============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 30 rings ring int. center anis. iso. HIS 2 0.900 171.991 -13.384 25.509 -99.200 -91.000 TRP 17 1.040 135.673 6.626 50.590 -99.200 -91.000 TRP6 17 1.020 135.676 5.024 48.848 -99.200 -91.000 TYR 26 0.840 154.205 7.266 54.228 -99.200 -91.000 HIS 27 0.900 147.623 11.458 55.902 -99.200 -91.000 TYR 33 0.840 145.928 0.369 45.151 -99.200 -91.000 PHE 38 1.000 148.745 5.409 29.808 -99.200 -91.000 TYR 39 0.840 149.919 -2.441 29.244 -99.200 -91.000 TYR 43 0.840 162.217 -1.817 24.861 -99.200 -91.000 TYR 65 0.840 170.759 3.867 41.118 -99.200 -91.000 PHE 71 1.000 167.230 -8.397 44.121 -99.200 -91.000 TYR 81 0.840 170.001 -8.213 34.740 -99.200 -91.000 PHE 84 1.000 165.466 4.804 27.479 -99.200 -91.000 PHE 135 1.000 146.821 -2.941 41.717 -99.200 -91.000 PHE 136 1.000 151.008 -0.493 39.721 -99.200 -91.000 TYR 177 0.840 147.468 10.700 51.063 -99.200 -91.000 HIS 184 0.900 139.499 17.611 53.805 -99.200 -91.000 PHE 185 1.000 141.611 12.714 58.613 -99.200 -91.000 TYR 190 0.840 130.921 7.106 53.516 -99.200 -91.000 TYR 218 0.840 148.832 20.339 42.421 -99.200 -91.000 TYR 225 0.840 134.983 17.043 38.880 -99.200 -91.000 PHE 227 1.000 136.404 20.461 27.461 -99.200 -91.000 TYR 230 0.840 131.156 21.715 26.823 -99.200 -91.000 PHE 233 1.000 130.830 10.920 28.643 -99.200 -91.000 PHE 236 1.000 133.250 8.758 38.655 -99.200 -91.000 TYR 245 0.840 138.645 7.260 37.220 -99.200 -91.000 PHE 246 1.000 135.262 10.803 29.685 -99.200 -91.000 PHE 247 1.000 133.827 4.322 35.176 -99.200 -91.000 TRP 263 1.040 143.988 19.444 29.533 -99.200 -91.000 TRP6 263 1.020 141.659 19.785 29.330 -99.200 -91.000