============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. PHE 14 1.000 23.921 55.820 16.046 -99.200 -91.000 PHE 37 1.000 31.405 57.348 14.838 -99.200 -91.000 TYR 52 0.840 12.158 33.639 12.494 -99.200 -91.000 TYR 57 0.840 15.742 37.060 16.388 -99.200 -91.000 TYR 67 0.840 28.756 52.258 4.687 -99.200 -91.000 PHE 69 1.000 32.124 54.764 -2.978 -99.200 -91.000 PHE 76 1.000 20.063 37.611 12.147 -99.200 -91.000 TRP 81 1.040 15.305 25.766 13.148 -99.200 -91.000 TRP6 81 1.020 17.214 24.419 13.485 -99.200 -91.000 HIS 82 0.900 15.496 32.825 7.592 -99.200 -91.000 TRP 101 1.040 27.040 48.235 -0.747 -99.200 -91.000 TRP6 101 1.020 25.681 48.687 1.146 -99.200 -91.000 TYR 135 0.840 10.868 27.526 4.978 -99.200 -91.000 PHE 142 1.000 11.523 27.050 9.797 -99.200 -91.000 TRP 149 1.040 16.364 26.778 18.271 -99.200 -91.000 TRP6 149 1.020 18.572 27.048 17.460 -99.200 -91.000 HIS 151 0.900 10.543 30.949 26.134 -99.200 -91.000 TYR 153 0.840 19.606 29.927 21.508 -99.200 -91.000