============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. TYR 10 0.840 20.531 -2.617 -10.079 -99.200 -91.000 HIS 13 0.900 30.830 -1.305 -14.572 -99.200 -91.000 PHE 22 1.000 26.163 4.038 -17.730 -99.200 -91.000 TYR 26 0.840 14.697 -5.280 -13.061 -99.200 -91.000 PHE 30 1.000 5.993 -2.118 -13.948 -99.200 -91.000 HIS 31 0.900 -0.735 -6.378 -16.131 -99.200 -91.000 HIS 51 0.900 11.903 4.434 -20.817 -99.200 -91.000 PHE 56 1.000 4.761 -9.547 -21.958 -99.200 -91.000 TRP 60 1.040 0.582 -13.661 -18.645 -99.200 -91.000 TRP6 60 1.020 0.939 -13.654 -20.969 -99.200 -91.000 PHE 62 1.000 3.242 -4.858 -18.692 -99.200 -91.000 TYR 63 0.840 11.680 -7.389 -17.969 -99.200 -91.000 TYR 66 0.840 12.419 4.446 -16.010 -99.200 -91.000 TYR 67 0.840 19.897 3.008 -19.479 -99.200 -91.000 PHE 70 1.000 26.175 6.570 -9.605 -99.200 -91.000 TYR 78 0.840 23.922 9.962 -6.952 -99.200 -91.000 HIS 84 0.900 1.665 0.222 -10.867 -99.200 -91.000 TRP 95 1.040 23.508 3.123 -4.986 -99.200 -91.000 TRP6 95 1.020 25.560 4.291 -4.851 -99.200 -91.000