============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. TYR 5 0.840 37.966 12.910 11.752 -99.200 -91.000 PHE 15 1.000 26.635 2.290 11.526 -99.200 -91.000 TYR 21 0.840 25.110 5.628 24.685 -99.200 -91.000 PHE 23 1.000 23.737 11.972 15.238 -99.200 -91.000 TYR 34 0.840 17.040 4.720 16.533 -99.200 -91.000 TRP 41 1.040 18.200 15.753 19.464 -99.200 -91.000 TRP6 41 1.020 19.056 15.732 17.249 -99.200 -91.000 HIS 53 0.900 23.773 14.869 0.680 -99.200 -91.000 TYR 65 0.840 23.133 20.291 2.123 -99.200 -91.000 TRP 73 1.040 17.749 19.863 12.127 -99.200 -91.000 TRP6 73 1.020 20.011 19.549 12.714 -99.200 -91.000 TYR 84 0.840 34.174 24.258 12.449 -99.200 -91.000 TYR 97 0.840 33.905 18.898 21.603 -99.200 -91.000 TRP 102 1.040 49.706 21.783 19.543 -99.200 -91.000 TRP6 102 1.020 49.674 19.450 20.011 -99.200 -91.000 HIS 109 0.900 47.525 14.948 2.731 -99.200 -91.000