============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. TYR 50 0.840 53.617 5.688 62.419 -99.200 -91.000 TYR 54 0.840 49.412 14.481 60.219 -99.200 -91.000 TYR 78 0.840 56.047 7.558 70.722 -99.200 -91.000 PHE 84 1.000 56.323 20.701 62.675 -99.200 -91.000 TRP 98 1.040 49.122 7.957 61.746 -99.200 -91.000 TRP6 98 1.020 47.059 7.615 60.617 -99.200 -91.000 TYR 101 0.840 46.639 -3.118 65.515 -99.200 -91.000 HIS 103 0.900 53.227 -3.020 57.599 -99.200 -91.000 PHE 106 1.000 42.286 8.342 63.940 -99.200 -91.000 TRP 124 1.040 49.406 13.963 80.727 -99.200 -91.000 TRP6 124 1.020 49.928 11.943 79.600 -99.200 -91.000 TYR 125 0.840 47.385 19.024 74.323 -99.200 -91.000 PHE 128 1.000 38.156 13.865 72.267 -99.200 -91.000