============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. PHE 4 1.000 21.335 22.167 57.497 -99.200 -91.000 TRP 5 1.040 20.117 14.050 50.661 -99.200 -91.000 TRP6 5 1.020 21.442 12.084 50.791 -99.200 -91.000 TYR 23 0.840 29.509 13.626 49.280 -99.200 -91.000 PHE 49 1.000 37.139 17.236 60.166 -99.200 -91.000 TRP 50 1.040 35.839 22.579 53.249 -99.200 -91.000 TRP6 50 1.020 34.044 21.085 52.831 -99.200 -91.000 TYR 52 0.840 32.183 27.650 60.922 -99.200 -91.000 TYR 58 0.840 29.429 32.231 55.653 -99.200 -91.000 PHE 64 1.000 26.452 26.798 52.679 -99.200 -91.000 PHE 66 1.000 31.988 25.211 51.501 -99.200 -91.000 PHE 79 1.000 35.237 21.783 48.252 -99.200 -91.000 PHE 81 1.000 28.661 20.527 49.272 -99.200 -91.000 PHE 90 1.000 24.406 33.541 55.082 -99.200 -91.000