============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. HIS 10 0.900 25.086 9.764 10.380 -99.200 -91.000 TYR 11 0.840 30.699 9.253 5.467 -99.200 -91.000 HIS 15 0.900 38.709 4.261 4.876 -99.200 -91.000 TRP 17 1.040 28.524 4.928 1.062 -99.200 -91.000 TRP6 17 1.020 26.232 4.516 0.649 -99.200 -91.000 TYR 33 0.840 40.880 7.202 1.814 -99.200 -91.000 PHE 43 1.000 33.339 -11.615 -6.605 -99.200 -91.000 PHE 59 1.000 29.128 -6.019 4.443 -99.200 -91.000 TYR 72 0.840 35.973 -4.923 8.677 -99.200 -91.000 TYR 98 0.840 29.980 8.698 -1.104 -99.200 -91.000 TRP 102 1.040 22.665 0.447 -4.237 -99.200 -91.000 TRP6 102 1.020 21.683 -1.471 -3.260 -99.200 -91.000 TYR 129 0.840 35.380 8.473 5.774 -99.200 -91.000