============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. PHE 1 1.000 40.697 121.367 28.848 -99.200 -91.000 TYR 7 0.840 42.767 123.702 40.736 -99.200 -91.000 HIS 30 0.900 67.594 118.183 47.093 -99.200 -91.000 PHE 31 1.000 65.177 117.603 54.584 -99.200 -91.000 TYR 37 0.840 59.893 126.663 44.054 -99.200 -91.000 TYR 59 0.840 51.792 136.877 50.021 -99.200 -91.000 PHE 66 1.000 45.598 131.858 50.877 -99.200 -91.000 PHE 70 1.000 50.887 122.501 63.405 -99.200 -91.000 PHE 78 1.000 48.386 123.792 67.358 -99.200 -91.000 HIS 82 0.900 45.543 133.079 66.993 -99.200 -91.000 HIS 83 0.900 48.126 136.147 65.865 -99.200 -91.000 TYR 84 0.840 51.351 133.004 59.813 -99.200 -91.000 TYR 125 0.840 41.218 127.865 62.338 -99.200 -91.000 PHE 129 1.000 46.920 117.961 61.815 -99.200 -91.000 PHE 144 1.000 52.227 121.494 48.294 -99.200 -91.000 TYR 145 0.840 48.536 115.073 44.531 -99.200 -91.000 HIS 154 0.900 35.266 129.074 47.730 -99.200 -91.000