============================================================================= 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. HIS 1 0.900 -1.480 15.285 22.625 -99.200 -91.000 HIS 2 0.900 5.667 16.949 24.075 -99.200 -91.000 HIS 3 0.900 3.505 12.855 21.821 -99.200 -91.000 HIS 4 0.900 -2.728 18.581 17.065 -99.200 -91.000 HIS 5 0.900 0.275 22.562 20.005 -99.200 -91.000 PHE 6 1.000 9.964 19.440 15.772 -99.200 -91.000 TYR 8 0.840 1.197 24.223 15.575 -99.200 -91.000 HIS 28 0.900 11.641 10.356 9.100 -99.200 -91.000 PHE 30 1.000 10.385 21.245 11.194 -99.200 -91.000 TRP 33 1.040 4.864 18.325 14.520 -99.200 -91.000 TRP6 33 1.020 5.338 20.572 14.028 -99.200 -91.000 PHE 35 1.000 5.397 16.129 3.754 -99.200 -91.000 PHE 38 1.000 1.157 21.985 11.301 -99.200 -91.000 TYR 43 0.840 -4.360 23.412 8.935 -99.200 -91.000 PHE 47 1.000 3.826 33.137 6.235 -99.200 -91.000 PHE 59 1.000 20.447 13.405 6.162 -99.200 -91.000 PHE 77 1.000 3.038 32.467 0.222 -99.200 -91.000 PHE 78 1.000 8.182 25.944 2.370 -99.200 -91.000 TYR 103 0.840 7.942 36.975 1.409 -99.200 -91.000