============================================================================= 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. TRP 5 1.040 -8.644 46.896 37.544 -99.200 -91.000 TRP6 5 1.020 -8.921 45.976 35.374 -99.200 -91.000 PHE 6 1.000 -9.185 39.523 33.930 -99.200 -91.000 PHE 7 1.000 -11.434 39.670 42.229 -99.200 -91.000 HIS 24 0.900 -14.507 52.763 51.600 -99.200 -91.000 PHE 28 1.000 -13.164 48.325 39.789 -99.200 -91.000 PHE 40 1.000 -12.961 40.367 29.247 -99.200 -91.000 PHE 46 1.000 -24.566 51.322 41.199 -99.200 -91.000 HIS 52 0.900 -23.851 41.545 38.898 -99.200 -91.000 PHE 53 1.000 -22.751 49.428 35.339 -99.200 -91.000 TYR 63 0.840 -12.261 45.661 25.522 -99.200 -91.000 PHE 64 1.000 -20.324 50.110 23.421 -99.200 -91.000 TRP 66 1.040 -23.299 53.985 30.811 -99.200 -91.000 TRP6 66 1.020 -25.486 53.222 31.159 -99.200 -91.000 PHE 70 1.000 -13.837 54.090 28.049 -99.200 -91.000 TYR 79 0.840 -14.597 58.217 30.852 -99.200 -91.000 HIS 80 0.900 -16.907 54.422 33.130 -99.200 -91.000 PHE 92 1.000 -17.205 59.606 40.689 -99.200 -91.000