============================================================================= 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 7 1.000 20.871 56.122 49.335 -99.200 -91.000 PHE 27 1.000 17.387 58.346 59.312 -99.200 -91.000 PHE 28 1.000 12.942 51.503 62.290 -99.200 -91.000 TYR 30 0.840 11.374 48.779 66.820 -99.200 -91.000 TYR 34 0.840 1.210 60.391 63.090 -99.200 -91.000 TYR 55 0.840 13.177 48.857 58.145 -99.200 -91.000 TRP 58 1.040 17.553 59.225 65.705 -99.200 -91.000 TRP6 58 1.020 16.311 61.031 64.784 -99.200 -91.000 PHE 67 1.000 15.393 45.778 76.894 -99.200 -91.000 TYR 81 0.840 15.944 44.672 61.961 -99.200 -91.000 PHE 84 1.000 12.428 41.711 68.706 -99.200 -91.000 HIS 85 0.900 10.775 47.325 61.815 -99.200 -91.000 TRP 86 1.040 4.266 42.608 61.051 -99.200 -91.000 TRP6 86 1.020 3.577 43.835 59.177 -99.200 -91.000 HIS 123 0.900 21.578 50.759 62.865 -99.200 -91.000 PHE 135 1.000 15.310 62.970 57.574 -99.200 -91.000 PHE 141 1.000 9.233 57.132 55.684 -99.200 -91.000 PHE 151 1.000 1.447 57.948 57.827 -99.200 -91.000