============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. HIS 21 0.900 27.398 37.632 23.765 -99.200 -91.000 TRP 23 1.040 27.275 32.494 23.495 -99.200 -91.000 TRP6 23 1.020 29.466 33.392 23.419 -99.200 -91.000 TYR 49 0.840 26.074 28.227 16.189 -99.200 -91.000 HIS 67 0.900 12.137 30.985 47.946 -99.200 -91.000 PHE 69 1.000 16.767 31.770 40.271 -99.200 -91.000 TYR 80 0.840 15.775 29.568 25.377 -99.200 -91.000 HIS 81 0.900 15.943 38.221 25.030 -99.200 -91.000 TYR 85 0.840 12.863 29.144 20.779 -99.200 -91.000 PHE 86 1.000 13.101 27.850 29.961 -99.200 -91.000 TYR 88 0.840 8.868 23.682 20.411 -99.200 -91.000 PHE 90 1.000 12.686 22.150 31.474 -99.200 -91.000 TYR 93 0.840 18.168 18.753 26.679 -99.200 -91.000 TYR 94 0.840 15.778 18.852 30.870 -99.200 -91.000 TYR 100 0.840 13.149 18.633 36.773 -99.200 -91.000