 11.495 -11.736 -99.200 -91.000 TYR 77 0.840 -6.377 18.327 -18.971 -99.200 -91.000 TYR 94 0.840 11.280 -9.137 -4.819 -99.200 -91.000 PHE 104 1.000 7.015 -4.223 -13.350 -99.200 -91.000 TYR 109 0.840 -9.559 -9.667 -13.199 -99.200 -91.000 PHE 112 1.000 -8.677 1.599 -14.879 -99.200 -91.000 TYR 122 0.840 -10.199 14.706 -16.353 -99.200 -91.000 PHE 124 1.000 -10.208 2.598 -20.446 -99.200 -91.000 TYR 127 0.840 -7.425 9.032 -18.917 -99.200 -91.000 HIS 130 0.900 -5.422 3.982 -20.472 -99.200 -91.000 TRP 131 1.040 2.238 6.196 -22.735 -99.200 -91.000 TRP6 131 1.020 3.086 8.394 -22.890 -99.200 -91.000 TYR 135 0.840 11.015 4.246 -11.236 -99.200 -91.000 TYR 137 0.840 13.301 -2.878 -4.987 -99.200 -91.000 TYR 150 0.840 22.415 7.865 8.808 -99.200 -91.000 TYR 162 0.840 18.290 2.265 -4.241 -99.200 -91.000 PHE 168 1.000 9.064 -1.310 -17.768 -99.200 -91.000 TRP 173 1.040 -1.357 -2.016 -26.548 -99.200 -91.000 TRP6 173 1.020 -0.674 -3.749 -27.998 -99.200 -91.000 HIS 192 0.900 8.089 -14.800 -14.481 -99.200 -91.000 HIS 194 0.900 15.453 -13.039 -18.411 -99.200 -91.000 TYR 195 0.840 14.831 -3.102 -17.641 -99.200 -91.000 PHE 198 1.000 8.362 -6.683 -18.075 -99.200 -91.000 PHE 205 1.000 -3.372 -9.903 -23.997 -99.200 -91.000 PHE 211 1.000 -4.733 -4.654 -21.789 -99.200 -91.000 TYR 214 0.840 -6.880 -13.150 -21.348 -99.200 -91.000 TRP 215 1.040 -6.051 -8.966 -18.940 -99.200 -91.000 TRP6 215 1.020 -5.958 -10.393 -17.072 -99.200 -91.000 TYR 218 0.840 -8.325 -13.906 -15.821 -99.200 -91.000 TYR 229 0.840 -11.026 -15.806 -21.556 -99.200 -91.000 TYR 235 0.840 -9.580 -13.623 -25.941 -99.200 -91.000 TRP 238 1.040 -15.262 -17.553 -24.441 -99.200 -91.000 TRP6 238 1.020 -15.268 -15.206 -24.574 -99.200 -91.000 TYR 240 0.840 -13.842 -22.681 -33.979 -99.200 -91.000