============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. PHE 9 1.000 10.319 27.333 55.329 -99.200 -91.000 TYR 18 0.840 19.396 30.244 53.969 -99.200 -91.000 PHE 25 1.000 12.507 16.902 50.513 -99.200 -91.000 PHE 38 1.000 5.666 6.186 50.331 -99.200 -91.000 TYR 39 0.840 10.309 11.840 51.459 -99.200 -91.000 HIS 56 0.900 -4.152 13.841 60.147 -99.200 -91.000 PHE 67 1.000 1.609 33.068 44.827 -99.200 -91.000 PHE 69 1.000 1.652 28.442 42.882 -99.200 -91.000 PHE 84 1.000 6.643 16.362 51.019 -99.200 -91.000 TRP 119 1.040 11.693 -0.130 34.676 -99.200 -91.000 TRP6 119 1.020 9.911 1.104 33.746 -99.200 -91.000 PHE 120 1.000 15.783 -2.387 35.611 -99.200 -91.000 HIS 124 0.900 17.837 1.021 51.932 -99.200 -91.000 TRP 126 1.040 23.867 3.040 51.049 -99.200 -91.000 TRP6 126 1.020 25.555 1.494 51.618 -99.200 -91.000 PHE 135 1.000 16.211 14.149 50.295 -99.200 -91.000 TYR 163 0.840 29.812 -1.928 60.107 -99.200 -91.000 PHE 164 1.000 26.875 -1.841 55.744 -99.200 -91.000 TYR 172 0.840 29.202 -8.125 43.177 -99.200 -91.000 PHE 175 1.000 36.607 -0.563 39.544 -99.200 -91.000 TYR 182 0.840 26.598 -8.896 29.340 -99.200 -91.000 PHE 189 1.000 17.382 -5.713 41.905 -99.200 -91.000 TRP 241 1.040 22.633 -7.715 41.069 -99.200 -91.000 TRP6 241 1.020 24.808 -6.847 40.772 -99.200 -91.000