============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 11 rings ring int. center anis. iso. HIS 6 0.900 10.676 39.556 24.786 -99.200 -91.000 PHE 12 1.000 20.289 46.684 30.889 -99.200 -91.000 PHE 27 1.000 22.424 44.065 25.076 -99.200 -91.000 TRP 28 1.040 16.224 40.471 20.101 -99.200 -91.000 TRP6 28 1.020 14.556 40.198 18.472 -99.200 -91.000 TRP 31 1.040 18.353 44.944 11.955 -99.200 -91.000 TRP6 31 1.020 20.678 44.720 12.159 -99.200 -91.000 TYR 49 0.840 21.442 25.918 32.245 -99.200 -91.000 TYR 70 0.840 26.000 47.191 29.664 -99.200 -91.000 PHE 81 1.000 24.128 42.559 32.843 -99.200 -91.000 PHE 102 1.000 29.463 32.968 27.775 -99.200 -91.000