============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. HIS 22 0.900 20.600 4.259 -0.959 -99.200 -91.000 PHE 24 1.000 15.569 1.387 -2.665 -99.200 -91.000 TRP 32 1.040 11.615 -3.133 -2.801 -99.200 -91.000 TRP6 32 1.020 9.840 -2.105 -1.670 -99.200 -91.000 PHE 35 1.000 9.309 8.825 -3.038 -99.200 -91.000 HIS 47 0.900 13.930 17.215 9.241 -99.200 -91.000 PHE 55 1.000 5.030 9.825 1.503 -99.200 -91.000 TYR 60 0.840 6.230 5.598 -0.673 -99.200 -91.000 TYR 69 0.840 26.407 4.243 13.048 -99.200 -91.000 TRP 70 1.040 26.103 -1.292 13.520 -99.200 -91.000 TRP6 70 1.020 25.632 0.067 15.353 -99.200 -91.000 HIS 79 0.900 20.579 -6.720 4.968 -99.200 -91.000 HIS 81 0.900 21.005 -2.382 2.576 -99.200 -91.000 PHE 86 1.000 6.542 4.431 4.964 -99.200 -91.000 TYR 96 0.840 2.923 7.851 6.383 -99.200 -91.000 TYR 105 0.840 24.600 -9.624 14.926 -99.200 -91.000 TYR 107 0.840 15.390 -3.303 12.579 -99.200 -91.000