============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 28 rings ring int. center anis. iso. PHE 18 1.000 0.021 28.027 -17.883 -99.200 -91.000 TYR 23 0.840 3.947 23.742 -17.140 -99.200 -91.000 TYR 44 0.840 11.166 43.761 -16.021 -99.200 -91.000 TYR 45 0.840 6.237 43.305 -16.111 -99.200 -91.000 PHE 46 1.000 4.028 37.438 -14.161 -99.200 -91.000 TYR 53 0.840 0.734 25.118 -13.584 -99.200 -91.000 TYR 54 0.840 5.933 26.649 -9.878 -99.200 -91.000 PHE 57 1.000 -2.666 25.707 -9.481 -99.200 -91.000 TYR 60 0.840 -6.193 34.576 -11.750 -99.200 -91.000 PHE 69 1.000 -12.914 23.758 5.319 -99.200 -91.000 PHE 75 1.000 -13.007 15.799 14.845 -99.200 -91.000 TYR 84 0.840 -13.581 19.839 0.658 -99.200 -91.000 PHE 88 1.000 -11.258 23.601 -1.575 -99.200 -91.000 HIS 91 0.900 -11.473 30.440 -2.854 -99.200 -91.000 TYR 103 0.840 -10.456 15.954 -12.806 -99.200 -91.000 TYR 119 0.840 0.484 29.426 -3.694 -99.200 -91.000 PHE 120 1.000 -8.461 24.061 -5.709 -99.200 -91.000 PHE 124 1.000 -10.844 19.349 -4.041 -99.200 -91.000 PHE 140 1.000 -20.665 12.724 5.117 -99.200 -91.000 HIS 141 0.900 -25.203 5.845 5.811 -99.200 -91.000 PHE 142 1.000 -17.800 7.000 2.106 -99.200 -91.000 PHE 143 1.000 -22.498 1.102 -1.773 -99.200 -91.000 HIS 147 0.900 -16.476 5.515 -8.187 -99.200 -91.000 HIS 150 0.900 -9.891 9.804 -7.323 -99.200 -91.000 TRP 151 1.040 -20.018 11.216 -8.062 -99.200 -91.000 TRP6 151 1.020 -21.325 12.126 -6.311 -99.200 -91.000 PHE 158 1.000 -13.818 17.603 -17.131 -99.200 -91.000 PHE 161 1.000 -21.779 17.238 -14.771 -99.200 -91.000