============================================================================= 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 24 1.000 10.773 -5.415 46.538 -99.200 -91.000 TRP 26 1.040 9.741 -0.876 36.526 -99.200 -91.000 TRP6 26 1.020 8.171 0.614 35.591 -99.200 -91.000 HIS 53 0.900 10.485 12.716 77.745 -99.200 -91.000 TYR 58 0.840 9.137 20.153 64.391 -99.200 -91.000 PHE 63 1.000 10.564 11.706 60.494 -99.200 -91.000 TYR 75 0.840 3.413 8.436 42.590 -99.200 -91.000 PHE 78 1.000 6.802 2.745 39.949 -99.200 -91.000 TRP 81 1.040 12.958 3.447 35.949 -99.200 -91.000 TRP6 81 1.020 12.744 2.873 38.230 -99.200 -91.000 TRP 112 1.040 15.437 16.325 73.185 -99.200 -91.000 TRP6 112 1.020 17.420 17.063 74.209 -99.200 -91.000 HIS 114 0.900 21.051 21.010 66.220 -99.200 -91.000 TRP 115 1.040 11.683 22.479 70.647 -99.200 -91.000 TRP6 115 1.020 10.342 21.564 68.948 -99.200 -91.000 HIS 139 0.900 26.710 15.948 41.465 -99.200 -91.000 TYR 144 0.840 17.358 12.007 45.233 -99.200 -91.000 TYR 155 0.840 13.808 19.759 58.628 -99.200 -91.000