============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. TRP 9 1.040 0.959 88.926 65.928 -99.200 -91.000 TRP6 9 1.020 1.220 86.616 65.479 -99.200 -91.000 TYR 21 0.840 6.219 91.065 50.354 -99.200 -91.000 HIS 23 0.900 12.968 82.573 51.045 -99.200 -91.000 HIS 26 0.900 16.567 83.207 43.693 -99.200 -91.000 PHE 36 1.000 -0.310 100.345 43.773 -99.200 -91.000 TYR 44 0.840 -4.291 94.449 55.789 -99.200 -91.000 TYR 45 0.840 -5.201 99.588 46.297 -99.200 -91.000 PHE 51 1.000 -5.392 100.266 40.602 -99.200 -91.000 TYR 65 0.840 7.719 97.570 55.938 -99.200 -91.000 HIS 77 0.900 9.175 96.062 51.140 -99.200 -91.000 TYR 79 0.840 9.596 90.785 41.543 -99.200 -91.000 PHE 87 1.000 1.084 104.259 41.311 -99.200 -91.000 TYR 119 0.840 14.956 98.724 40.862 -99.200 -91.000 TYR 138 0.840 -14.868 105.263 62.505 -99.200 -91.000 TYR 143 0.840 -2.078 105.909 70.308 -99.200 -91.000 TRP 153 1.040 3.952 114.101 59.524 -99.200 -91.000 TRP6 153 1.020 5.245 112.124 59.809 -99.200 -91.000 TYR 157 0.840 5.055 111.632 53.041 -99.200 -91.000 TYR 164 0.840 15.466 113.778 45.498 -99.200 -91.000 PHE 168 1.000 1.708 114.879 47.707 -99.200 -91.000 PHE 172 1.000 -6.364 114.577 53.919 -99.200 -91.000 TYR 186 0.840 -15.118 106.888 50.014 -99.200 -91.000 HIS 192 0.900 -6.040 99.216 58.808 -99.200 -91.000 TYR 198 0.840 -8.107 99.108 49.895 -99.200 -91.000 TYR 208 0.840 -1.833 110.936 39.759 -99.200 -91.000 TYR 210 0.840 -2.495 103.786 31.626 -99.200 -91.000