============================================================================= 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. PHE 11 1.000 33.902 26.366 29.760 -99.200 -91.000 TRP 15 1.040 29.662 40.877 27.143 -99.200 -91.000 TRP6 15 1.020 31.733 41.804 26.478 -99.200 -91.000 PHE 28 1.000 38.445 42.640 32.144 -99.200 -91.000 PHE 35 1.000 31.180 22.456 31.955 -99.200 -91.000 HIS 38 0.900 34.347 17.360 19.578 -99.200 -91.000 PHE 54 1.000 52.507 5.005 26.325 -99.200 -91.000 TYR 55 0.840 55.572 3.742 15.812 -99.200 -91.000 PHE 60 1.000 55.798 14.719 20.457 -99.200 -91.000 TYR 62 0.840 47.731 24.208 21.758 -99.200 -91.000 TRP 98 1.040 59.324 8.752 29.084 -99.200 -91.000 TRP6 98 1.020 57.590 7.797 27.797 -99.200 -91.000 PHE 105 1.000 51.875 13.803 31.477 -99.200 -91.000 TYR 117 0.840 44.647 47.461 40.739 -99.200 -91.000 TYR 123 0.840 45.186 23.449 34.404 -99.200 -91.000 HIS 141 0.900 39.289 22.877 40.009 -99.200 -91.000 PHE 144 1.000 35.177 33.009 37.939 -99.200 -91.000 PHE 147 1.000 39.517 25.593 36.651 -99.200 -91.000 PHE 149 1.000 41.330 19.720 34.135 -99.200 -91.000 TYR 150 0.840 36.396 17.114 27.917 -99.200 -91.000 PHE 155 1.000 45.565 9.617 15.794 -99.200 -91.000 PHE 158 1.000 38.442 15.123 22.579 -99.200 -91.000 TYR 162 0.840 36.977 17.926 38.573 -99.200 -91.000 HIS 164 0.900 34.601 24.109 40.099 -99.200 -91.000 PHE 166 1.000 31.365 30.558 37.289 -99.200 -91.000 TYR 181 0.840 35.923 23.582 44.415 -99.200 -91.000 PHE 183 1.000 40.547 16.752 39.119 -99.200 -91.000